Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:15:12 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./FeO2.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 35 20 6 2553 1122 184 Max 36 21 7 2566 1141 195 Sum 1277 741 225 92087 40715 6753 bravais-lattice index = 14 lattice parameter (alat) = 5.7126 a.u. unit-cell volume = 935.5844 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 80.00 number of Kohn-Sham states= 96 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.712642 celldm(2)= 1.523255 celldm(3)= 3.294575 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.523255 0.000000 ) a(3) = ( 0.000000 0.000000 3.294575 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.656489 -0.000000 ) b(3) = ( 0.000000 0.000000 0.303529 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Fe 8.00 55.84500 Fe( 1.00) 8 Sym. Ops., with inversion, found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.7616275 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.6472875 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.7616275 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.6472875 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.7616275 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 1.6472875 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.7616275 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.6472875 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] C2' -C2' 3 -3 180 deg rotation - cart. axis [0,1,0] C2'' -C2'' 4 -4 180 deg rotation - cart. axis [1,0,0] i 5 inversion -i -5 inversion E s_v -s_v 6 -6 inv. 180 deg rotation - cart. axis [0,0,1] s_v'-s_v' 7 -7 inv. 180 deg rotation - cart. axis [0,1,0] s_v''-s_v' 8 -8 inv. 180 deg rotation - cart. axis [1,0,0] Cartesian axes number of k points= 424 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023585 k( 2) = ( 0.0096154 -0.0000000 -0.0000000), wk = 0.0023585 k( 3) = ( 0.0192308 -0.0000000 -0.0000000), wk = 0.0023585 k( 4) = ( 0.0288462 -0.0000000 -0.0000000), wk = 0.0023585 k( 5) = ( 0.0384615 -0.0000000 -0.0000000), wk = 0.0023585 k( 6) = ( 0.0480769 -0.0000000 -0.0000000), wk = 0.0023585 k( 7) = ( 0.0576923 -0.0000000 -0.0000000), wk = 0.0023585 k( 8) = ( 0.0673077 -0.0000000 -0.0000000), wk = 0.0023585 k( 9) = ( 0.0769231 -0.0000000 -0.0000000), wk = 0.0023585 k( 10) = ( 0.0865385 -0.0000000 -0.0000000), wk = 0.0023585 k( 11) = ( 0.0961538 -0.0000000 -0.0000000), wk = 0.0023585 k( 12) = ( 0.1057692 -0.0000000 -0.0000000), wk = 0.0023585 k( 13) = ( 0.1153846 -0.0000000 -0.0000000), wk = 0.0023585 k( 14) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0023585 k( 15) = ( 0.1346154 -0.0000000 -0.0000000), wk = 0.0023585 k( 16) = ( 0.1442308 -0.0000000 -0.0000000), wk = 0.0023585 k( 17) = ( 0.1538461 -0.0000000 -0.0000000), wk = 0.0023585 k( 18) = ( 0.1634615 -0.0000000 -0.0000000), wk = 0.0023585 k( 19) = ( 0.1730769 -0.0000000 -0.0000000), wk = 0.0023585 k( 20) = ( 0.1826923 -0.0000000 -0.0000000), wk = 0.0023585 k( 21) = ( 0.1923077 -0.0000000 -0.0000000), wk = 0.0023585 k( 22) = ( 0.2019231 -0.0000000 -0.0000000), wk = 0.0023585 k( 23) = ( 0.2115385 -0.0000000 -0.0000000), wk = 0.0023585 k( 24) = ( 0.2211539 -0.0000000 -0.0000000), wk = 0.0023585 k( 25) = ( 0.2307692 -0.0000000 -0.0000000), wk = 0.0023585 k( 26) = ( 0.2403846 -0.0000000 -0.0000000), wk = 0.0023585 k( 27) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0023585 k( 28) = ( 0.2596154 -0.0000000 -0.0000000), wk = 0.0023585 k( 29) = ( 0.2692308 -0.0000000 -0.0000000), wk = 0.0023585 k( 30) = ( 0.2788462 -0.0000000 -0.0000000), wk = 0.0023585 k( 31) = ( 0.2884615 -0.0000000 -0.0000000), wk = 0.0023585 k( 32) = ( 0.2980769 -0.0000000 -0.0000000), wk = 0.0023585 k( 33) = ( 0.3076923 -0.0000000 -0.0000000), wk = 0.0023585 k( 34) = ( 0.3173077 -0.0000000 -0.0000000), wk = 0.0023585 k( 35) = ( 0.3269231 -0.0000000 -0.0000000), wk = 0.0023585 k( 36) = ( 0.3365385 -0.0000000 -0.0000000), wk = 0.0023585 k( 37) = ( 0.3461538 -0.0000000 -0.0000000), wk = 0.0023585 k( 38) = ( 0.3557692 -0.0000000 -0.0000000), wk = 0.0023585 k( 39) = ( 0.3653846 -0.0000000 -0.0000000), wk = 0.0023585 k( 40) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0023585 k( 41) = ( 0.3846154 -0.0000000 -0.0000000), wk = 0.0023585 k( 42) = ( 0.3942308 -0.0000000 -0.0000000), wk = 0.0023585 k( 43) = ( 0.4038462 -0.0000000 -0.0000000), wk = 0.0023585 k( 44) = ( 0.4134615 -0.0000000 -0.0000000), wk = 0.0023585 k( 45) = ( 0.4230769 -0.0000000 -0.0000000), wk = 0.0023585 k( 46) = ( 0.4326923 -0.0000000 -0.0000000), wk = 0.0023585 k( 47) = ( 0.4423077 -0.0000000 -0.0000000), wk = 0.0023585 k( 48) = ( 0.4519231 -0.0000000 -0.0000000), wk = 0.0023585 k( 49) = ( 0.4615385 -0.0000000 -0.0000000), wk = 0.0023585 k( 50) = ( 0.4711538 -0.0000000 -0.0000000), wk = 0.0023585 k( 51) = ( 0.4807692 -0.0000000 -0.0000000), wk = 0.0023585 k( 52) = ( 0.4903846 -0.0000000 -0.0000000), wk = 0.0023585 k( 53) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023585 k( 54) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023585 k( 55) = ( 0.5000000 0.0093784 -0.0000000), wk = 0.0023585 k( 56) = ( 0.5000000 0.0187568 -0.0000000), wk = 0.0023585 k( 57) = ( 0.5000000 0.0281352 -0.0000000), wk = 0.0023585 k( 58) = ( 0.5000000 0.0375137 -0.0000000), wk = 0.0023585 k( 59) = ( 0.5000000 0.0468921 -0.0000000), wk = 0.0023585 k( 60) = ( 0.5000000 0.0562705 -0.0000000), wk = 0.0023585 k( 61) = ( 0.5000000 0.0656489 -0.0000000), wk = 0.0023585 k( 62) = ( 0.5000000 0.0750273 -0.0000000), wk = 0.0023585 k( 63) = ( 0.5000000 0.0844057 -0.0000000), wk = 0.0023585 k( 64) = ( 0.5000000 0.0937841 -0.0000000), wk = 0.0023585 k( 65) = ( 0.5000000 0.1031625 -0.0000000), wk = 0.0023585 k( 66) = ( 0.5000000 0.1125410 -0.0000000), wk = 0.0023585 k( 67) = ( 0.5000000 0.1219194 -0.0000000), wk = 0.0023585 k( 68) = ( 0.5000000 0.1312978 -0.0000000), wk = 0.0023585 k( 69) = ( 0.5000000 0.1406762 -0.0000000), wk = 0.0023585 k( 70) = ( 0.5000000 0.1500546 -0.0000000), wk = 0.0023585 k( 71) = ( 0.5000000 0.1594330 -0.0000000), wk = 0.0023585 k( 72) = ( 0.5000000 0.1688114 -0.0000000), wk = 0.0023585 k( 73) = ( 0.5000000 0.1781898 -0.0000000), wk = 0.0023585 k( 74) = ( 0.5000000 0.1875683 -0.0000000), wk = 0.0023585 k( 75) = ( 0.5000000 0.1969467 -0.0000000), wk = 0.0023585 k( 76) = ( 0.5000000 0.2063251 -0.0000000), wk = 0.0023585 k( 77) = ( 0.5000000 0.2157035 -0.0000000), wk = 0.0023585 k( 78) = ( 0.5000000 0.2250819 -0.0000000), wk = 0.0023585 k( 79) = ( 0.5000000 0.2344603 -0.0000000), wk = 0.0023585 k( 80) = ( 0.5000000 0.2438387 -0.0000000), wk = 0.0023585 k( 81) = ( 0.5000000 0.2532171 -0.0000000), wk = 0.0023585 k( 82) = ( 0.5000000 0.2625956 -0.0000000), wk = 0.0023585 k( 83) = ( 0.5000000 0.2719740 -0.0000000), wk = 0.0023585 k( 84) = ( 0.5000000 0.2813524 -0.0000000), wk = 0.0023585 k( 85) = ( 0.5000000 0.2907308 -0.0000000), wk = 0.0023585 k( 86) = ( 0.5000000 0.3001092 -0.0000000), wk = 0.0023585 k( 87) = ( 0.5000000 0.3094876 -0.0000000), wk = 0.0023585 k( 88) = ( 0.5000000 0.3188660 -0.0000000), wk = 0.0023585 k( 89) = ( 0.5000000 0.3282444 -0.0000000), wk = 0.0023585 k( 90) = ( 0.5000000 0.3282444 -0.0000000), wk = 0.0023585 k( 91) = ( 0.4903846 0.3282444 -0.0000000), wk = 0.0023585 k( 92) = ( 0.4807692 0.3282444 -0.0000000), wk = 0.0023585 k( 93) = ( 0.4711538 0.3282444 -0.0000000), wk = 0.0023585 k( 94) = ( 0.4615385 0.3282444 -0.0000000), wk = 0.0023585 k( 95) = ( 0.4519231 0.3282444 -0.0000000), wk = 0.0023585 k( 96) = ( 0.4423077 0.3282444 -0.0000000), wk = 0.0023585 k( 97) = ( 0.4326923 0.3282444 -0.0000000), wk = 0.0023585 k( 98) = ( 0.4230769 0.3282444 -0.0000000), wk = 0.0023585 k( 99) = ( 0.4134615 0.3282444 -0.0000000), wk = 0.0023585 k( 100) = ( 0.4038462 0.3282444 -0.0000000), wk = 0.0023585 k( 101) = ( 0.3942308 0.3282444 -0.0000000), wk = 0.0023585 k( 102) = ( 0.3846154 0.3282444 -0.0000000), wk = 0.0023585 k( 103) = ( 0.3750000 0.3282444 -0.0000000), wk = 0.0023585 k( 104) = ( 0.3653846 0.3282444 -0.0000000), wk = 0.0023585 k( 105) = ( 0.3557692 0.3282444 -0.0000000), wk = 0.0023585 k( 106) = ( 0.3461538 0.3282444 -0.0000000), wk = 0.0023585 k( 107) = ( 0.3365385 0.3282444 -0.0000000), wk = 0.0023585 k( 108) = ( 0.3269231 0.3282444 -0.0000000), wk = 0.0023585 k( 109) = ( 0.3173077 0.3282444 -0.0000000), wk = 0.0023585 k( 110) = ( 0.3076923 0.3282444 -0.0000000), wk = 0.0023585 k( 111) = ( 0.2980769 0.3282444 -0.0000000), wk = 0.0023585 k( 112) = ( 0.2884615 0.3282444 -0.0000000), wk = 0.0023585 k( 113) = ( 0.2788462 0.3282444 -0.0000000), wk = 0.0023585 k( 114) = ( 0.2692308 0.3282444 -0.0000000), wk = 0.0023585 k( 115) = ( 0.2596154 0.3282444 -0.0000000), wk = 0.0023585 k( 116) = ( 0.2500000 0.3282444 -0.0000000), wk = 0.0023585 k( 117) = ( 0.2403846 0.3282444 -0.0000000), wk = 0.0023585 k( 118) = ( 0.2307692 0.3282444 -0.0000000), wk = 0.0023585 k( 119) = ( 0.2211539 0.3282444 -0.0000000), wk = 0.0023585 k( 120) = ( 0.2115385 0.3282444 -0.0000000), wk = 0.0023585 k( 121) = ( 0.2019231 0.3282444 -0.0000000), wk = 0.0023585 k( 122) = ( 0.1923077 0.3282444 -0.0000000), wk = 0.0023585 k( 123) = ( 0.1826923 0.3282444 -0.0000000), wk = 0.0023585 k( 124) = ( 0.1730769 0.3282444 -0.0000000), wk = 0.0023585 k( 125) = ( 0.1634615 0.3282444 -0.0000000), wk = 0.0023585 k( 126) = ( 0.1538461 0.3282444 -0.0000000), wk = 0.0023585 k( 127) = ( 0.1442308 0.3282444 -0.0000000), wk = 0.0023585 k( 128) = ( 0.1346154 0.3282444 -0.0000000), wk = 0.0023585 k( 129) = ( 0.1250000 0.3282444 -0.0000000), wk = 0.0023585 k( 130) = ( 0.1153846 0.3282444 -0.0000000), wk = 0.0023585 k( 131) = ( 0.1057692 0.3282444 -0.0000000), wk = 0.0023585 k( 132) = ( 0.0961538 0.3282444 -0.0000000), wk = 0.0023585 k( 133) = ( 0.0865385 0.3282444 -0.0000000), wk = 0.0023585 k( 134) = ( 0.0769231 0.3282444 -0.0000000), wk = 0.0023585 k( 135) = ( 0.0673077 0.3282444 -0.0000000), wk = 0.0023585 k( 136) = ( 0.0576923 0.3282444 -0.0000000), wk = 0.0023585 k( 137) = ( 0.0480769 0.3282444 -0.0000000), wk = 0.0023585 k( 138) = ( 0.0384615 0.3282444 -0.0000000), wk = 0.0023585 k( 139) = ( 0.0288462 0.3282444 -0.0000000), wk = 0.0023585 k( 140) = ( 0.0192308 0.3282444 -0.0000000), wk = 0.0023585 k( 141) = ( 0.0096154 0.3282444 -0.0000000), wk = 0.0023585 k( 142) = ( 0.0000000 0.3282444 -0.0000000), wk = 0.0023585 k( 143) = ( 0.0000000 0.3282444 -0.0000000), wk = 0.0023585 k( 144) = ( 0.0000000 0.3188660 -0.0000000), wk = 0.0023585 k( 145) = ( 0.0000000 0.3094876 -0.0000000), wk = 0.0023585 k( 146) = ( 0.0000000 0.3001092 -0.0000000), wk = 0.0023585 k( 147) = ( 0.0000000 0.2907308 -0.0000000), wk = 0.0023585 k( 148) = ( 0.0000000 0.2813524 -0.0000000), wk = 0.0023585 k( 149) = ( 0.0000000 0.2719740 -0.0000000), wk = 0.0023585 k( 150) = ( 0.0000000 0.2625956 -0.0000000), wk = 0.0023585 k( 151) = ( 0.0000000 0.2532171 -0.0000000), wk = 0.0023585 k( 152) = ( 0.0000000 0.2438387 -0.0000000), wk = 0.0023585 k( 153) = ( 0.0000000 0.2344603 -0.0000000), wk = 0.0023585 k( 154) = ( 0.0000000 0.2250819 -0.0000000), wk = 0.0023585 k( 155) = ( 0.0000000 0.2157035 -0.0000000), wk = 0.0023585 k( 156) = ( 0.0000000 0.2063251 -0.0000000), wk = 0.0023585 k( 157) = ( 0.0000000 0.1969467 -0.0000000), wk = 0.0023585 k( 158) = ( 0.0000000 0.1875683 -0.0000000), wk = 0.0023585 k( 159) = ( 0.0000000 0.1781898 -0.0000000), wk = 0.0023585 k( 160) = ( 0.0000000 0.1688114 -0.0000000), wk = 0.0023585 k( 161) = ( 0.0000000 0.1594330 -0.0000000), wk = 0.0023585 k( 162) = ( 0.0000000 0.1500546 -0.0000000), wk = 0.0023585 k( 163) = ( 0.0000000 0.1406762 -0.0000000), wk = 0.0023585 k( 164) = ( 0.0000000 0.1312978 -0.0000000), wk = 0.0023585 k( 165) = ( 0.0000000 0.1219194 -0.0000000), wk = 0.0023585 k( 166) = ( 0.0000000 0.1125410 -0.0000000), wk = 0.0023585 k( 167) = ( 0.0000000 0.1031625 -0.0000000), wk = 0.0023585 k( 168) = ( 0.0000000 0.0937841 -0.0000000), wk = 0.0023585 k( 169) = ( 0.0000000 0.0844057 -0.0000000), wk = 0.0023585 k( 170) = ( 0.0000000 0.0750273 -0.0000000), wk = 0.0023585 k( 171) = ( 0.0000000 0.0656489 -0.0000000), wk = 0.0023585 k( 172) = ( 0.0000000 0.0562705 -0.0000000), wk = 0.0023585 k( 173) = ( 0.0000000 0.0468921 -0.0000000), wk = 0.0023585 k( 174) = ( 0.0000000 0.0375137 -0.0000000), wk = 0.0023585 k( 175) = ( 0.0000000 0.0281352 -0.0000000), wk = 0.0023585 k( 176) = ( 0.0000000 0.0187568 -0.0000000), wk = 0.0023585 k( 177) = ( 0.0000000 0.0093784 -0.0000000), wk = 0.0023585 k( 178) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023585 k( 179) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023585 k( 180) = ( 0.0000000 0.0000000 0.0094853), wk = 0.0023585 k( 181) = ( 0.0000000 0.0000000 0.0189706), wk = 0.0023585 k( 182) = ( 0.0000000 0.0000000 0.0284559), wk = 0.0023585 k( 183) = ( 0.0000000 0.0000000 0.0379412), wk = 0.0023585 k( 184) = ( 0.0000000 0.0000000 0.0474265), wk = 0.0023585 k( 185) = ( 0.0000000 0.0000000 0.0569117), wk = 0.0023585 k( 186) = ( 0.0000000 0.0000000 0.0663970), wk = 0.0023585 k( 187) = ( 0.0000000 0.0000000 0.0758823), wk = 0.0023585 k( 188) = ( 0.0000000 0.0000000 0.0853676), wk = 0.0023585 k( 189) = ( 0.0000000 0.0000000 0.0948529), wk = 0.0023585 k( 190) = ( 0.0000000 0.0000000 0.1043382), wk = 0.0023585 k( 191) = ( 0.0000000 0.0000000 0.1138235), wk = 0.0023585 k( 192) = ( 0.0000000 0.0000000 0.1233088), wk = 0.0023585 k( 193) = ( 0.0000000 0.0000000 0.1327941), wk = 0.0023585 k( 194) = ( 0.0000000 0.0000000 0.1422794), wk = 0.0023585 k( 195) = ( 0.0000000 0.0000000 0.1517646), wk = 0.0023585 k( 196) = ( 0.0000000 0.0000000 0.1517646), wk = 0.0023585 k( 197) = ( 0.0096154 -0.0000000 0.1517646), wk = 0.0023585 k( 198) = ( 0.0192308 -0.0000000 0.1517646), wk = 0.0023585 k( 199) = ( 0.0288462 -0.0000000 0.1517646), wk = 0.0023585 k( 200) = ( 0.0384615 -0.0000000 0.1517646), wk = 0.0023585 k( 201) = ( 0.0480769 -0.0000000 0.1517646), wk = 0.0023585 k( 202) = ( 0.0576923 -0.0000000 0.1517646), wk = 0.0023585 k( 203) = ( 0.0673077 -0.0000000 0.1517646), wk = 0.0023585 k( 204) = ( 0.0769231 -0.0000000 0.1517646), wk = 0.0023585 k( 205) = ( 0.0865385 -0.0000000 0.1517646), wk = 0.0023585 k( 206) = ( 0.0961538 -0.0000000 0.1517646), wk = 0.0023585 k( 207) = ( 0.1057692 -0.0000000 0.1517646), wk = 0.0023585 k( 208) = ( 0.1153846 -0.0000000 0.1517646), wk = 0.0023585 k( 209) = ( 0.1250000 -0.0000000 0.1517646), wk = 0.0023585 k( 210) = ( 0.1346154 -0.0000000 0.1517646), wk = 0.0023585 k( 211) = ( 0.1442308 -0.0000000 0.1517646), wk = 0.0023585 k( 212) = ( 0.1538461 -0.0000000 0.1517646), wk = 0.0023585 k( 213) = ( 0.1634615 -0.0000000 0.1517646), wk = 0.0023585 k( 214) = ( 0.1730769 -0.0000000 0.1517646), wk = 0.0023585 k( 215) = ( 0.1826923 -0.0000000 0.1517646), wk = 0.0023585 k( 216) = ( 0.1923077 -0.0000000 0.1517646), wk = 0.0023585 k( 217) = ( 0.2019231 -0.0000000 0.1517646), wk = 0.0023585 k( 218) = ( 0.2115385 -0.0000000 0.1517646), wk = 0.0023585 k( 219) = ( 0.2211539 -0.0000000 0.1517646), wk = 0.0023585 k( 220) = ( 0.2307692 -0.0000000 0.1517646), wk = 0.0023585 k( 221) = ( 0.2403846 -0.0000000 0.1517646), wk = 0.0023585 k( 222) = ( 0.2500000 -0.0000000 0.1517646), wk = 0.0023585 k( 223) = ( 0.2596154 -0.0000000 0.1517646), wk = 0.0023585 k( 224) = ( 0.2692308 -0.0000000 0.1517646), wk = 0.0023585 k( 225) = ( 0.2788462 -0.0000000 0.1517646), wk = 0.0023585 k( 226) = ( 0.2884615 -0.0000000 0.1517646), wk = 0.0023585 k( 227) = ( 0.2980769 -0.0000000 0.1517646), wk = 0.0023585 k( 228) = ( 0.3076923 -0.0000000 0.1517646), wk = 0.0023585 k( 229) = ( 0.3173077 -0.0000000 0.1517646), wk = 0.0023585 k( 230) = ( 0.3269231 -0.0000000 0.1517646), wk = 0.0023585 k( 231) = ( 0.3365385 -0.0000000 0.1517646), wk = 0.0023585 k( 232) = ( 0.3461538 -0.0000000 0.1517646), wk = 0.0023585 k( 233) = ( 0.3557692 -0.0000000 0.1517646), wk = 0.0023585 k( 234) = ( 0.3653846 -0.0000000 0.1517646), wk = 0.0023585 k( 235) = ( 0.3750000 -0.0000000 0.1517646), wk = 0.0023585 k( 236) = ( 0.3846154 -0.0000000 0.1517646), wk = 0.0023585 k( 237) = ( 0.3942308 -0.0000000 0.1517646), wk = 0.0023585 k( 238) = ( 0.4038462 -0.0000000 0.1517646), wk = 0.0023585 k( 239) = ( 0.4134615 -0.0000000 0.1517646), wk = 0.0023585 k( 240) = ( 0.4230769 -0.0000000 0.1517646), wk = 0.0023585 k( 241) = ( 0.4326923 -0.0000000 0.1517646), wk = 0.0023585 k( 242) = ( 0.4423077 -0.0000000 0.1517646), wk = 0.0023585 k( 243) = ( 0.4519231 -0.0000000 0.1517646), wk = 0.0023585 k( 244) = ( 0.4615385 -0.0000000 0.1517646), wk = 0.0023585 k( 245) = ( 0.4711538 -0.0000000 0.1517646), wk = 0.0023585 k( 246) = ( 0.4807692 -0.0000000 0.1517646), wk = 0.0023585 k( 247) = ( 0.4903846 -0.0000000 0.1517646), wk = 0.0023585 k( 248) = ( 0.5000000 -0.0000000 0.1517646), wk = 0.0023585 k( 249) = ( 0.5000000 -0.0000000 0.1517646), wk = 0.0023585 k( 250) = ( 0.5000000 0.0093784 0.1517646), wk = 0.0023585 k( 251) = ( 0.5000000 0.0187568 0.1517646), wk = 0.0023585 k( 252) = ( 0.5000000 0.0281352 0.1517646), wk = 0.0023585 k( 253) = ( 0.5000000 0.0375137 0.1517646), wk = 0.0023585 k( 254) = ( 0.5000000 0.0468921 0.1517646), wk = 0.0023585 k( 255) = ( 0.5000000 0.0562705 0.1517646), wk = 0.0023585 k( 256) = ( 0.5000000 0.0656489 0.1517646), wk = 0.0023585 k( 257) = ( 0.5000000 0.0750273 0.1517646), wk = 0.0023585 k( 258) = ( 0.5000000 0.0844057 0.1517646), wk = 0.0023585 k( 259) = ( 0.5000000 0.0937841 0.1517646), wk = 0.0023585 k( 260) = ( 0.5000000 0.1031625 0.1517646), wk = 0.0023585 k( 261) = ( 0.5000000 0.1125410 0.1517646), wk = 0.0023585 k( 262) = ( 0.5000000 0.1219194 0.1517646), wk = 0.0023585 k( 263) = ( 0.5000000 0.1312978 0.1517646), wk = 0.0023585 k( 264) = ( 0.5000000 0.1406762 0.1517646), wk = 0.0023585 k( 265) = ( 0.5000000 0.1500546 0.1517646), wk = 0.0023585 k( 266) = ( 0.5000000 0.1594330 0.1517646), wk = 0.0023585 k( 267) = ( 0.5000000 0.1688114 0.1517646), wk = 0.0023585 k( 268) = ( 0.5000000 0.1781898 0.1517646), wk = 0.0023585 k( 269) = ( 0.5000000 0.1875683 0.1517646), wk = 0.0023585 k( 270) = ( 0.5000000 0.1969467 0.1517646), wk = 0.0023585 k( 271) = ( 0.5000000 0.2063251 0.1517646), wk = 0.0023585 k( 272) = ( 0.5000000 0.2157035 0.1517646), wk = 0.0023585 k( 273) = ( 0.5000000 0.2250819 0.1517646), wk = 0.0023585 k( 274) = ( 0.5000000 0.2344603 0.1517646), wk = 0.0023585 k( 275) = ( 0.5000000 0.2438387 0.1517646), wk = 0.0023585 k( 276) = ( 0.5000000 0.2532171 0.1517646), wk = 0.0023585 k( 277) = ( 0.5000000 0.2625956 0.1517646), wk = 0.0023585 k( 278) = ( 0.5000000 0.2719740 0.1517646), wk = 0.0023585 k( 279) = ( 0.5000000 0.2813524 0.1517646), wk = 0.0023585 k( 280) = ( 0.5000000 0.2907308 0.1517646), wk = 0.0023585 k( 281) = ( 0.5000000 0.3001092 0.1517646), wk = 0.0023585 k( 282) = ( 0.5000000 0.3094876 0.1517646), wk = 0.0023585 k( 283) = ( 0.5000000 0.3188660 0.1517646), wk = 0.0023585 k( 284) = ( 0.5000000 0.3282444 0.1517646), wk = 0.0023585 k( 285) = ( 0.5000000 0.3282444 0.1517646), wk = 0.0023585 k( 286) = ( 0.4903846 0.3282444 0.1517646), wk = 0.0023585 k( 287) = ( 0.4807692 0.3282444 0.1517646), wk = 0.0023585 k( 288) = ( 0.4711538 0.3282444 0.1517646), wk = 0.0023585 k( 289) = ( 0.4615385 0.3282444 0.1517646), wk = 0.0023585 k( 290) = ( 0.4519231 0.3282444 0.1517646), wk = 0.0023585 k( 291) = ( 0.4423077 0.3282444 0.1517646), wk = 0.0023585 k( 292) = ( 0.4326923 0.3282444 0.1517646), wk = 0.0023585 k( 293) = ( 0.4230769 0.3282444 0.1517646), wk = 0.0023585 k( 294) = ( 0.4134615 0.3282444 0.1517646), wk = 0.0023585 k( 295) = ( 0.4038462 0.3282444 0.1517646), wk = 0.0023585 k( 296) = ( 0.3942308 0.3282444 0.1517646), wk = 0.0023585 k( 297) = ( 0.3846154 0.3282444 0.1517646), wk = 0.0023585 k( 298) = ( 0.3750000 0.3282444 0.1517646), wk = 0.0023585 k( 299) = ( 0.3653846 0.3282444 0.1517646), wk = 0.0023585 k( 300) = ( 0.3557692 0.3282444 0.1517646), wk = 0.0023585 k( 301) = ( 0.3461538 0.3282444 0.1517646), wk = 0.0023585 k( 302) = ( 0.3365385 0.3282444 0.1517646), wk = 0.0023585 k( 303) = ( 0.3269231 0.3282444 0.1517646), wk = 0.0023585 k( 304) = ( 0.3173077 0.3282444 0.1517646), wk = 0.0023585 k( 305) = ( 0.3076923 0.3282444 0.1517646), wk = 0.0023585 k( 306) = ( 0.2980769 0.3282444 0.1517646), wk = 0.0023585 k( 307) = ( 0.2884615 0.3282444 0.1517646), wk = 0.0023585 k( 308) = ( 0.2788462 0.3282444 0.1517646), wk = 0.0023585 k( 309) = ( 0.2692308 0.3282444 0.1517646), wk = 0.0023585 k( 310) = ( 0.2596154 0.3282444 0.1517646), wk = 0.0023585 k( 311) = ( 0.2500000 0.3282444 0.1517646), wk = 0.0023585 k( 312) = ( 0.2403846 0.3282444 0.1517646), wk = 0.0023585 k( 313) = ( 0.2307692 0.3282444 0.1517646), wk = 0.0023585 k( 314) = ( 0.2211539 0.3282444 0.1517646), wk = 0.0023585 k( 315) = ( 0.2115385 0.3282444 0.1517646), wk = 0.0023585 k( 316) = ( 0.2019231 0.3282444 0.1517646), wk = 0.0023585 k( 317) = ( 0.1923077 0.3282444 0.1517646), wk = 0.0023585 k( 318) = ( 0.1826923 0.3282444 0.1517646), wk = 0.0023585 k( 319) = ( 0.1730769 0.3282444 0.1517646), wk = 0.0023585 k( 320) = ( 0.1634615 0.3282444 0.1517646), wk = 0.0023585 k( 321) = ( 0.1538461 0.3282444 0.1517646), wk = 0.0023585 k( 322) = ( 0.1442308 0.3282444 0.1517646), wk = 0.0023585 k( 323) = ( 0.1346154 0.3282444 0.1517646), wk = 0.0023585 k( 324) = ( 0.1250000 0.3282444 0.1517646), wk = 0.0023585 k( 325) = ( 0.1153846 0.3282444 0.1517646), wk = 0.0023585 k( 326) = ( 0.1057692 0.3282444 0.1517646), wk = 0.0023585 k( 327) = ( 0.0961538 0.3282444 0.1517646), wk = 0.0023585 k( 328) = ( 0.0865385 0.3282444 0.1517646), wk = 0.0023585 k( 329) = ( 0.0769231 0.3282444 0.1517646), wk = 0.0023585 k( 330) = ( 0.0673077 0.3282444 0.1517646), wk = 0.0023585 k( 331) = ( 0.0576923 0.3282444 0.1517646), wk = 0.0023585 k( 332) = ( 0.0480769 0.3282444 0.1517646), wk = 0.0023585 k( 333) = ( 0.0384615 0.3282444 0.1517646), wk = 0.0023585 k( 334) = ( 0.0288462 0.3282444 0.1517646), wk = 0.0023585 k( 335) = ( 0.0192308 0.3282444 0.1517646), wk = 0.0023585 k( 336) = ( 0.0096154 0.3282444 0.1517646), wk = 0.0023585 k( 337) = ( 0.0000000 0.3282444 0.1517646), wk = 0.0023585 k( 338) = ( 0.0000000 0.3282444 0.1517646), wk = 0.0023585 k( 339) = ( 0.0000000 0.3188660 0.1517646), wk = 0.0023585 k( 340) = ( 0.0000000 0.3094876 0.1517646), wk = 0.0023585 k( 341) = ( 0.0000000 0.3001092 0.1517646), wk = 0.0023585 k( 342) = ( 0.0000000 0.2907308 0.1517646), wk = 0.0023585 k( 343) = ( 0.0000000 0.2813524 0.1517646), wk = 0.0023585 k( 344) = ( 0.0000000 0.2719740 0.1517646), wk = 0.0023585 k( 345) = ( 0.0000000 0.2625956 0.1517646), wk = 0.0023585 k( 346) = ( 0.0000000 0.2532171 0.1517646), wk = 0.0023585 k( 347) = ( 0.0000000 0.2438387 0.1517646), wk = 0.0023585 k( 348) = ( 0.0000000 0.2344603 0.1517646), wk = 0.0023585 k( 349) = ( 0.0000000 0.2250819 0.1517646), wk = 0.0023585 k( 350) = ( 0.0000000 0.2157035 0.1517646), wk = 0.0023585 k( 351) = ( 0.0000000 0.2063251 0.1517646), wk = 0.0023585 k( 352) = ( 0.0000000 0.1969467 0.1517646), wk = 0.0023585 k( 353) = ( 0.0000000 0.1875683 0.1517646), wk = 0.0023585 k( 354) = ( 0.0000000 0.1781898 0.1517646), wk = 0.0023585 k( 355) = ( 0.0000000 0.1688114 0.1517646), wk = 0.0023585 k( 356) = ( 0.0000000 0.1594330 0.1517646), wk = 0.0023585 k( 357) = ( 0.0000000 0.1500546 0.1517646), wk = 0.0023585 k( 358) = ( 0.0000000 0.1406762 0.1517646), wk = 0.0023585 k( 359) = ( 0.0000000 0.1312978 0.1517646), wk = 0.0023585 k( 360) = ( 0.0000000 0.1219194 0.1517646), wk = 0.0023585 k( 361) = ( 0.0000000 0.1125410 0.1517646), wk = 0.0023585 k( 362) = ( 0.0000000 0.1031625 0.1517646), wk = 0.0023585 k( 363) = ( 0.0000000 0.0937841 0.1517646), wk = 0.0023585 k( 364) = ( 0.0000000 0.0844057 0.1517646), wk = 0.0023585 k( 365) = ( 0.0000000 0.0750273 0.1517646), wk = 0.0023585 k( 366) = ( 0.0000000 0.0656489 0.1517646), wk = 0.0023585 k( 367) = ( 0.0000000 0.0562705 0.1517646), wk = 0.0023585 k( 368) = ( 0.0000000 0.0468921 0.1517646), wk = 0.0023585 k( 369) = ( 0.0000000 0.0375137 0.1517646), wk = 0.0023585 k( 370) = ( 0.0000000 0.0281352 0.1517646), wk = 0.0023585 k( 371) = ( 0.0000000 0.0187568 0.1517646), wk = 0.0023585 k( 372) = ( 0.0000000 0.0093784 0.1517646), wk = 0.0023585 k( 373) = ( 0.0000000 0.0000000 0.1517646), wk = 0.0023585 k( 374) = ( 0.0000000 0.3282444 -0.0000000), wk = 0.0023585 k( 375) = ( 0.0000000 0.3282444 0.0094853), wk = 0.0023585 k( 376) = ( 0.0000000 0.3282444 0.0189706), wk = 0.0023585 k( 377) = ( 0.0000000 0.3282444 0.0284559), wk = 0.0023585 k( 378) = ( 0.0000000 0.3282444 0.0379412), wk = 0.0023585 k( 379) = ( 0.0000000 0.3282444 0.0474265), wk = 0.0023585 k( 380) = ( 0.0000000 0.3282444 0.0569117), wk = 0.0023585 k( 381) = ( 0.0000000 0.3282444 0.0663970), wk = 0.0023585 k( 382) = ( 0.0000000 0.3282444 0.0758823), wk = 0.0023585 k( 383) = ( 0.0000000 0.3282444 0.0853676), wk = 0.0023585 k( 384) = ( 0.0000000 0.3282444 0.0948529), wk = 0.0023585 k( 385) = ( 0.0000000 0.3282444 0.1043382), wk = 0.0023585 k( 386) = ( 0.0000000 0.3282444 0.1138235), wk = 0.0023585 k( 387) = ( 0.0000000 0.3282444 0.1233088), wk = 0.0023585 k( 388) = ( 0.0000000 0.3282444 0.1327941), wk = 0.0023585 k( 389) = ( 0.0000000 0.3282444 0.1422794), wk = 0.0023585 k( 390) = ( 0.0000000 0.3282444 0.1517646), wk = 0.0023585 k( 391) = ( 0.5000000 -0.0000000 0.1517646), wk = 0.0023585 k( 392) = ( 0.5000000 -0.0000000 0.1422794), wk = 0.0023585 k( 393) = ( 0.5000000 -0.0000000 0.1327941), wk = 0.0023585 k( 394) = ( 0.5000000 -0.0000000 0.1233088), wk = 0.0023585 k( 395) = ( 0.5000000 -0.0000000 0.1138235), wk = 0.0023585 k( 396) = ( 0.5000000 -0.0000000 0.1043382), wk = 0.0023585 k( 397) = ( 0.5000000 -0.0000000 0.0948529), wk = 0.0023585 k( 398) = ( 0.5000000 -0.0000000 0.0853676), wk = 0.0023585 k( 399) = ( 0.5000000 -0.0000000 0.0758823), wk = 0.0023585 k( 400) = ( 0.5000000 -0.0000000 0.0663970), wk = 0.0023585 k( 401) = ( 0.5000000 -0.0000000 0.0569117), wk = 0.0023585 k( 402) = ( 0.5000000 -0.0000000 0.0474265), wk = 0.0023585 k( 403) = ( 0.5000000 -0.0000000 0.0379412), wk = 0.0023585 k( 404) = ( 0.5000000 -0.0000000 0.0284559), wk = 0.0023585 k( 405) = ( 0.5000000 -0.0000000 0.0189706), wk = 0.0023585 k( 406) = ( 0.5000000 -0.0000000 0.0094853), wk = 0.0023585 k( 407) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023585 k( 408) = ( 0.5000000 0.3282444 -0.0000000), wk = 0.0023585 k( 409) = ( 0.5000000 0.3282444 0.0094853), wk = 0.0023585 k( 410) = ( 0.5000000 0.3282444 0.0189706), wk = 0.0023585 k( 411) = ( 0.5000000 0.3282444 0.0284559), wk = 0.0023585 k( 412) = ( 0.5000000 0.3282444 0.0379412), wk = 0.0023585 k( 413) = ( 0.5000000 0.3282444 0.0474265), wk = 0.0023585 k( 414) = ( 0.5000000 0.3282444 0.0569117), wk = 0.0023585 k( 415) = ( 0.5000000 0.3282444 0.0663970), wk = 0.0023585 k( 416) = ( 0.5000000 0.3282444 0.0758823), wk = 0.0023585 k( 417) = ( 0.5000000 0.3282444 0.0853676), wk = 0.0023585 k( 418) = ( 0.5000000 0.3282444 0.0948529), wk = 0.0023585 k( 419) = ( 0.5000000 0.3282444 0.1043382), wk = 0.0023585 k( 420) = ( 0.5000000 0.3282444 0.1138235), wk = 0.0023585 k( 421) = ( 0.5000000 0.3282444 0.1233088), wk = 0.0023585 k( 422) = ( 0.5000000 0.3282444 0.1327941), wk = 0.0023585 k( 423) = ( 0.5000000 0.3282444 0.1422794), wk = 0.0023585 k( 424) = ( 0.5000000 0.3282444 0.1517646), wk = 0.0023585 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023585 k( 2) = ( 0.0096154 -0.0000000 0.0000000), wk = 0.0023585 k( 3) = ( 0.0192308 -0.0000000 -0.0000000), wk = 0.0023585 k( 4) = ( 0.0288462 -0.0000000 0.0000000), wk = 0.0023585 k( 5) = ( 0.0384615 -0.0000000 -0.0000000), wk = 0.0023585 k( 6) = ( 0.0480769 -0.0000000 -0.0000000), wk = 0.0023585 k( 7) = ( 0.0576923 0.0000000 0.0000000), wk = 0.0023585 k( 8) = ( 0.0673077 -0.0000000 0.0000000), wk = 0.0023585 k( 9) = ( 0.0769231 -0.0000000 -0.0000000), wk = 0.0023585 k( 10) = ( 0.0865385 -0.0000000 -0.0000000), wk = 0.0023585 k( 11) = ( 0.0961538 -0.0000000 0.0000000), wk = 0.0023585 k( 12) = ( 0.1057692 -0.0000000 0.0000000), wk = 0.0023585 k( 13) = ( 0.1153846 0.0000000 0.0000000), wk = 0.0023585 k( 14) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0023585 k( 15) = ( 0.1346154 -0.0000000 0.0000000), wk = 0.0023585 k( 16) = ( 0.1442308 -0.0000000 -0.0000000), wk = 0.0023585 k( 17) = ( 0.1538461 -0.0000000 0.0000000), wk = 0.0023585 k( 18) = ( 0.1634615 0.0000000 0.0000000), wk = 0.0023585 k( 19) = ( 0.1730769 -0.0000000 -0.0000000), wk = 0.0023585 k( 20) = ( 0.1826923 -0.0000000 -0.0000000), wk = 0.0023585 k( 21) = ( 0.1923077 -0.0000000 0.0000000), wk = 0.0023585 k( 22) = ( 0.2019231 -0.0000000 0.0000000), wk = 0.0023585 k( 23) = ( 0.2115385 -0.0000000 0.0000000), wk = 0.0023585 k( 24) = ( 0.2211539 -0.0000000 0.0000000), wk = 0.0023585 k( 25) = ( 0.2307692 0.0000000 0.0000000), wk = 0.0023585 k( 26) = ( 0.2403846 0.0000000 0.0000000), wk = 0.0023585 k( 27) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0023585 k( 28) = ( 0.2596154 -0.0000000 0.0000000), wk = 0.0023585 k( 29) = ( 0.2692308 -0.0000000 0.0000000), wk = 0.0023585 k( 30) = ( 0.2788462 -0.0000000 -0.0000000), wk = 0.0023585 k( 31) = ( 0.2884615 -0.0000000 -0.0000000), wk = 0.0023585 k( 32) = ( 0.2980769 -0.0000000 0.0000000), wk = 0.0023585 k( 33) = ( 0.3076923 -0.0000000 0.0000000), wk = 0.0023585 k( 34) = ( 0.3173077 0.0000000 0.0000000), wk = 0.0023585 k( 35) = ( 0.3269231 0.0000000 0.0000000), wk = 0.0023585 k( 36) = ( 0.3365385 0.0000000 0.0000000), wk = 0.0023585 k( 37) = ( 0.3461538 -0.0000000 0.0000000), wk = 0.0023585 k( 38) = ( 0.3557692 -0.0000000 0.0000000), wk = 0.0023585 k( 39) = ( 0.3653846 -0.0000000 -0.0000000), wk = 0.0023585 k( 40) = ( 0.3750000 0.0000000 -0.0000000), wk = 0.0023585 k( 41) = ( 0.3846154 -0.0000000 0.0000000), wk = 0.0023585 k( 42) = ( 0.3942308 0.0000000 0.0000000), wk = 0.0023585 k( 43) = ( 0.4038462 -0.0000000 -0.0000000), wk = 0.0023585 k( 44) = ( 0.4134615 -0.0000000 0.0000000), wk = 0.0023585 k( 45) = ( 0.4230769 -0.0000000 0.0000000), wk = 0.0023585 k( 46) = ( 0.4326923 -0.0000000 0.0000000), wk = 0.0023585 k( 47) = ( 0.4423077 0.0000000 0.0000000), wk = 0.0023585 k( 48) = ( 0.4519231 -0.0000000 0.0000000), wk = 0.0023585 k( 49) = ( 0.4615385 0.0000000 0.0000000), wk = 0.0023585 k( 50) = ( 0.4711538 -0.0000000 0.0000000), wk = 0.0023585 k( 51) = ( 0.4807692 -0.0000000 0.0000000), wk = 0.0023585 k( 52) = ( 0.4903846 -0.0000000 0.0000000), wk = 0.0023585 k( 53) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023585 k( 54) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023585 k( 55) = ( 0.5000000 0.0142857 0.0000000), wk = 0.0023585 k( 56) = ( 0.5000000 0.0285714 0.0000000), wk = 0.0023585 k( 57) = ( 0.5000000 0.0428571 0.0000000), wk = 0.0023585 k( 58) = ( 0.5000000 0.0571429 0.0000000), wk = 0.0023585 k( 59) = ( 0.5000000 0.0714286 0.0000000), wk = 0.0023585 k( 60) = ( 0.5000000 0.0857143 0.0000000), wk = 0.0023585 k( 61) = ( 0.5000000 0.1000000 -0.0000000), wk = 0.0023585 k( 62) = ( 0.5000000 0.1142857 0.0000000), wk = 0.0023585 k( 63) = ( 0.5000000 0.1285714 0.0000000), wk = 0.0023585 k( 64) = ( 0.5000000 0.1428571 -0.0000000), wk = 0.0023585 k( 65) = ( 0.5000000 0.1571429 0.0000000), wk = 0.0023585 k( 66) = ( 0.5000000 0.1714286 0.0000000), wk = 0.0023585 k( 67) = ( 0.5000000 0.1857143 -0.0000000), wk = 0.0023585 k( 68) = ( 0.5000000 0.2000000 0.0000000), wk = 0.0023585 k( 69) = ( 0.5000000 0.2142857 0.0000000), wk = 0.0023585 k( 70) = ( 0.5000000 0.2285714 -0.0000000), wk = 0.0023585 k( 71) = ( 0.5000000 0.2428571 0.0000000), wk = 0.0023585 k( 72) = ( 0.5000000 0.2571429 0.0000000), wk = 0.0023585 k( 73) = ( 0.5000000 0.2714286 -0.0000000), wk = 0.0023585 k( 74) = ( 0.5000000 0.2857143 0.0000000), wk = 0.0023585 k( 75) = ( 0.5000000 0.3000000 0.0000000), wk = 0.0023585 k( 76) = ( 0.5000000 0.3142857 0.0000000), wk = 0.0023585 k( 77) = ( 0.5000000 0.3285714 0.0000000), wk = 0.0023585 k( 78) = ( 0.5000000 0.3428571 -0.0000000), wk = 0.0023585 k( 79) = ( 0.5000000 0.3571429 0.0000000), wk = 0.0023585 k( 80) = ( 0.5000000 0.3714286 -0.0000000), wk = 0.0023585 k( 81) = ( 0.5000000 0.3857143 0.0000000), wk = 0.0023585 k( 82) = ( 0.5000000 0.4000000 0.0000000), wk = 0.0023585 k( 83) = ( 0.5000000 0.4142857 -0.0000000), wk = 0.0023585 k( 84) = ( 0.5000000 0.4285714 0.0000000), wk = 0.0023585 k( 85) = ( 0.5000000 0.4428571 0.0000000), wk = 0.0023585 k( 86) = ( 0.5000000 0.4571429 0.0000000), wk = 0.0023585 k( 87) = ( 0.5000000 0.4714286 0.0000000), wk = 0.0023585 k( 88) = ( 0.5000000 0.4857143 0.0000000), wk = 0.0023585 k( 89) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023585 k( 90) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023585 k( 91) = ( 0.4903846 0.5000000 0.0000000), wk = 0.0023585 k( 92) = ( 0.4807692 0.5000000 -0.0000000), wk = 0.0023585 k( 93) = ( 0.4711538 0.5000000 -0.0000000), wk = 0.0023585 k( 94) = ( 0.4615385 0.5000000 0.0000000), wk = 0.0023585 k( 95) = ( 0.4519231 0.5000000 0.0000000), wk = 0.0023585 k( 96) = ( 0.4423077 0.5000000 -0.0000000), wk = 0.0023585 k( 97) = ( 0.4326923 0.5000000 -0.0000000), wk = 0.0023585 k( 98) = ( 0.4230769 0.5000000 0.0000000), wk = 0.0023585 k( 99) = ( 0.4134615 0.5000000 0.0000000), wk = 0.0023585 k( 100) = ( 0.4038462 0.5000000 -0.0000000), wk = 0.0023585 k( 101) = ( 0.3942308 0.5000000 -0.0000000), wk = 0.0023585 k( 102) = ( 0.3846154 0.5000000 0.0000000), wk = 0.0023585 k( 103) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0023585 k( 104) = ( 0.3653846 0.5000000 -0.0000000), wk = 0.0023585 k( 105) = ( 0.3557692 0.5000000 0.0000000), wk = 0.0023585 k( 106) = ( 0.3461538 0.5000000 0.0000000), wk = 0.0023585 k( 107) = ( 0.3365385 0.5000000 0.0000000), wk = 0.0023585 k( 108) = ( 0.3269231 0.5000000 -0.0000000), wk = 0.0023585 k( 109) = ( 0.3173077 0.5000000 0.0000000), wk = 0.0023585 k( 110) = ( 0.3076923 0.5000000 0.0000000), wk = 0.0023585 k( 111) = ( 0.2980769 0.5000000 -0.0000000), wk = 0.0023585 k( 112) = ( 0.2884615 0.5000000 -0.0000000), wk = 0.0023585 k( 113) = ( 0.2788462 0.5000000 0.0000000), wk = 0.0023585 k( 114) = ( 0.2692308 0.5000000 0.0000000), wk = 0.0023585 k( 115) = ( 0.2596154 0.5000000 -0.0000000), wk = 0.0023585 k( 116) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0023585 k( 117) = ( 0.2403846 0.5000000 0.0000000), wk = 0.0023585 k( 118) = ( 0.2307692 0.5000000 0.0000000), wk = 0.0023585 k( 119) = ( 0.2211539 0.5000000 0.0000000), wk = 0.0023585 k( 120) = ( 0.2115385 0.5000000 0.0000000), wk = 0.0023585 k( 121) = ( 0.2019231 0.5000000 0.0000000), wk = 0.0023585 k( 122) = ( 0.1923077 0.5000000 0.0000000), wk = 0.0023585 k( 123) = ( 0.1826923 0.5000000 0.0000000), wk = 0.0023585 k( 124) = ( 0.1730769 0.5000000 0.0000000), wk = 0.0023585 k( 125) = ( 0.1634615 0.5000000 0.0000000), wk = 0.0023585 k( 126) = ( 0.1538461 0.5000000 0.0000000), wk = 0.0023585 k( 127) = ( 0.1442308 0.5000000 0.0000000), wk = 0.0023585 k( 128) = ( 0.1346154 0.5000000 0.0000000), wk = 0.0023585 k( 129) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0023585 k( 130) = ( 0.1153846 0.5000000 0.0000000), wk = 0.0023585 k( 131) = ( 0.1057692 0.5000000 0.0000000), wk = 0.0023585 k( 132) = ( 0.0961538 0.5000000 0.0000000), wk = 0.0023585 k( 133) = ( 0.0865385 0.5000000 0.0000000), wk = 0.0023585 k( 134) = ( 0.0769231 0.5000000 0.0000000), wk = 0.0023585 k( 135) = ( 0.0673077 0.5000000 -0.0000000), wk = 0.0023585 k( 136) = ( 0.0576923 0.5000000 0.0000000), wk = 0.0023585 k( 137) = ( 0.0480769 0.5000000 0.0000000), wk = 0.0023585 k( 138) = ( 0.0384615 0.5000000 0.0000000), wk = 0.0023585 k( 139) = ( 0.0288462 0.5000000 0.0000000), wk = 0.0023585 k( 140) = ( 0.0192308 0.5000000 0.0000000), wk = 0.0023585 k( 141) = ( 0.0096154 0.5000000 0.0000000), wk = 0.0023585 k( 142) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023585 k( 143) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023585 k( 144) = ( 0.0000000 0.4857143 0.0000000), wk = 0.0023585 k( 145) = ( 0.0000000 0.4714286 0.0000000), wk = 0.0023585 k( 146) = ( 0.0000000 0.4571429 0.0000000), wk = 0.0023585 k( 147) = ( 0.0000000 0.4428571 0.0000000), wk = 0.0023585 k( 148) = ( 0.0000000 0.4285714 0.0000000), wk = 0.0023585 k( 149) = ( 0.0000000 0.4142857 0.0000000), wk = 0.0023585 k( 150) = ( 0.0000000 0.4000000 0.0000000), wk = 0.0023585 k( 151) = ( 0.0000000 0.3857143 0.0000000), wk = 0.0023585 k( 152) = ( 0.0000000 0.3714286 -0.0000000), wk = 0.0023585 k( 153) = ( 0.0000000 0.3571429 0.0000000), wk = 0.0023585 k( 154) = ( 0.0000000 0.3428571 -0.0000000), wk = 0.0023585 k( 155) = ( 0.0000000 0.3285714 0.0000000), wk = 0.0023585 k( 156) = ( 0.0000000 0.3142857 -0.0000000), wk = 0.0023585 k( 157) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0023585 k( 158) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0023585 k( 159) = ( 0.0000000 0.2714286 0.0000000), wk = 0.0023585 k( 160) = ( 0.0000000 0.2571429 -0.0000000), wk = 0.0023585 k( 161) = ( 0.0000000 0.2428571 0.0000000), wk = 0.0023585 k( 162) = ( 0.0000000 0.2285714 0.0000000), wk = 0.0023585 k( 163) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0023585 k( 164) = ( 0.0000000 0.2000000 0.0000000), wk = 0.0023585 k( 165) = ( 0.0000000 0.1857143 -0.0000000), wk = 0.0023585 k( 166) = ( 0.0000000 0.1714286 -0.0000000), wk = 0.0023585 k( 167) = ( 0.0000000 0.1571429 0.0000000), wk = 0.0023585 k( 168) = ( 0.0000000 0.1428571 0.0000000), wk = 0.0023585 k( 169) = ( 0.0000000 0.1285714 -0.0000000), wk = 0.0023585 k( 170) = ( 0.0000000 0.1142857 0.0000000), wk = 0.0023585 k( 171) = ( 0.0000000 0.1000000 0.0000000), wk = 0.0023585 k( 172) = ( 0.0000000 0.0857143 -0.0000000), wk = 0.0023585 k( 173) = ( 0.0000000 0.0714286 0.0000000), wk = 0.0023585 k( 174) = ( 0.0000000 0.0571429 -0.0000000), wk = 0.0023585 k( 175) = ( 0.0000000 0.0428571 0.0000000), wk = 0.0023585 k( 176) = ( 0.0000000 0.0285714 -0.0000000), wk = 0.0023585 k( 177) = ( 0.0000000 0.0142857 -0.0000000), wk = 0.0023585 k( 178) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023585 k( 179) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023585 k( 180) = ( 0.0000000 0.0000000 0.0312500), wk = 0.0023585 k( 181) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0023585 k( 182) = ( 0.0000000 0.0000000 0.0937500), wk = 0.0023585 k( 183) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0023585 k( 184) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0023585 k( 185) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0023585 k( 186) = ( 0.0000000 0.0000000 0.2187500), wk = 0.0023585 k( 187) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0023585 k( 188) = ( 0.0000000 0.0000000 0.2812500), wk = 0.0023585 k( 189) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0023585 k( 190) = ( 0.0000000 0.0000000 0.3437500), wk = 0.0023585 k( 191) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0023585 k( 192) = ( 0.0000000 0.0000000 0.4062500), wk = 0.0023585 k( 193) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0023585 k( 194) = ( 0.0000000 0.0000000 0.4687500), wk = 0.0023585 k( 195) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023585 k( 196) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023585 k( 197) = ( 0.0096154 -0.0000000 0.5000000), wk = 0.0023585 k( 198) = ( 0.0192308 -0.0000000 0.5000000), wk = 0.0023585 k( 199) = ( 0.0288462 -0.0000000 0.5000000), wk = 0.0023585 k( 200) = ( 0.0384615 -0.0000000 0.5000000), wk = 0.0023585 k( 201) = ( 0.0480769 -0.0000000 0.5000000), wk = 0.0023585 k( 202) = ( 0.0576923 0.0000000 0.5000000), wk = 0.0023585 k( 203) = ( 0.0673077 -0.0000000 0.5000000), wk = 0.0023585 k( 204) = ( 0.0769231 -0.0000000 0.5000000), wk = 0.0023585 k( 205) = ( 0.0865385 -0.0000000 0.5000000), wk = 0.0023585 k( 206) = ( 0.0961538 -0.0000000 0.5000000), wk = 0.0023585 k( 207) = ( 0.1057692 -0.0000000 0.5000000), wk = 0.0023585 k( 208) = ( 0.1153846 0.0000000 0.5000000), wk = 0.0023585 k( 209) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0023585 k( 210) = ( 0.1346154 -0.0000000 0.5000000), wk = 0.0023585 k( 211) = ( 0.1442308 -0.0000000 0.5000000), wk = 0.0023585 k( 212) = ( 0.1538461 -0.0000000 0.5000000), wk = 0.0023585 k( 213) = ( 0.1634615 0.0000000 0.5000000), wk = 0.0023585 k( 214) = ( 0.1730769 -0.0000000 0.5000000), wk = 0.0023585 k( 215) = ( 0.1826923 -0.0000000 0.5000000), wk = 0.0023585 k( 216) = ( 0.1923077 -0.0000000 0.5000000), wk = 0.0023585 k( 217) = ( 0.2019231 -0.0000000 0.5000000), wk = 0.0023585 k( 218) = ( 0.2115385 -0.0000000 0.5000000), wk = 0.0023585 k( 219) = ( 0.2211539 -0.0000000 0.5000000), wk = 0.0023585 k( 220) = ( 0.2307692 0.0000000 0.5000000), wk = 0.0023585 k( 221) = ( 0.2403846 0.0000000 0.5000000), wk = 0.0023585 k( 222) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0023585 k( 223) = ( 0.2596154 -0.0000000 0.5000000), wk = 0.0023585 k( 224) = ( 0.2692308 -0.0000000 0.5000000), wk = 0.0023585 k( 225) = ( 0.2788462 -0.0000000 0.5000000), wk = 0.0023585 k( 226) = ( 0.2884615 -0.0000000 0.5000000), wk = 0.0023585 k( 227) = ( 0.2980769 -0.0000000 0.5000000), wk = 0.0023585 k( 228) = ( 0.3076923 -0.0000000 0.5000000), wk = 0.0023585 k( 229) = ( 0.3173077 0.0000000 0.5000000), wk = 0.0023585 k( 230) = ( 0.3269231 0.0000000 0.5000000), wk = 0.0023585 k( 231) = ( 0.3365385 0.0000000 0.5000000), wk = 0.0023585 k( 232) = ( 0.3461538 -0.0000000 0.5000000), wk = 0.0023585 k( 233) = ( 0.3557692 -0.0000000 0.5000000), wk = 0.0023585 k( 234) = ( 0.3653846 -0.0000000 0.5000000), wk = 0.0023585 k( 235) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0023585 k( 236) = ( 0.3846154 -0.0000000 0.5000000), wk = 0.0023585 k( 237) = ( 0.3942308 0.0000000 0.5000000), wk = 0.0023585 k( 238) = ( 0.4038462 -0.0000000 0.5000000), wk = 0.0023585 k( 239) = ( 0.4134615 -0.0000000 0.5000000), wk = 0.0023585 k( 240) = ( 0.4230769 -0.0000000 0.5000000), wk = 0.0023585 k( 241) = ( 0.4326923 -0.0000000 0.5000000), wk = 0.0023585 k( 242) = ( 0.4423077 0.0000000 0.5000000), wk = 0.0023585 k( 243) = ( 0.4519231 -0.0000000 0.5000000), wk = 0.0023585 k( 244) = ( 0.4615385 0.0000000 0.5000000), wk = 0.0023585 k( 245) = ( 0.4711538 -0.0000000 0.5000000), wk = 0.0023585 k( 246) = ( 0.4807692 -0.0000000 0.5000000), wk = 0.0023585 k( 247) = ( 0.4903846 -0.0000000 0.5000000), wk = 0.0023585 k( 248) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023585 k( 249) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023585 k( 250) = ( 0.5000000 0.0142857 0.5000000), wk = 0.0023585 k( 251) = ( 0.5000000 0.0285714 0.5000000), wk = 0.0023585 k( 252) = ( 0.5000000 0.0428571 0.5000000), wk = 0.0023585 k( 253) = ( 0.5000000 0.0571429 0.5000000), wk = 0.0023585 k( 254) = ( 0.5000000 0.0714286 0.5000000), wk = 0.0023585 k( 255) = ( 0.5000000 0.0857143 0.5000000), wk = 0.0023585 k( 256) = ( 0.5000000 0.1000000 0.5000000), wk = 0.0023585 k( 257) = ( 0.5000000 0.1142857 0.5000000), wk = 0.0023585 k( 258) = ( 0.5000000 0.1285714 0.5000000), wk = 0.0023585 k( 259) = ( 0.5000000 0.1428571 0.5000000), wk = 0.0023585 k( 260) = ( 0.5000000 0.1571429 0.5000000), wk = 0.0023585 k( 261) = ( 0.5000000 0.1714286 0.5000000), wk = 0.0023585 k( 262) = ( 0.5000000 0.1857143 0.5000000), wk = 0.0023585 k( 263) = ( 0.5000000 0.2000000 0.5000000), wk = 0.0023585 k( 264) = ( 0.5000000 0.2142857 0.5000000), wk = 0.0023585 k( 265) = ( 0.5000000 0.2285714 0.5000000), wk = 0.0023585 k( 266) = ( 0.5000000 0.2428571 0.5000000), wk = 0.0023585 k( 267) = ( 0.5000000 0.2571429 0.5000000), wk = 0.0023585 k( 268) = ( 0.5000000 0.2714286 0.5000000), wk = 0.0023585 k( 269) = ( 0.5000000 0.2857143 0.5000000), wk = 0.0023585 k( 270) = ( 0.5000000 0.3000000 0.5000000), wk = 0.0023585 k( 271) = ( 0.5000000 0.3142857 0.5000000), wk = 0.0023585 k( 272) = ( 0.5000000 0.3285714 0.5000000), wk = 0.0023585 k( 273) = ( 0.5000000 0.3428571 0.5000000), wk = 0.0023585 k( 274) = ( 0.5000000 0.3571429 0.5000000), wk = 0.0023585 k( 275) = ( 0.5000000 0.3714286 0.5000000), wk = 0.0023585 k( 276) = ( 0.5000000 0.3857143 0.5000000), wk = 0.0023585 k( 277) = ( 0.5000000 0.4000000 0.5000000), wk = 0.0023585 k( 278) = ( 0.5000000 0.4142857 0.5000000), wk = 0.0023585 k( 279) = ( 0.5000000 0.4285714 0.5000000), wk = 0.0023585 k( 280) = ( 0.5000000 0.4428571 0.5000000), wk = 0.0023585 k( 281) = ( 0.5000000 0.4571429 0.5000000), wk = 0.0023585 k( 282) = ( 0.5000000 0.4714286 0.5000000), wk = 0.0023585 k( 283) = ( 0.5000000 0.4857143 0.5000000), wk = 0.0023585 k( 284) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023585 k( 285) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023585 k( 286) = ( 0.4903846 0.5000000 0.5000000), wk = 0.0023585 k( 287) = ( 0.4807692 0.5000000 0.5000000), wk = 0.0023585 k( 288) = ( 0.4711538 0.5000000 0.5000000), wk = 0.0023585 k( 289) = ( 0.4615385 0.5000000 0.5000000), wk = 0.0023585 k( 290) = ( 0.4519231 0.5000000 0.5000000), wk = 0.0023585 k( 291) = ( 0.4423077 0.5000000 0.5000000), wk = 0.0023585 k( 292) = ( 0.4326923 0.5000000 0.5000000), wk = 0.0023585 k( 293) = ( 0.4230769 0.5000000 0.5000000), wk = 0.0023585 k( 294) = ( 0.4134615 0.5000000 0.5000000), wk = 0.0023585 k( 295) = ( 0.4038462 0.5000000 0.5000000), wk = 0.0023585 k( 296) = ( 0.3942308 0.5000000 0.5000000), wk = 0.0023585 k( 297) = ( 0.3846154 0.5000000 0.5000000), wk = 0.0023585 k( 298) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0023585 k( 299) = ( 0.3653846 0.5000000 0.5000000), wk = 0.0023585 k( 300) = ( 0.3557692 0.5000000 0.5000000), wk = 0.0023585 k( 301) = ( 0.3461538 0.5000000 0.5000000), wk = 0.0023585 k( 302) = ( 0.3365385 0.5000000 0.5000000), wk = 0.0023585 k( 303) = ( 0.3269231 0.5000000 0.5000000), wk = 0.0023585 k( 304) = ( 0.3173077 0.5000000 0.5000000), wk = 0.0023585 k( 305) = ( 0.3076923 0.5000000 0.5000000), wk = 0.0023585 k( 306) = ( 0.2980769 0.5000000 0.5000000), wk = 0.0023585 k( 307) = ( 0.2884615 0.5000000 0.5000000), wk = 0.0023585 k( 308) = ( 0.2788462 0.5000000 0.5000000), wk = 0.0023585 k( 309) = ( 0.2692308 0.5000000 0.5000000), wk = 0.0023585 k( 310) = ( 0.2596154 0.5000000 0.5000000), wk = 0.0023585 k( 311) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0023585 k( 312) = ( 0.2403846 0.5000000 0.5000000), wk = 0.0023585 k( 313) = ( 0.2307692 0.5000000 0.5000000), wk = 0.0023585 k( 314) = ( 0.2211539 0.5000000 0.5000000), wk = 0.0023585 k( 315) = ( 0.2115385 0.5000000 0.5000000), wk = 0.0023585 k( 316) = ( 0.2019231 0.5000000 0.5000000), wk = 0.0023585 k( 317) = ( 0.1923077 0.5000000 0.5000000), wk = 0.0023585 k( 318) = ( 0.1826923 0.5000000 0.5000000), wk = 0.0023585 k( 319) = ( 0.1730769 0.5000000 0.5000000), wk = 0.0023585 k( 320) = ( 0.1634615 0.5000000 0.5000000), wk = 0.0023585 k( 321) = ( 0.1538461 0.5000000 0.5000000), wk = 0.0023585 k( 322) = ( 0.1442308 0.5000000 0.5000000), wk = 0.0023585 k( 323) = ( 0.1346154 0.5000000 0.5000000), wk = 0.0023585 k( 324) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0023585 k( 325) = ( 0.1153846 0.5000000 0.5000000), wk = 0.0023585 k( 326) = ( 0.1057692 0.5000000 0.5000000), wk = 0.0023585 k( 327) = ( 0.0961538 0.5000000 0.5000000), wk = 0.0023585 k( 328) = ( 0.0865385 0.5000000 0.5000000), wk = 0.0023585 k( 329) = ( 0.0769231 0.5000000 0.5000000), wk = 0.0023585 k( 330) = ( 0.0673077 0.5000000 0.5000000), wk = 0.0023585 k( 331) = ( 0.0576923 0.5000000 0.5000000), wk = 0.0023585 k( 332) = ( 0.0480769 0.5000000 0.5000000), wk = 0.0023585 k( 333) = ( 0.0384615 0.5000000 0.5000000), wk = 0.0023585 k( 334) = ( 0.0288462 0.5000000 0.5000000), wk = 0.0023585 k( 335) = ( 0.0192308 0.5000000 0.5000000), wk = 0.0023585 k( 336) = ( 0.0096154 0.5000000 0.5000000), wk = 0.0023585 k( 337) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023585 k( 338) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023585 k( 339) = ( 0.0000000 0.4857143 0.5000000), wk = 0.0023585 k( 340) = ( 0.0000000 0.4714286 0.5000000), wk = 0.0023585 k( 341) = ( 0.0000000 0.4571429 0.5000000), wk = 0.0023585 k( 342) = ( 0.0000000 0.4428571 0.5000000), wk = 0.0023585 k( 343) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0023585 k( 344) = ( 0.0000000 0.4142857 0.5000000), wk = 0.0023585 k( 345) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0023585 k( 346) = ( 0.0000000 0.3857143 0.5000000), wk = 0.0023585 k( 347) = ( 0.0000000 0.3714286 0.5000000), wk = 0.0023585 k( 348) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0023585 k( 349) = ( 0.0000000 0.3428571 0.5000000), wk = 0.0023585 k( 350) = ( 0.0000000 0.3285714 0.5000000), wk = 0.0023585 k( 351) = ( 0.0000000 0.3142857 0.5000000), wk = 0.0023585 k( 352) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0023585 k( 353) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0023585 k( 354) = ( 0.0000000 0.2714286 0.5000000), wk = 0.0023585 k( 355) = ( 0.0000000 0.2571429 0.5000000), wk = 0.0023585 k( 356) = ( 0.0000000 0.2428571 0.5000000), wk = 0.0023585 k( 357) = ( 0.0000000 0.2285714 0.5000000), wk = 0.0023585 k( 358) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0023585 k( 359) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0023585 k( 360) = ( 0.0000000 0.1857143 0.5000000), wk = 0.0023585 k( 361) = ( 0.0000000 0.1714286 0.5000000), wk = 0.0023585 k( 362) = ( 0.0000000 0.1571429 0.5000000), wk = 0.0023585 k( 363) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0023585 k( 364) = ( 0.0000000 0.1285714 0.5000000), wk = 0.0023585 k( 365) = ( 0.0000000 0.1142857 0.5000000), wk = 0.0023585 k( 366) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0023585 k( 367) = ( 0.0000000 0.0857143 0.5000000), wk = 0.0023585 k( 368) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0023585 k( 369) = ( 0.0000000 0.0571429 0.5000000), wk = 0.0023585 k( 370) = ( 0.0000000 0.0428571 0.5000000), wk = 0.0023585 k( 371) = ( 0.0000000 0.0285714 0.5000000), wk = 0.0023585 k( 372) = ( 0.0000000 0.0142857 0.5000000), wk = 0.0023585 k( 373) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023585 k( 374) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023585 k( 375) = ( 0.0000000 0.5000000 0.0312500), wk = 0.0023585 k( 376) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0023585 k( 377) = ( 0.0000000 0.5000000 0.0937500), wk = 0.0023585 k( 378) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0023585 k( 379) = ( 0.0000000 0.5000000 0.1562500), wk = 0.0023585 k( 380) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0023585 k( 381) = ( 0.0000000 0.5000000 0.2187500), wk = 0.0023585 k( 382) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0023585 k( 383) = ( 0.0000000 0.5000000 0.2812500), wk = 0.0023585 k( 384) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0023585 k( 385) = ( 0.0000000 0.5000000 0.3437500), wk = 0.0023585 k( 386) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0023585 k( 387) = ( 0.0000000 0.5000000 0.4062500), wk = 0.0023585 k( 388) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0023585 k( 389) = ( 0.0000000 0.5000000 0.4687500), wk = 0.0023585 k( 390) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023585 k( 391) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023585 k( 392) = ( 0.5000000 0.0000000 0.4687500), wk = 0.0023585 k( 393) = ( 0.5000000 0.0000000 0.4375000), wk = 0.0023585 k( 394) = ( 0.5000000 0.0000000 0.4062500), wk = 0.0023585 k( 395) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0023585 k( 396) = ( 0.5000000 0.0000000 0.3437500), wk = 0.0023585 k( 397) = ( 0.5000000 0.0000000 0.3125000), wk = 0.0023585 k( 398) = ( 0.5000000 0.0000000 0.2812500), wk = 0.0023585 k( 399) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0023585 k( 400) = ( 0.5000000 0.0000000 0.2187500), wk = 0.0023585 k( 401) = ( 0.5000000 0.0000000 0.1875000), wk = 0.0023585 k( 402) = ( 0.5000000 0.0000000 0.1562500), wk = 0.0023585 k( 403) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0023585 k( 404) = ( 0.5000000 0.0000000 0.0937500), wk = 0.0023585 k( 405) = ( 0.5000000 0.0000000 0.0625000), wk = 0.0023585 k( 406) = ( 0.5000000 0.0000000 0.0312500), wk = 0.0023585 k( 407) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023585 k( 408) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023585 k( 409) = ( 0.5000000 0.5000000 0.0312500), wk = 0.0023585 k( 410) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0023585 k( 411) = ( 0.5000000 0.5000000 0.0937500), wk = 0.0023585 k( 412) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0023585 k( 413) = ( 0.5000000 0.5000000 0.1562500), wk = 0.0023585 k( 414) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0023585 k( 415) = ( 0.5000000 0.5000000 0.2187500), wk = 0.0023585 k( 416) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0023585 k( 417) = ( 0.5000000 0.5000000 0.2812500), wk = 0.0023585 k( 418) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0023585 k( 419) = ( 0.5000000 0.5000000 0.3437500), wk = 0.0023585 k( 420) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0023585 k( 421) = ( 0.5000000 0.5000000 0.4062500), wk = 0.0023585 k( 422) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0023585 k( 423) = ( 0.5000000 0.5000000 0.4687500), wk = 0.0023585 k( 424) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023585 Dense grid: 92087 G-vectors FFT dimensions: ( 36, 50, 108) Smooth grid: 40715 G-vectors FFT dimensions: ( 25, 40, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.46 Mb ( 316, 96) NL pseudopotentials 0.60 Mb ( 158, 248) Each V/rho on FFT grid 0.08 Mb ( 5400) Each G-vector array 0.02 Mb ( 2555) G-vector shells 0.01 Mb ( 1239) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.85 Mb ( 316, 384) Each subspace H/S matrix 0.14 Mb ( 96, 96) Each matrix 0.73 Mb ( 248, 2, 96) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./FeO2.save/charge-density.dat Starting wfc are 136 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.8 secs Computing kpt #: 2 total cpu time spent up to now is 4.3 secs Computing kpt #: 3 total cpu time spent up to now is 5.5 secs Computing kpt #: 4 total cpu time spent up to now is 6.8 secs Computing kpt #: 5 total cpu time spent up to now is 8.1 secs Computing kpt #: 6 total cpu time spent up to now is 9.4 secs Computing kpt #: 7 total cpu time spent up to now is 10.6 secs Computing kpt #: 8 total cpu time spent up to now is 11.8 secs Computing kpt #: 9 total cpu time spent up to now is 13.0 secs Computing kpt #: 10 total cpu time spent up to now is 14.3 secs Computing kpt #: 11 total cpu time spent up to now is 15.5 secs Computing kpt #: 12 total cpu time spent up to now is 16.8 secs Computing kpt #: 13 total cpu time spent up to now is 18.0 secs Computing kpt #: 14 total cpu time spent up to now is 19.3 secs Computing kpt #: 15 total cpu time spent up to now is 20.5 secs Computing kpt #: 16 total cpu time spent up to now is 21.8 secs Computing kpt #: 17 total cpu time spent up to now is 23.1 secs Computing kpt #: 18 total cpu time spent up to now is 24.3 secs Computing kpt #: 19 total cpu time spent up to now is 25.6 secs Computing kpt #: 20 total cpu time spent up to now is 26.9 secs Computing kpt #: 21 total cpu time spent up to now is 28.3 secs Computing kpt #: 22 total cpu time spent up to now is 29.7 secs Computing kpt #: 23 total cpu time spent up to now is 31.0 secs Computing kpt #: 24 total cpu time spent up to now is 32.3 secs Computing kpt #: 25 total cpu time spent up to now is 33.6 secs Computing kpt #: 26 total cpu time spent up to now is 34.9 secs Computing kpt #: 27 total cpu time spent up to now is 36.1 secs Computing kpt #: 28 total cpu time spent up to now is 37.4 secs Computing kpt #: 29 total cpu time spent up to now is 38.7 secs Computing kpt #: 30 total cpu time spent up to now is 39.9 secs Computing kpt #: 31 total cpu time spent up to now is 41.2 secs Computing kpt #: 32 total cpu time spent up to now is 42.5 secs Computing kpt #: 33 total cpu time spent up to now is 43.8 secs Computing kpt #: 34 total cpu time spent up to now is 45.0 secs Computing kpt #: 35 total cpu time spent up to now is 46.3 secs Computing kpt #: 36 total cpu time spent up to now is 47.5 secs Computing kpt #: 37 total cpu time spent up to now is 48.7 secs Computing kpt #: 38 total cpu time spent up to now is 50.0 secs Computing kpt #: 39 total cpu time spent up to now is 51.2 secs Computing kpt #: 40 total cpu time spent up to now is 52.4 secs Computing kpt #: 41 total cpu time spent up to now is 53.6 secs Computing kpt #: 42 total cpu time spent up to now is 54.9 secs Computing kpt #: 43 total cpu time spent up to now is 56.1 secs Computing kpt #: 44 total cpu time spent up to now is 57.3 secs Computing kpt #: 45 total cpu time spent up to now is 58.5 secs Computing kpt #: 46 total cpu time spent up to now is 59.8 secs Computing kpt #: 47 total cpu time spent up to now is 61.0 secs Computing kpt #: 48 total cpu time spent up to now is 62.1 secs Computing kpt #: 49 total cpu time spent up to now is 63.3 secs Computing kpt #: 50 total cpu time spent up to now is 64.5 secs Computing kpt #: 51 total cpu time spent up to now is 65.7 secs Computing kpt #: 52 total cpu time spent up to now is 66.9 secs Computing kpt #: 53 total cpu time spent up to now is 68.0 secs Computing kpt #: 54 total cpu time spent up to now is 69.2 secs Computing kpt #: 55 total cpu time spent up to now is 70.5 secs Computing kpt #: 56 total cpu time spent up to now is 71.9 secs Computing kpt #: 57 total cpu time spent up to now is 73.1 secs Computing kpt #: 58 total cpu time spent up to now is 74.3 secs Computing kpt #: 59 total cpu time spent up to now is 75.5 secs Computing kpt #: 60 total cpu time spent up to now is 76.6 secs Computing kpt #: 61 total cpu time spent up to now is 77.8 secs Computing kpt #: 62 total cpu time spent up to now is 79.0 secs Computing kpt #: 63 total cpu time spent up to now is 80.3 secs Computing kpt #: 64 total cpu time spent up to now is 81.4 secs Computing kpt #: 65 total cpu time spent up to now is 82.6 secs Computing kpt #: 66 total cpu time spent up to now is 83.9 secs Computing kpt #: 67 total cpu time spent up to now is 85.1 secs Computing kpt #: 68 total cpu time spent up to now is 86.4 secs Computing kpt #: 69 total cpu time spent up to now is 87.6 secs Computing kpt #: 70 total cpu time spent up to now is 88.8 secs Computing kpt #: 71 total cpu time spent up to now is 90.1 secs Computing kpt #: 72 total cpu time spent up to now is 91.3 secs Computing kpt #: 73 total cpu time spent up to now is 92.5 secs Computing kpt #: 74 total cpu time spent up to now is 93.8 secs Computing kpt #: 75 total cpu time spent up to now is 95.0 secs Computing kpt #: 76 total cpu time spent up to now is 96.3 secs Computing kpt #: 77 total cpu time spent up to now is 97.5 secs Computing kpt #: 78 total cpu time spent up to now is 98.7 secs Computing kpt #: 79 total cpu time spent up to now is 99.9 secs Computing kpt #: 80 total cpu time spent up to now is 101.1 secs Computing kpt #: 81 total cpu time spent up to now is 102.3 secs Computing kpt #: 82 total cpu time spent up to now is 103.5 secs Computing kpt #: 83 total cpu time spent up to now is 104.7 secs Computing kpt #: 84 total cpu time spent up to now is 105.8 secs Computing kpt #: 85 total cpu time spent up to now is 107.0 secs Computing kpt #: 86 total cpu time spent up to now is 108.2 secs Computing kpt #: 87 total cpu time spent up to now is 109.4 secs Computing kpt #: 88 total cpu time spent up to now is 110.6 secs Computing kpt #: 89 total cpu time spent up to now is 111.8 secs Computing kpt #: 90 total cpu time spent up to now is 112.9 secs Computing kpt #: 91 total cpu time spent up to now is 114.1 secs Computing kpt #: 92 total cpu time spent up to now is 115.3 secs Computing kpt #: 93 total cpu time spent up to now is 116.5 secs Computing kpt #: 94 total cpu time spent up to now is 117.7 secs Computing kpt #: 95 total cpu time spent up to now is 118.9 secs Computing kpt #: 96 total cpu time spent up to now is 120.1 secs Computing kpt #: 97 total cpu time spent up to now is 121.2 secs Computing kpt #: 98 total cpu time spent up to now is 122.4 secs Computing kpt #: 99 total cpu time spent up to now is 123.6 secs Computing kpt #: 100 total cpu time spent up to now is 124.8 secs Computing kpt #: 101 total cpu time spent up to now is 126.0 secs Computing kpt #: 102 total cpu time spent up to now is 127.2 secs Computing kpt #: 103 total cpu time spent up to now is 128.3 secs Computing kpt #: 104 total cpu time spent up to now is 129.4 secs Computing kpt #: 105 total cpu time spent up to now is 130.6 secs Computing kpt #: 106 total cpu time spent up to now is 131.7 secs Computing kpt #: 107 total cpu time spent up to now is 132.9 secs Computing kpt #: 108 total cpu time spent up to now is 134.1 secs Computing kpt #: 109 total cpu time spent up to now is 135.2 secs Computing kpt #: 110 total cpu time spent up to now is 136.3 secs Computing kpt #: 111 total cpu time spent up to now is 137.5 secs Computing kpt #: 112 total cpu time spent up to now is 138.6 secs Computing kpt #: 113 total cpu time spent up to now is 140.7 secs Computing kpt #: 114 total cpu time spent up to now is 141.9 secs Computing kpt #: 115 total cpu time spent up to now is 143.0 secs Computing kpt #: 116 total cpu time spent up to now is 144.2 secs Computing kpt #: 117 total cpu time spent up to now is 145.4 secs Computing kpt #: 118 total cpu time spent up to now is 147.0 secs Computing kpt #: 119 total cpu time spent up to now is 148.2 secs Computing kpt #: 120 total cpu time spent up to now is 149.4 secs Computing kpt #: 121 total cpu time spent up to now is 150.5 secs Computing kpt #: 122 total cpu time spent up to now is 151.7 secs Computing kpt #: 123 total cpu time spent up to now is 152.9 secs Computing kpt #: 124 total cpu time spent up to now is 154.2 secs Computing kpt #: 125 total cpu time spent up to now is 155.4 secs Computing kpt #: 126 total cpu time spent up to now is 156.6 secs Computing kpt #: 127 total cpu time spent up to now is 157.8 secs Computing kpt #: 128 total cpu time spent up to now is 159.0 secs Computing kpt #: 129 total cpu time spent up to now is 160.2 secs Computing kpt #: 130 total cpu time spent up to now is 161.4 secs Computing kpt #: 131 total cpu time spent up to now is 162.6 secs Computing kpt #: 132 total cpu time spent up to now is 163.8 secs Computing kpt #: 133 total cpu time spent up to now is 165.1 secs Computing kpt #: 134 total cpu time spent up to now is 166.3 secs Computing kpt #: 135 total cpu time spent up to now is 167.6 secs Computing kpt #: 136 total cpu time spent up to now is 168.8 secs Computing kpt #: 137 total cpu time spent up to now is 170.1 secs Computing kpt #: 138 total cpu time spent up to now is 171.4 secs Computing kpt #: 139 total cpu time spent up to now is 172.7 secs Computing kpt #: 140 total cpu time spent up to now is 174.0 secs Computing kpt #: 141 total cpu time spent up to now is 175.4 secs Computing kpt #: 142 total cpu time spent up to now is 176.8 secs Computing kpt #: 143 total cpu time spent up to now is 178.2 secs Computing kpt #: 144 total cpu time spent up to now is 179.6 secs Computing kpt #: 145 total cpu time spent up to now is 180.9 secs Computing kpt #: 146 total cpu time spent up to now is 182.3 secs Computing kpt #: 147 total cpu time spent up to now is 183.6 secs Computing kpt #: 148 total cpu time spent up to now is 184.8 secs Computing kpt #: 149 total cpu time spent up to now is 186.2 secs Computing kpt #: 150 total cpu time spent up to now is 187.4 secs Computing kpt #: 151 total cpu time spent up to now is 188.7 secs Computing kpt #: 152 total cpu time spent up to now is 190.0 secs Computing kpt #: 153 total cpu time spent up to now is 191.3 secs Computing kpt #: 154 total cpu time spent up to now is 192.6 secs Computing kpt #: 155 total cpu time spent up to now is 194.0 secs Computing kpt #: 156 total cpu time spent up to now is 195.5 secs Computing kpt #: 157 total cpu time spent up to now is 196.7 secs Computing kpt #: 158 total cpu time spent up to now is 198.0 secs Computing kpt #: 159 total cpu time spent up to now is 199.1 secs Computing kpt #: 160 total cpu time spent up to now is 200.4 secs Computing kpt #: 161 total cpu time spent up to now is 201.6 secs Computing kpt #: 162 total cpu time spent up to now is 202.8 secs Computing kpt #: 163 total cpu time spent up to now is 204.2 secs Computing kpt #: 164 total cpu time spent up to now is 205.6 secs Computing kpt #: 165 total cpu time spent up to now is 206.8 secs Computing kpt #: 166 total cpu time spent up to now is 208.0 secs Computing kpt #: 167 total cpu time spent up to now is 209.2 secs Computing kpt #: 168 total cpu time spent up to now is 210.4 secs Computing kpt #: 169 total cpu time spent up to now is 211.7 secs Computing kpt #: 170 total cpu time spent up to now is 213.0 secs Computing kpt #: 171 total cpu time spent up to now is 214.4 secs Computing kpt #: 172 total cpu time spent up to now is 215.6 secs Computing kpt #: 173 total cpu time spent up to now is 217.0 secs Computing kpt #: 174 total cpu time spent up to now is 218.3 secs Computing kpt #: 175 total cpu time spent up to now is 219.7 secs Computing kpt #: 176 total cpu time spent up to now is 221.1 secs Computing kpt #: 177 total cpu time spent up to now is 222.3 secs Computing kpt #: 178 total cpu time spent up to now is 223.6 secs Computing kpt #: 179 total cpu time spent up to now is 225.0 secs Computing kpt #: 180 total cpu time spent up to now is 226.3 secs Computing kpt #: 181 total cpu time spent up to now is 227.7 secs Computing kpt #: 182 total cpu time spent up to now is 229.1 secs Computing kpt #: 183 total cpu time spent up to now is 230.5 secs Computing kpt #: 184 total cpu time spent up to now is 232.0 secs Computing kpt #: 185 total cpu time spent up to now is 233.4 secs Computing kpt #: 186 total cpu time spent up to now is 234.7 secs Computing kpt #: 187 total cpu time spent up to now is 236.2 secs Computing kpt #: 188 total cpu time spent up to now is 237.6 secs Computing kpt #: 189 total cpu time spent up to now is 239.2 secs Computing kpt #: 190 total cpu time spent up to now is 240.6 secs Computing kpt #: 191 total cpu time spent up to now is 241.9 secs Computing kpt #: 192 total cpu time spent up to now is 243.2 secs Computing kpt #: 193 total cpu time spent up to now is 244.5 secs Computing kpt #: 194 total cpu time spent up to now is 245.8 secs Computing kpt #: 195 total cpu time spent up to now is 247.1 secs Computing kpt #: 196 total cpu time spent up to now is 248.4 secs Computing kpt #: 197 total cpu time spent up to now is 249.8 secs Computing kpt #: 198 total cpu time spent up to now is 251.2 secs Computing kpt #: 199 total cpu time spent up to now is 252.7 secs Computing kpt #: 200 total cpu time spent up to now is 254.2 secs Computing kpt #: 201 total cpu time spent up to now is 255.4 secs Computing kpt #: 202 total cpu time spent up to now is 256.9 secs Computing kpt #: 203 total cpu time spent up to now is 258.2 secs Computing kpt #: 204 total cpu time spent up to now is 259.6 secs Computing kpt #: 205 total cpu time spent up to now is 260.9 secs Computing kpt #: 206 total cpu time spent up to now is 262.1 secs Computing kpt #: 207 total cpu time spent up to now is 263.4 secs Computing kpt #: 208 total cpu time spent up to now is 264.7 secs Computing kpt #: 209 total cpu time spent up to now is 266.0 secs Computing kpt #: 210 total cpu time spent up to now is 267.3 secs Computing kpt #: 211 total cpu time spent up to now is 268.5 secs Computing kpt #: 212 total cpu time spent up to now is 269.8 secs Computing kpt #: 213 total cpu time spent up to now is 271.1 secs Computing kpt #: 214 total cpu time spent up to now is 272.4 secs Computing kpt #: 215 total cpu time spent up to now is 273.7 secs Computing kpt #: 216 total cpu time spent up to now is 274.9 secs Computing kpt #: 217 total cpu time spent up to now is 276.2 secs Computing kpt #: 218 total cpu time spent up to now is 277.5 secs Computing kpt #: 219 total cpu time spent up to now is 278.8 secs Computing kpt #: 220 total cpu time spent up to now is 280.0 secs Computing kpt #: 221 total cpu time spent up to now is 281.3 secs Computing kpt #: 222 total cpu time spent up to now is 282.5 secs Computing kpt #: 223 total cpu time spent up to now is 283.8 secs Computing kpt #: 224 total cpu time spent up to now is 285.0 secs Computing kpt #: 225 total cpu time spent up to now is 286.2 secs Computing kpt #: 226 total cpu time spent up to now is 287.5 secs Computing kpt #: 227 total cpu time spent up to now is 288.7 secs Computing kpt #: 228 total cpu time spent up to now is 289.9 secs Computing kpt #: 229 total cpu time spent up to now is 291.1 secs Computing kpt #: 230 total cpu time spent up to now is 292.3 secs Computing kpt #: 231 total cpu time spent up to now is 293.6 secs Computing kpt #: 232 total cpu time spent up to now is 294.8 secs Computing kpt #: 233 total cpu time spent up to now is 296.0 secs Computing kpt #: 234 total cpu time spent up to now is 297.2 secs Computing kpt #: 235 total cpu time spent up to now is 298.4 secs Computing kpt #: 236 total cpu time spent up to now is 299.6 secs Computing kpt #: 237 total cpu time spent up to now is 300.8 secs Computing kpt #: 238 total cpu time spent up to now is 302.0 secs Computing kpt #: 239 total cpu time spent up to now is 303.2 secs Computing kpt #: 240 total cpu time spent up to now is 304.4 secs Computing kpt #: 241 total cpu time spent up to now is 305.5 secs Computing kpt #: 242 total cpu time spent up to now is 306.7 secs Computing kpt #: 243 total cpu time spent up to now is 307.8 secs Computing kpt #: 244 total cpu time spent up to now is 309.0 secs Computing kpt #: 245 total cpu time spent up to now is 310.2 secs Computing kpt #: 246 total cpu time spent up to now is 311.3 secs Computing kpt #: 247 total cpu time spent up to now is 312.4 secs Computing kpt #: 248 total cpu time spent up to now is 313.6 secs Computing kpt #: 249 total cpu time spent up to now is 314.7 secs Computing kpt #: 250 total cpu time spent up to now is 316.0 secs Computing kpt #: 251 total cpu time spent up to now is 317.1 secs Computing kpt #: 252 total cpu time spent up to now is 318.3 secs Computing kpt #: 253 total cpu time spent up to now is 319.4 secs Computing kpt #: 254 total cpu time spent up to now is 320.6 secs Computing kpt #: 255 total cpu time spent up to now is 321.7 secs Computing kpt #: 256 total cpu time spent up to now is 322.8 secs Computing kpt #: 257 total cpu time spent up to now is 324.0 secs Computing kpt #: 258 total cpu time spent up to now is 325.1 secs Computing kpt #: 259 total cpu time spent up to now is 326.3 secs Computing kpt #: 260 total cpu time spent up to now is 327.4 secs Computing kpt #: 261 total cpu time spent up to now is 328.5 secs Computing kpt #: 262 total cpu time spent up to now is 329.6 secs Computing kpt #: 263 total cpu time spent up to now is 330.8 secs Computing kpt #: 264 total cpu time spent up to now is 331.9 secs Computing kpt #: 265 total cpu time spent up to now is 333.1 secs Computing kpt #: 266 total cpu time spent up to now is 334.2 secs Computing kpt #: 267 total cpu time spent up to now is 335.3 secs Computing kpt #: 268 total cpu time spent up to now is 336.4 secs Computing kpt #: 269 total cpu time spent up to now is 337.6 secs Computing kpt #: 270 total cpu time spent up to now is 338.7 secs Computing kpt #: 271 total cpu time spent up to now is 339.8 secs Computing kpt #: 272 total cpu time spent up to now is 340.9 secs Computing kpt #: 273 total cpu time spent up to now is 342.0 secs Computing kpt #: 274 total cpu time spent up to now is 343.2 secs Computing kpt #: 275 total cpu time spent up to now is 344.3 secs Computing kpt #: 276 total cpu time spent up to now is 345.4 secs Computing kpt #: 277 total cpu time spent up to now is 346.5 secs Computing kpt #: 278 total cpu time spent up to now is 347.7 secs Computing kpt #: 279 total cpu time spent up to now is 348.8 secs Computing kpt #: 280 total cpu time spent up to now is 349.9 secs Computing kpt #: 281 total cpu time spent up to now is 351.0 secs Computing kpt #: 282 total cpu time spent up to now is 352.1 secs Computing kpt #: 283 total cpu time spent up to now is 353.2 secs Computing kpt #: 284 total cpu time spent up to now is 354.4 secs Computing kpt #: 285 total cpu time spent up to now is 355.5 secs Computing kpt #: 286 total cpu time spent up to now is 356.6 secs Computing kpt #: 287 total cpu time spent up to now is 357.7 secs Computing kpt #: 288 total cpu time spent up to now is 358.8 secs Computing kpt #: 289 total cpu time spent up to now is 360.0 secs Computing kpt #: 290 total cpu time spent up to now is 361.1 secs Computing kpt #: 291 total cpu time spent up to now is 362.2 secs Computing kpt #: 292 total cpu time spent up to now is 363.3 secs Computing kpt #: 293 total cpu time spent up to now is 364.5 secs Computing kpt #: 294 total cpu time spent up to now is 365.6 secs Computing kpt #: 295 total cpu time spent up to now is 366.7 secs Computing kpt #: 296 total cpu time spent up to now is 367.9 secs Computing kpt #: 297 total cpu time spent up to now is 369.0 secs Computing kpt #: 298 total cpu time spent up to now is 370.4 secs Computing kpt #: 299 total cpu time spent up to now is 371.8 secs Computing kpt #: 300 total cpu time spent up to now is 372.9 secs Computing kpt #: 301 total cpu time spent up to now is 374.1 secs Computing kpt #: 302 total cpu time spent up to now is 375.2 secs Computing kpt #: 303 total cpu time spent up to now is 376.4 secs Computing kpt #: 304 total cpu time spent up to now is 377.6 secs Computing kpt #: 305 total cpu time spent up to now is 378.7 secs Computing kpt #: 306 total cpu time spent up to now is 379.8 secs Computing kpt #: 307 total cpu time spent up to now is 381.0 secs Computing kpt #: 308 total cpu time spent up to now is 382.2 secs Computing kpt #: 309 total cpu time spent up to now is 383.4 secs Computing kpt #: 310 total cpu time spent up to now is 384.5 secs Computing kpt #: 311 total cpu time spent up to now is 385.7 secs Computing kpt #: 312 total cpu time spent up to now is 386.9 secs Computing kpt #: 313 total cpu time spent up to now is 388.0 secs Computing kpt #: 314 total cpu time spent up to now is 389.2 secs Computing kpt #: 315 total cpu time spent up to now is 390.4 secs Computing kpt #: 316 total cpu time spent up to now is 391.6 secs Computing kpt #: 317 total cpu time spent up to now is 392.8 secs Computing kpt #: 318 total cpu time spent up to now is 393.9 secs Computing kpt #: 319 total cpu time spent up to now is 395.1 secs Computing kpt #: 320 total cpu time spent up to now is 396.3 secs Computing kpt #: 321 total cpu time spent up to now is 397.5 secs Computing kpt #: 322 total cpu time spent up to now is 398.7 secs Computing kpt #: 323 total cpu time spent up to now is 399.8 secs Computing kpt #: 324 total cpu time spent up to now is 401.1 secs Computing kpt #: 325 total cpu time spent up to now is 402.3 secs Computing kpt #: 326 total cpu time spent up to now is 403.5 secs Computing kpt #: 327 total cpu time spent up to now is 404.7 secs Computing kpt #: 328 total cpu time spent up to now is 405.9 secs Computing kpt #: 329 total cpu time spent up to now is 407.2 secs Computing kpt #: 330 total cpu time spent up to now is 408.5 secs Computing kpt #: 331 total cpu time spent up to now is 409.7 secs Computing kpt #: 332 total cpu time spent up to now is 411.0 secs Computing kpt #: 333 total cpu time spent up to now is 412.3 secs Computing kpt #: 334 total cpu time spent up to now is 413.6 secs Computing kpt #: 335 total cpu time spent up to now is 414.9 secs Computing kpt #: 336 total cpu time spent up to now is 416.2 secs Computing kpt #: 337 total cpu time spent up to now is 417.5 secs Computing kpt #: 338 total cpu time spent up to now is 418.8 secs Computing kpt #: 339 total cpu time spent up to now is 420.1 secs Computing kpt #: 340 total cpu time spent up to now is 421.5 secs Computing kpt #: 341 total cpu time spent up to now is 422.8 secs Computing kpt #: 342 total cpu time spent up to now is 424.1 secs Computing kpt #: 343 total cpu time spent up to now is 425.6 secs Computing kpt #: 344 total cpu time spent up to now is 426.9 secs Computing kpt #: 345 total cpu time spent up to now is 428.3 secs Computing kpt #: 346 total cpu time spent up to now is 429.7 secs Computing kpt #: 347 total cpu time spent up to now is 431.0 secs Computing kpt #: 348 total cpu time spent up to now is 432.4 secs Computing kpt #: 349 total cpu time spent up to now is 433.7 secs Computing kpt #: 350 total cpu time spent up to now is 435.1 secs Computing kpt #: 351 total cpu time spent up to now is 436.4 secs Computing kpt #: 352 total cpu time spent up to now is 437.7 secs Computing kpt #: 353 total cpu time spent up to now is 439.0 secs Computing kpt #: 354 total cpu time spent up to now is 440.3 secs Computing kpt #: 355 total cpu time spent up to now is 441.6 secs Computing kpt #: 356 total cpu time spent up to now is 442.9 secs Computing kpt #: 357 total cpu time spent up to now is 444.2 secs Computing kpt #: 358 total cpu time spent up to now is 445.5 secs Computing kpt #: 359 total cpu time spent up to now is 446.8 secs Computing kpt #: 360 total cpu time spent up to now is 448.1 secs Computing kpt #: 361 total cpu time spent up to now is 449.4 secs Computing kpt #: 362 total cpu time spent up to now is 450.6 secs Computing kpt #: 363 total cpu time spent up to now is 452.1 secs Computing kpt #: 364 total cpu time spent up to now is 453.6 secs Computing kpt #: 365 total cpu time spent up to now is 455.0 secs Computing kpt #: 366 total cpu time spent up to now is 456.5 secs Computing kpt #: 367 total cpu time spent up to now is 457.9 secs Computing kpt #: 368 total cpu time spent up to now is 459.2 secs Computing kpt #: 369 total cpu time spent up to now is 460.4 secs Computing kpt #: 370 total cpu time spent up to now is 461.7 secs Computing kpt #: 371 total cpu time spent up to now is 463.2 secs Computing kpt #: 372 total cpu time spent up to now is 464.7 secs Computing kpt #: 373 total cpu time spent up to now is 466.0 secs Computing kpt #: 374 total cpu time spent up to now is 467.4 secs Computing kpt #: 375 total cpu time spent up to now is 468.7 secs Computing kpt #: 376 total cpu time spent up to now is 470.1 secs Computing kpt #: 377 total cpu time spent up to now is 471.5 secs Computing kpt #: 378 total cpu time spent up to now is 473.0 secs Computing kpt #: 379 total cpu time spent up to now is 474.3 secs Computing kpt #: 380 total cpu time spent up to now is 475.7 secs Computing kpt #: 381 total cpu time spent up to now is 477.0 secs Computing kpt #: 382 total cpu time spent up to now is 478.4 secs Computing kpt #: 383 total cpu time spent up to now is 479.8 secs Computing kpt #: 384 total cpu time spent up to now is 481.3 secs Computing kpt #: 385 total cpu time spent up to now is 482.7 secs Computing kpt #: 386 total cpu time spent up to now is 484.0 secs Computing kpt #: 387 total cpu time spent up to now is 485.3 secs Computing kpt #: 388 total cpu time spent up to now is 486.6 secs Computing kpt #: 389 total cpu time spent up to now is 487.9 secs Computing kpt #: 390 total cpu time spent up to now is 489.2 secs Computing kpt #: 391 total cpu time spent up to now is 490.4 secs Computing kpt #: 392 total cpu time spent up to now is 491.5 secs Computing kpt #: 393 total cpu time spent up to now is 492.7 secs Computing kpt #: 394 total cpu time spent up to now is 493.8 secs Computing kpt #: 395 total cpu time spent up to now is 495.0 secs Computing kpt #: 396 total cpu time spent up to now is 496.1 secs Computing kpt #: 397 total cpu time spent up to now is 497.3 secs Computing kpt #: 398 total cpu time spent up to now is 498.5 secs Computing kpt #: 399 total cpu time spent up to now is 499.7 secs Computing kpt #: 400 total cpu time spent up to now is 500.8 secs Computing kpt #: 401 total cpu time spent up to now is 502.0 secs Computing kpt #: 402 total cpu time spent up to now is 503.2 secs Computing kpt #: 403 total cpu time spent up to now is 504.3 secs Computing kpt #: 404 total cpu time spent up to now is 505.5 secs Computing kpt #: 405 total cpu time spent up to now is 506.6 secs Computing kpt #: 406 total cpu time spent up to now is 507.8 secs Computing kpt #: 407 total cpu time spent up to now is 509.0 secs Computing kpt #: 408 total cpu time spent up to now is 510.1 secs Computing kpt #: 409 total cpu time spent up to now is 511.3 secs Computing kpt #: 410 total cpu time spent up to now is 512.5 secs Computing kpt #: 411 total cpu time spent up to now is 513.7 secs Computing kpt #: 412 total cpu time spent up to now is 514.9 secs Computing kpt #: 413 total cpu time spent up to now is 516.0 secs Computing kpt #: 414 total cpu time spent up to now is 517.1 secs Computing kpt #: 415 total cpu time spent up to now is 518.3 secs Computing kpt #: 416 total cpu time spent up to now is 519.4 secs Computing kpt #: 417 total cpu time spent up to now is 520.6 secs Computing kpt #: 418 total cpu time spent up to now is 521.7 secs Computing kpt #: 419 total cpu time spent up to now is 522.8 secs Computing kpt #: 420 total cpu time spent up to now is 524.0 secs Computing kpt #: 421 total cpu time spent up to now is 525.1 secs Computing kpt #: 422 total cpu time spent up to now is 526.3 secs Computing kpt #: 423 total cpu time spent up to now is 527.4 secs Computing kpt #: 424 total cpu time spent up to now is 528.5 secs ethr = 1.25E-08, avg # of iterations = 16.8 total cpu time spent up to now is 528.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5107 PWs) bands (ev): -13.6535 -13.6535 -13.4245 -13.4245 -12.8814 -12.8814 -12.7654 -12.7654 -12.1995 -12.1995 -11.9544 -11.9544 -11.3761 -11.3761 -11.3082 -11.3082 -0.8578 -0.8578 -0.5100 -0.5100 -0.1457 -0.1457 -0.1343 -0.1343 0.5624 0.5624 0.5784 0.5784 0.8943 0.8943 0.9104 0.9104 0.9362 0.9362 0.9560 0.9560 1.2820 1.2820 1.4766 1.4766 1.7417 1.7417 2.0708 2.0708 2.5594 2.5594 2.6768 2.6768 2.7210 2.7210 3.0098 3.0098 3.3842 3.3842 3.4452 3.4452 3.7141 3.7141 3.8459 3.8459 3.9383 3.9383 4.1372 4.1372 4.2277 4.2277 4.2622 4.2622 4.2965 4.2965 4.5607 4.5607 4.5865 4.5865 4.6225 4.6225 4.6994 4.6994 4.7634 4.7634 4.7730 4.7730 5.0380 5.0380 5.4744 5.4744 5.7029 5.7029 5.8891 5.8891 6.2667 6.2667 6.8941 6.8941 6.9880 6.9880 k = 0.0096-0.0000-0.0000 ( 5109 PWs) bands (ev): -13.6529 -13.6529 -13.4241 -13.4241 -12.8812 -12.8812 -12.7653 -12.7653 -12.1992 -12.1992 -11.9543 -11.9543 -11.3761 -11.3761 -11.3083 -11.3083 -0.8569 -0.8569 -0.5093 -0.5093 -0.1452 -0.1452 -0.1339 -0.1339 0.5624 0.5624 0.5790 0.5790 0.8909 0.8909 0.9105 0.9105 0.9347 0.9347 0.9557 0.9557 1.2858 1.2858 1.4764 1.4764 1.7423 1.7423 2.0719 2.0719 2.5514 2.5514 2.6735 2.6735 2.7263 2.7263 3.0085 3.0085 3.3826 3.3826 3.4443 3.4443 3.7136 3.7136 3.8429 3.8429 3.9325 3.9325 4.1391 4.1391 4.2279 4.2279 4.2621 4.2621 4.3015 4.3015 4.5600 4.5600 4.5786 4.5786 4.6319 4.6319 4.7008 4.7008 4.7609 4.7609 4.7753 4.7753 5.0399 5.0399 5.4750 5.4750 5.7025 5.7025 5.8895 5.8895 6.2676 6.2676 6.8936 6.8936 6.9871 6.9871 k = 0.0192-0.0000-0.0000 ( 5107 PWs) bands (ev): -13.6514 -13.6514 -13.4229 -13.4229 -12.8804 -12.8804 -12.7650 -12.7650 -12.1985 -12.1985 -11.9538 -11.9538 -11.3760 -11.3760 -11.3084 -11.3084 -0.8541 -0.8541 -0.5072 -0.5072 -0.1438 -0.1438 -0.1327 -0.1327 0.5627 0.5627 0.5808 0.5808 0.8809 0.8809 0.9106 0.9106 0.9304 0.9304 0.9549 0.9549 1.2967 1.2967 1.4756 1.4756 1.7443 1.7443 2.0749 2.0749 2.5304 2.5304 2.6638 2.6638 2.7399 2.7399 3.0047 3.0047 3.3776 3.3776 3.4414 3.4414 3.7120 3.7120 3.8340 3.8340 3.9162 3.9162 4.1445 4.1445 4.2286 4.2286 4.2619 4.2619 4.3157 4.3157 4.5573 4.5573 4.5650 4.5650 4.6502 4.6502 4.7048 4.7048 4.7549 4.7549 4.7811 4.7811 5.0454 5.0454 5.4766 5.4766 5.7014 5.7014 5.8906 5.8906 6.2702 6.2702 6.8921 6.8921 6.9842 6.9842 k = 0.0288-0.0000-0.0000 ( 5107 PWs) bands (ev): -13.6488 -13.6488 -13.4209 -13.4209 -12.8792 -12.8792 -12.7646 -12.7646 -12.1974 -12.1974 -11.9530 -11.9530 -11.3759 -11.3759 -11.3086 -11.3086 -0.8495 -0.8495 -0.5037 -0.5037 -0.1415 -0.1415 -0.1306 -0.1306 0.5630 0.5630 0.5838 0.5838 0.8654 0.8654 0.9106 0.9106 0.9236 0.9236 0.9537 0.9537 1.3137 1.3137 1.4743 1.4743 1.7475 1.7475 2.0797 2.0797 2.5010 2.5010 2.6478 2.6478 2.7573 2.7573 2.9983 2.9983 3.3696 3.3696 3.4365 3.4365 3.7094 3.7094 3.8187 3.8187 3.8922 3.8922 4.1531 4.1531 4.2299 4.2299 4.2617 4.2617 4.3367 4.3367 4.5483 4.5483 4.5565 4.5565 4.6711 4.6711 4.7103 4.7103 4.7469 4.7469 4.7896 4.7896 5.0541 5.0541 5.4793 5.4793 5.6995 5.6995 5.8924 5.8924 6.2744 6.2744 6.8894 6.8894 6.9796 6.9796 k = 0.0385-0.0000-0.0000 ( 5115 PWs) bands (ev): -13.6451 -13.6451 -13.4182 -13.4182 -12.8775 -12.8775 -12.7640 -12.7640 -12.1957 -12.1957 -11.9519 -11.9519 -11.3758 -11.3758 -11.3090 -11.3090 -0.8431 -0.8431 -0.4988 -0.4988 -0.1383 -0.1383 -0.1278 -0.1278 0.5633 0.5633 0.5879 0.5879 0.8456 0.8456 0.9081 0.9081 0.9168 0.9168 0.9520 0.9520 1.3354 1.3354 1.4723 1.4723 1.7521 1.7521 2.0856 2.0856 2.4668 2.4668 2.6259 2.6259 2.7754 2.7754 2.9894 2.9894 3.3588 3.3588 3.4292 3.4292 3.7056 3.7056 3.7963 3.7963 3.8642 3.8642 4.1645 4.1645 4.2321 4.2321 4.2617 4.2617 4.3624 4.3624 4.5357 4.5357 4.5520 4.5520 4.6926 4.6926 4.7140 4.7140 4.7408 4.7408 4.8006 4.8006 5.0652 5.0652 5.4830 5.4830 5.6969 5.6969 5.8948 5.8948 6.2803 6.2803 6.8856 6.8856 6.9732 6.9732 k = 0.0481-0.0000-0.0000 ( 5111 PWs) bands (ev): -13.6405 -13.6405 -13.4147 -13.4147 -12.8753 -12.8753 -12.7632 -12.7632 -12.1936 -12.1936 -11.9505 -11.9505 -11.3756 -11.3756 -11.3094 -11.3094 -0.8349 -0.8349 -0.4926 -0.4926 -0.1342 -0.1342 -0.1241 -0.1241 0.5637 0.5637 0.5932 0.5932 0.8228 0.8228 0.8978 0.8978 0.9157 0.9157 0.9499 0.9499 1.3608 1.3608 1.4697 1.4697 1.7579 1.7579 2.0919 2.0919 2.4302 2.4302 2.5985 2.5985 2.7930 2.7930 2.9780 2.9780 3.3455 3.3455 3.4192 3.4192 3.6999 3.6999 3.7672 3.7672 3.8352 3.8352 4.1777 4.1777 4.2353 4.2353 4.2625 4.2625 4.3909 4.3909 4.5246 4.5246 4.5472 4.5472 4.7039 4.7039 4.7185 4.7185 4.7443 4.7443 4.8138 4.8138 5.0784 5.0784 5.4877 5.4877 5.6935 5.6935 5.8981 5.8981 6.2875 6.2875 6.8805 6.8805 6.9654 6.9654 k = 0.0577-0.0000-0.0000 ( 5115 PWs) bands (ev): -13.6348 -13.6348 -13.4104 -13.4104 -12.8726 -12.8726 -12.7622 -12.7622 -12.1910 -12.1910 -11.9488 -11.9488 -11.3754 -11.3754 -11.3099 -11.3099 -0.8249 -0.8249 -0.4851 -0.4851 -0.1292 -0.1292 -0.1197 -0.1197 0.5640 0.5640 0.5997 0.5997 0.7979 0.7979 0.8832 0.8832 0.9170 0.9170 0.9474 0.9474 1.3886 1.3886 1.4663 1.4663 1.7652 1.7652 2.0970 2.0970 2.3936 2.3936 2.5660 2.5660 2.8091 2.8091 2.9641 2.9641 3.3303 3.3303 3.4062 3.4062 3.6880 3.6880 3.7362 3.7362 3.8064 3.8064 4.1908 4.1908 4.2398 4.2398 4.2654 4.2654 4.4209 4.4209 4.5154 4.5154 4.5419 4.5419 4.6913 4.6913 4.7391 4.7391 4.7554 4.7554 4.8287 4.8287 5.0929 5.0929 5.4933 5.4933 5.6894 5.6894 5.9020 5.9020 6.2959 6.2959 6.8739 6.8739 6.9562 6.9562 k = 0.0673-0.0000-0.0000 ( 5109 PWs) bands (ev): -13.6281 -13.6281 -13.4054 -13.4054 -12.8695 -12.8695 -12.7611 -12.7611 -12.1879 -12.1879 -11.9467 -11.9467 -11.3752 -11.3752 -11.3105 -11.3105 -0.8132 -0.8132 -0.4763 -0.4763 -0.1235 -0.1235 -0.1145 -0.1145 0.5641 0.5641 0.6072 0.6072 0.7716 0.7716 0.8661 0.8661 0.9193 0.9193 0.9444 0.9444 1.4182 1.4182 1.4622 1.4622 1.7737 1.7737 2.0988 2.0988 2.3596 2.3596 2.5289 2.5289 2.8236 2.8236 2.9479 2.9479 3.3135 3.3135 3.3900 3.3900 3.6583 3.6583 3.7167 3.7167 3.7777 3.7777 4.2017 4.2017 4.2451 4.2451 4.2727 4.2727 4.4510 4.4510 4.5085 4.5085 4.5363 4.5363 4.6741 4.6741 4.7605 4.7605 4.7697 4.7697 4.8450 4.8450 5.1083 5.1083 5.4996 5.4996 5.6847 5.6847 5.9067 5.9067 6.3052 6.3052 6.8657 6.8657 6.9460 6.9460 k = 0.0769-0.0000-0.0000 ( 5113 PWs) bands (ev): -13.6205 -13.6205 -13.3996 -13.3996 -12.8660 -12.8660 -12.7599 -12.7599 -12.1844 -12.1844 -11.9443 -11.9443 -11.3750 -11.3750 -11.3112 -11.3112 -0.7997 -0.7997 -0.4662 -0.4662 -0.1170 -0.1170 -0.1087 -0.1087 0.5639 0.5639 0.6159 0.6159 0.7447 0.7447 0.8470 0.8470 0.9223 0.9223 0.9410 0.9410 1.4481 1.4481 1.4580 1.4580 1.7837 1.7837 2.0939 2.0939 2.3320 2.3320 2.4878 2.4878 2.8364 2.8364 2.9295 2.9295 3.2956 3.2956 3.3702 3.3702 3.6123 3.6123 3.7089 3.7089 3.7488 3.7488 4.2086 4.2086 4.2499 4.2499 4.2869 4.2869 4.4785 4.4785 4.5058 4.5058 4.5307 4.5307 4.6552 4.6552 4.7804 4.7804 4.7863 4.7863 4.8623 4.8623 5.1243 5.1243 5.5066 5.5066 5.6791 5.6791 5.9122 5.9122 6.3151 6.3151 6.8556 6.8556 6.9351 6.9351 k = 0.0865-0.0000-0.0000 ( 5111 PWs) bands (ev): -13.6118 -13.6118 -13.3931 -13.3931 -12.8621 -12.8621 -12.7585 -12.7585 -12.1803 -12.1803 -11.9417 -11.9417 -11.3748 -11.3748 -11.3120 -11.3120 -0.7845 -0.7845 -0.4549 -0.4549 -0.1098 -0.1098 -0.1022 -0.1022 0.5633 0.5633 0.6256 0.6256 0.7174 0.7174 0.8262 0.8262 0.9260 0.9260 0.9373 0.9373 1.4507 1.4507 1.4808 1.4808 1.7950 1.7950 2.0787 2.0787 2.3143 2.3143 2.4431 2.4431 2.8474 2.8474 2.9091 2.9091 3.2769 3.2769 3.3470 3.3470 3.5590 3.5590 3.7017 3.7017 3.7228 3.7228 4.2114 4.2114 4.2547 4.2547 4.3074 4.3074 4.4906 4.4906 4.5158 4.5158 4.5291 4.5291 4.6354 4.6354 4.7978 4.7978 4.8049 4.8049 4.8805 4.8805 5.1406 5.1406 5.5142 5.5142 5.6730 5.6730 5.9184 5.9184 6.3253 6.3253 6.8435 6.8435 6.9239 6.9239 k = 0.0962-0.0000-0.0000 ( 5115 PWs) bands (ev): -13.6023 -13.6023 -13.3859 -13.3859 -12.8579 -12.8579 -12.7570 -12.7570 -12.1757 -12.1757 -11.9387 -11.9387 -11.3746 -11.3746 -11.3129 -11.3129 -0.7676 -0.7676 -0.4424 -0.4424 -0.1021 -0.1021 -0.0950 -0.0950 0.5622 0.5622 0.6363 0.6363 0.6902 0.6902 0.8040 0.8040 0.9287 0.9287 0.9348 0.9348 1.4440 1.4440 1.5123 1.5123 1.8078 1.8078 2.0521 2.0521 2.3081 2.3081 2.3955 2.3955 2.8566 2.8566 2.8870 2.8870 3.2579 3.2579 3.3204 3.3204 3.5016 3.5016 3.6793 3.6793 3.7129 3.7129 4.2110 4.2110 4.2599 4.2599 4.3319 4.3319 4.4904 4.4904 4.5147 4.5147 4.5508 4.5508 4.6154 4.6154 4.8140 4.8140 4.8237 4.8237 4.8993 4.8993 5.1569 5.1569 5.5223 5.5223 5.6662 5.6662 5.9254 5.9254 6.3353 6.3353 6.8291 6.8291 6.9128 6.9128 k = 0.1058-0.0000-0.0000 ( 5111 PWs) bands (ev): -13.5918 -13.5918 -13.3780 -13.3780 -12.8533 -12.8533 -12.7554 -12.7554 -12.1706 -12.1706 -11.9354 -11.9354 -11.3744 -11.3744 -11.3140 -11.3140 -0.7492 -0.7492 -0.4289 -0.4289 -0.0938 -0.0938 -0.0874 -0.0874 0.5605 0.5605 0.6476 0.6476 0.6635 0.6635 0.7806 0.7806 0.9252 0.9252 0.9388 0.9388 1.4366 1.4366 1.5437 1.5437 1.8220 1.8220 2.0155 2.0155 2.3118 2.3118 2.3455 2.3455 2.8617 2.8617 2.8661 2.8661 3.2387 3.2387 3.2905 3.2905 3.4415 3.4415 3.6476 3.6476 3.7126 3.7126 4.2084 4.2084 4.2658 4.2658 4.3589 4.3589 4.4894 4.4894 4.5086 4.5086 4.5753 4.5753 4.5989 4.5989 4.8296 4.8296 4.8417 4.8417 4.9188 4.9188 5.1731 5.1731 5.5307 5.5307 5.6587 5.6587 5.9331 5.9331 6.3446 6.3446 6.8121 6.8121 6.9025 6.9025 k = 0.1154-0.0000-0.0000 ( 5109 PWs) bands (ev): -13.5803 -13.5803 -13.3694 -13.3694 -12.8484 -12.8484 -12.7537 -12.7537 -12.1650 -12.1650 -11.9318 -11.9318 -11.3743 -11.3743 -11.3151 -11.3151 -0.7291 -0.7291 -0.4143 -0.4143 -0.0852 -0.0852 -0.0793 -0.0793 0.5581 0.5581 0.6359 0.6359 0.6614 0.6614 0.7562 0.7562 0.9188 0.9188 0.9458 0.9458 1.4285 1.4285 1.5748 1.5748 1.8377 1.8377 1.9723 1.9723 2.2931 2.2931 2.3227 2.3227 2.8387 2.8387 2.8707 2.8707 3.2196 3.2196 3.2577 3.2577 3.3794 3.3794 3.6136 3.6136 3.7146 3.7146 4.2042 4.2042 4.2722 4.2722 4.3870 4.3870 4.4882 4.4882 4.5025 4.5025 4.5689 4.5689 4.6132 4.6132 4.8443 4.8443 4.8584 4.8584 4.9387 4.9387 5.1890 5.1890 5.5392 5.5392 5.6507 5.6507 5.9415 5.9415 6.3528 6.3528 6.7926 6.7926 6.8934 6.8934 k = 0.1250-0.0000-0.0000 ( 5113 PWs) bands (ev): -13.5680 -13.5680 -13.3601 -13.3601 -12.8433 -12.8433 -12.7519 -12.7519 -12.1589 -12.1589 -11.9278 -11.9278 -11.3742 -11.3742 -11.3165 -11.3165 -0.7076 -0.7076 -0.3987 -0.3987 -0.0763 -0.0763 -0.0707 -0.0707 0.5549 0.5549 0.6102 0.6102 0.6750 0.6750 0.7309 0.7309 0.9108 0.9108 0.9543 0.9543 1.4201 1.4201 1.6053 1.6053 1.8545 1.8545 1.9252 1.9252 2.2395 2.2395 2.3378 2.3378 2.8136 2.8136 2.8752 2.8752 3.2005 3.2005 3.2223 3.2223 3.3158 3.3158 3.5784 3.5784 3.7179 3.7179 4.1990 4.1990 4.2789 4.2789 4.4150 4.4150 4.4852 4.4852 4.4986 4.4986 4.5501 4.5501 4.6401 4.6401 4.8581 4.8581 4.8737 4.8737 4.9591 4.9591 5.2044 5.2044 5.5478 5.5478 5.6422 5.6422 5.9506 5.9506 6.3593 6.3593 6.7705 6.7705 6.8862 6.8862 k = 0.1346-0.0000-0.0000 ( 5105 PWs) bands (ev): -13.5549 -13.5549 -13.3503 -13.3503 -12.8380 -12.8380 -12.7500 -12.7500 -12.1522 -12.1522 -11.9236 -11.9236 -11.3742 -11.3742 -11.3179 -11.3179 -0.6845 -0.6845 -0.3823 -0.3823 -0.0672 -0.0672 -0.0618 -0.0618 0.5508 0.5508 0.5850 0.5850 0.6896 0.6896 0.7052 0.7052 0.9009 0.9009 0.9641 0.9641 1.4119 1.4119 1.6350 1.6350 1.8679 1.8679 1.8808 1.8808 2.1849 2.1849 2.3556 2.3556 2.7882 2.7882 2.8784 2.8784 3.1811 3.1811 3.1849 3.1849 3.2512 3.2512 3.5422 3.5422 3.7219 3.7219 4.1927 4.1927 4.2856 4.2856 4.4406 4.4406 4.4794 4.4794 4.4981 4.4981 4.5328 4.5328 4.6669 4.6669 4.8707 4.8707 4.8874 4.8874 4.9801 4.9801 5.2193 5.2193 5.5562 5.5562 5.6332 5.6332 5.9602 5.9602 6.3636 6.3636 6.7461 6.7461 6.8815 6.8815 k = 0.1442-0.0000-0.0000 ( 5107 PWs) bands (ev): -13.5409 -13.5409 -13.3398 -13.3398 -12.8325 -12.8325 -12.7482 -12.7482 -12.1450 -12.1450 -11.9191 -11.9191 -11.3742 -11.3742 -11.3196 -11.3196 -0.6601 -0.6601 -0.3650 -0.3650 -0.0581 -0.0581 -0.0526 -0.0526 0.5457 0.5457 0.5606 0.5606 0.6790 0.6790 0.7053 0.7053 0.8887 0.8887 0.9754 0.9754 1.4043 1.4043 1.6636 1.6636 1.8237 1.8237 1.8942 1.8942 2.1296 2.1296 2.3750 2.3750 2.7630 2.7630 2.8801 2.8801 3.1440 3.1440 3.1630 3.1630 3.1863 3.1863 3.5052 3.5052 3.7264 3.7264 4.1856 4.1856 4.2922 4.2922 4.4561 4.4561 4.4736 4.4736 4.4994 4.4994 4.5242 4.5242 4.6926 4.6926 4.8820 4.8820 4.8996 4.8996 5.0015 5.0015 5.2334 5.2334 5.5644 5.5644 5.6240 5.6240 5.9704 5.9704 6.3653 6.3653 6.7195 6.7195 6.8796 6.8796 k = 0.1538-0.0000-0.0000 ( 5119 PWs) bands (ev): -13.5262 -13.5262 -13.3288 -13.3288 -12.8268 -12.8268 -12.7462 -12.7462 -12.1372 -12.1372 -11.9143 -11.9143 -11.3743 -11.3743 -11.3213 -11.3213 -0.6344 -0.6344 -0.3469 -0.3469 -0.0493 -0.0493 -0.0433 -0.0433 0.5369 0.5369 0.5398 0.5398 0.6526 0.6526 0.7218 0.7218 0.8738 0.8738 0.9881 0.9881 1.3979 1.3979 1.6911 1.6911 1.7731 1.7731 1.9151 1.9151 2.0741 2.0741 2.3954 2.3954 2.7380 2.7380 2.8805 2.8805 3.1010 3.1010 3.1214 3.1214 3.1452 3.1452 3.4675 3.4675 3.7312 3.7312 4.1776 4.1776 4.2984 4.2984 4.4518 4.4518 4.4672 4.4672 4.5027 4.5027 4.5339 4.5339 4.7171 4.7171 4.8918 4.8918 4.9102 4.9102 5.0233 5.0233 5.2467 5.2467 5.5717 5.5717 5.6147 5.6147 5.9811 5.9811 6.3643 6.3643 6.6911 6.6911 6.8807 6.8807 k = 0.1635-0.0000-0.0000 ( 5119 PWs) bands (ev): -13.5107 -13.5107 -13.3172 -13.3172 -12.8211 -12.8211 -12.7443 -12.7443 -12.1288 -12.1288 -11.9091 -11.9091 -11.3746 -11.3746 -11.3233 -11.3233 -0.6074 -0.6074 -0.3282 -0.3282 -0.0409 -0.0409 -0.0339 -0.0339 0.5145 0.5145 0.5326 0.5326 0.6263 0.6263 0.7393 0.7393 0.8557 0.8557 1.0021 1.0021 1.3933 1.3933 1.7174 1.7174 1.7229 1.7229 1.9371 1.9371 2.0190 2.0190 2.4162 2.4162 2.7136 2.7136 2.8796 2.8796 3.0487 3.0487 3.0653 3.0653 3.1269 3.1269 3.4293 3.4293 3.7363 3.7363 4.1687 4.1687 4.3043 4.3043 4.4380 4.4380 4.4562 4.4562 4.5071 4.5071 4.5567 4.5567 4.7402 4.7402 4.9002 4.9002 4.9193 4.9193 5.0455 5.0455 5.2592 5.2592 5.5774 5.5774 5.6065 5.6065 5.9921 5.9921 6.3606 6.3606 6.6615 6.6615 6.8848 6.8848 k = 0.1731-0.0000-0.0000 ( 5107 PWs) bands (ev): -13.4945 -13.4945 -13.3051 -13.3051 -12.8153 -12.8153 -12.7424 -12.7424 -12.1199 -12.1199 -11.9037 -11.9037 -11.3750 -11.3750 -11.3254 -11.3254 -0.5792 -0.5792 -0.3089 -0.3089 -0.0331 -0.0331 -0.0245 -0.0245 0.4931 0.4931 0.5245 0.5245 0.6003 0.6003 0.7577 0.7577 0.8341 0.8341 1.0174 1.0174 1.3911 1.3911 1.6736 1.6736 1.7425 1.7425 1.9568 1.9568 1.9677 1.9677 2.4370 2.4370 2.6899 2.6899 2.8774 2.8774 2.9861 2.9861 3.0189 3.0189 3.1091 3.1091 3.3906 3.3906 3.7413 3.7413 4.1588 4.1588 4.3095 4.3095 4.4205 4.4205 4.4448 4.4448 4.5117 4.5117 4.5835 4.5835 4.7618 4.7618 4.9070 4.9070 4.9271 4.9271 5.0680 5.0680 5.2708 5.2708 5.5783 5.5783 5.6023 5.6023 6.0034 6.0034 6.3542 6.3542 6.6309 6.6309 6.8910 6.8910 k = 0.1827-0.0000-0.0000 ( 5113 PWs) bands (ev): -13.4776 -13.4776 -13.2925 -13.2925 -12.8096 -12.8096 -12.7405 -12.7405 -12.1104 -12.1104 -11.8979 -11.8979 -11.3755 -11.3755 -11.3278 -11.3278 -0.5499 -0.5499 -0.2891 -0.2891 -0.0263 -0.0263 -0.0152 -0.0152 0.4727 0.4727 0.5153 0.5153 0.5747 0.5747 0.7765 0.7765 0.8091 0.8091 1.0339 1.0339 1.3917 1.3917 1.6258 1.6258 1.7660 1.7660 1.9099 1.9099 1.9846 1.9846 2.4577 2.4577 2.6667 2.6667 2.8738 2.8738 2.9225 2.9225 2.9734 2.9734 3.0916 3.0916 3.3516 3.3516 3.7461 3.7461 4.1475 4.1475 4.3140 4.3140 4.4020 4.4020 4.4333 4.4333 4.5164 4.5164 4.6110 4.6110 4.7819 4.7819 4.9122 4.9122 4.9334 4.9334 5.0908 5.0908 5.2813 5.2813 5.5722 5.5722 5.6042 5.6042 6.0148 6.0148 6.3455 6.3455 6.5998 6.5998 6.8956 6.8956 k = 0.1923-0.0000-0.0000 ( 5113 PWs) bands (ev): -13.4600 -13.4600 -13.2794 -13.2794 -12.8038 -12.8038 -12.7387 -12.7387 -12.1003 -12.1003 -11.8919 -11.8919 -11.3762 -11.3762 -11.3303 -11.3303 -0.5196 -0.5196 -0.2689 -0.2689 -0.0209 -0.0209 -0.0060 -0.0060 0.4535 0.4535 0.5050 0.5050 0.5500 0.5500 0.7766 0.7766 0.7998 0.7998 1.0516 1.0516 1.3955 1.3955 1.5799 1.5799 1.7881 1.7881 1.8577 1.8577 2.0085 2.0085 2.4779 2.4779 2.6443 2.6443 2.8596 2.8596 2.8694 2.8694 2.9276 2.9276 3.0744 3.0744 3.3123 3.3123 3.7507 3.7507 4.1348 4.1348 4.3175 4.3175 4.3840 4.3840 4.4217 4.4217 4.5214 4.5214 4.6381 4.6381 4.8006 4.8006 4.9158 4.9158 4.9383 4.9383 5.1136 5.1136 5.2908 5.2908 5.5625 5.5625 5.6091 5.6091 6.0262 6.0262 6.3349 6.3349 6.5685 6.5685 6.8853 6.8853 k = 0.2019-0.0000-0.0000 ( 5107 PWs) bands (ev): -13.4419 -13.4419 -13.2659 -13.2659 -12.7982 -12.7982 -12.7369 -12.7369 -12.0897 -12.0897 -11.8855 -11.8855 -11.3771 -11.3771 -11.3331 -11.3331 -0.4885 -0.4885 -0.2483 -0.2483 -0.0173 -0.0173 0.0030 0.0030 0.4354 0.4354 0.4937 0.4937 0.5265 0.5265 0.7442 0.7442 0.8202 0.8202 1.0702 1.0702 1.4027 1.4027 1.5361 1.5361 1.8068 1.8068 1.8089 1.8089 2.0325 2.0325 2.4976 2.4976 2.6224 2.6224 2.7994 2.7994 2.8628 2.8628 2.8815 2.8815 3.0577 3.0577 3.2729 3.2729 3.7549 3.7549 4.1204 4.1204 4.3199 4.3199 4.3675 4.3675 4.4099 4.4099 4.5264 4.5264 4.6645 4.6645 4.8178 4.8178 4.9178 4.9178 4.9420 4.9420 5.1365 5.1365 5.2991 5.2991 5.5514 5.5514 5.6145 5.6145 6.0376 6.0376 6.3228 6.3228 6.5374 6.5374 6.8608 6.8608 k = 0.2115-0.0000-0.0000 ( 5103 PWs) bands (ev): -13.4232 -13.4232 -13.2520 -13.2520 -12.7927 -12.7927 -12.7353 -12.7353 -12.0784 -12.0784 -11.8789 -11.8789 -11.3782 -11.3782 -11.3361 -11.3361 -0.4565 -0.4565 -0.2275 -0.2275 -0.0158 -0.0158 0.0116 0.0116 0.4185 0.4185 0.4812 0.4812 0.5045 0.5045 0.7070 0.7070 0.8426 0.8426 1.0898 1.0898 1.4132 1.4132 1.4949 1.4949 1.7588 1.7588 1.8270 1.8270 2.0563 2.0563 2.5165 2.5165 2.6008 2.6008 2.7415 2.7415 2.8352 2.8352 2.8552 2.8552 3.0416 3.0416 3.2334 3.2334 3.7586 3.7586 4.1039 4.1039 4.3204 4.3204 4.3535 4.3535 4.3978 4.3978 4.5314 4.5314 4.6897 4.6897 4.8336 4.8336 4.9184 4.9184 4.9444 4.9444 5.1593 5.1593 5.3062 5.3062 5.5397 5.5397 5.6199 5.6199 6.0489 6.0489 6.3096 6.3096 6.5069 6.5069 6.8353 6.8353 k = 0.2212-0.0000-0.0000 ( 5111 PWs) bands (ev): -13.4041 -13.4041 -13.2378 -13.2378 -12.7874 -12.7874 -12.7338 -12.7338 -12.0666 -12.0666 -11.8720 -11.8720 -11.3795 -11.3795 -11.3393 -11.3393 -0.4239 -0.4239 -0.2066 -0.2066 -0.0169 -0.0169 0.0199 0.0199 0.4027 0.4027 0.4677 0.4677 0.4845 0.4845 0.6663 0.6663 0.8663 0.8663 1.1099 1.1099 1.4259 1.4259 1.4575 1.4575 1.7130 1.7130 1.8431 1.8431 2.0794 2.0794 2.5345 2.5345 2.5794 2.5794 2.6870 2.6870 2.7889 2.7889 2.8462 2.8462 3.0260 3.0260 3.1941 3.1941 3.7617 3.7617 4.0851 4.0851 4.3181 4.3181 4.3433 4.3433 4.3854 4.3854 4.5363 4.5363 4.7137 4.7137 4.8479 4.8479 4.9174 4.9174 4.9457 4.9457 5.1816 5.1816 5.3121 5.3121 5.5277 5.5277 5.6249 5.6249 6.0599 6.0599 6.2958 6.2958 6.4771 6.4771 6.8107 6.8107 k = 0.2308-0.0000-0.0000 ( 5109 PWs) bands (ev): -13.3844 -13.3844 -13.2232 -13.2232 -12.7823 -12.7823 -12.7324 -12.7324 -12.0543 -12.0543 -11.8648 -11.8648 -11.3811 -11.3811 -11.3429 -11.3429 -0.3906 -0.3906 -0.1855 -0.1855 -0.0210 -0.0210 0.0277 0.0277 0.3880 0.3880 0.4531 0.4531 0.4668 0.4668 0.6226 0.6226 0.8912 0.8912 1.1306 1.1306 1.4170 1.4170 1.4479 1.4479 1.6700 1.6700 1.8564 1.8564 2.1016 2.1016 2.5512 2.5512 2.5583 2.5583 2.6369 2.6369 2.7428 2.7428 2.8358 2.8358 3.0113 3.0113 3.1550 3.1550 3.7642 3.7642 4.0640 4.0640 4.3128 4.3128 4.3374 4.3374 4.3728 4.3728 4.5411 4.5411 4.7362 4.7362 4.8610 4.8610 4.9150 4.9150 4.9460 4.9460 5.2035 5.2035 5.3169 5.3169 5.5154 5.5154 5.6294 5.6294 6.0706 6.0706 6.2817 6.2817 6.4485 6.4485 6.7872 6.7872 k = 0.2404-0.0000-0.0000 ( 5108 PWs) bands (ev): -13.3644 -13.3644 -13.2083 -13.2083 -12.7775 -12.7775 -12.7312 -12.7312 -12.0414 -12.0414 -11.8572 -11.8572 -11.3830 -11.3830 -11.3466 -11.3466 -0.3570 -0.3570 -0.1644 -0.1644 -0.0284 -0.0284 0.0351 0.0351 0.3744 0.3744 0.4375 0.4375 0.4515 0.4515 0.5765 0.5765 0.9174 0.9174 1.1515 1.1515 1.3855 1.3855 1.4669 1.4669 1.6304 1.6304 1.8661 1.8661 2.1226 2.1226 2.5359 2.5359 2.5678 2.5678 2.5919 2.5919 2.6972 2.6972 2.8240 2.8240 2.9973 2.9973 3.1164 3.1164 3.7659 3.7659 4.0404 4.0404 4.3064 4.3064 4.3339 4.3339 4.3600 4.3600 4.5457 4.5457 4.7571 4.7571 4.8728 4.8728 4.9114 4.9114 4.9452 4.9452 5.2248 5.2248 5.3205 5.3205 5.5030 5.5030 5.6334 5.6334 6.0809 6.0809 6.2677 6.2677 6.4211 6.4211 6.7650 6.7650 k = 0.2500-0.0000-0.0000 ( 5104 PWs) bands (ev): -13.3440 -13.3440 -13.1932 -13.1932 -12.7730 -12.7730 -12.7302 -12.7302 -12.0279 -12.0279 -11.8494 -11.8494 -11.3851 -11.3851 -11.3507 -11.3507 -0.3230 -0.3230 -0.1434 -0.1434 -0.0393 -0.0393 0.0420 0.0420 0.3618 0.3618 0.4210 0.4210 0.4390 0.4390 0.5283 0.5283 0.9448 0.9448 1.1722 1.1722 1.3561 1.3561 1.4898 1.4898 1.5945 1.5945 1.8715 1.8715 2.1423 2.1423 2.5135 2.5135 2.5527 2.5527 2.5830 2.5830 2.6522 2.6522 2.8107 2.8107 2.9844 2.9844 3.0785 3.0785 3.7668 3.7668 4.0146 4.0146 4.3006 4.3006 4.3309 4.3309 4.3473 4.3473 4.5501 4.5501 4.7765 4.7765 4.8833 4.8833 4.9066 4.9066 4.9436 4.9436 5.2451 5.2451 5.3230 5.3230 5.4905 5.4905 5.6370 5.6370 6.0908 6.0908 6.2540 6.2540 6.3953 6.3953 6.7441 6.7441 k = 0.2596-0.0000-0.0000 ( 5104 PWs) bands (ev): -13.3233 -13.3233 -13.1779 -13.1779 -12.7688 -12.7688 -12.7295 -12.7295 -12.0139 -12.0139 -11.8414 -11.8414 -11.3875 -11.3875 -11.3551 -11.3551 -0.2889 -0.2889 -0.1225 -0.1225 -0.0537 -0.0537 0.0484 0.0484 0.3502 0.3502 0.4034 0.4034 0.4293 0.4293 0.4786 0.4786 0.9734 0.9734 1.1922 1.1922 1.3298 1.3298 1.5154 1.5154 1.5629 1.5629 1.8717 1.8717 2.1607 2.1607 2.4904 2.4904 2.5204 2.5204 2.5966 2.5966 2.6082 2.6082 2.7960 2.7960 2.9726 2.9726 3.0417 3.0417 3.7669 3.7669 3.9866 3.9866 4.2963 4.2963 4.3270 4.3270 4.3352 4.3352 4.5542 4.5542 4.7940 4.7940 4.8921 4.8921 4.9012 4.9012 4.9411 4.9411 5.2640 5.2640 5.3249 5.3249 5.4780 5.4780 5.6400 5.6400 6.1004 6.1004 6.2409 6.2409 6.3709 6.3709 6.7246 6.7246 k = 0.2692-0.0000-0.0000 ( 5094 PWs) bands (ev): -13.3023 -13.3023 -13.1624 -13.1624 -12.7650 -12.7650 -12.7289 -12.7289 -11.9995 -11.9995 -11.8330 -11.8330 -11.3903 -11.3903 -11.3597 -11.3597 -0.2548 -0.2548 -0.1019 -0.1019 -0.0713 -0.0713 0.0542 0.0542 0.3394 0.3394 0.3850 0.3850 0.4217 0.4217 0.4284 0.4284 1.0034 1.0034 1.2111 1.2111 1.3067 1.3067 1.5352 1.5352 1.5443 1.5443 1.8661 1.8661 2.1778 2.1778 2.4663 2.4663 2.4951 2.4951 2.5650 2.5650 2.6094 2.6094 2.7799 2.7799 2.9619 2.9619 3.0065 3.0065 3.7660 3.7660 3.9566 3.9566 4.2933 4.2933 4.3191 4.3191 4.3267 4.3267 4.5581 4.5581 4.8097 4.8097 4.8926 4.8926 4.9021 4.9021 4.9379 4.9379 5.2808 5.2808 5.3268 5.3268 5.4655 5.4655 5.6426 5.6426 6.1095 6.1095 6.2287 6.2287 6.3483 6.3483 6.7066 6.7066 k = 0.2788-0.0000-0.0000 ( 5094 PWs) bands (ev): -13.2812 -13.2812 -13.1467 -13.1467 -12.7616 -12.7616 -12.7287 -12.7287 -11.9845 -11.9845 -11.8243 -11.8243 -11.3934 -11.3934 -11.3647 -11.3647 -0.2209 -0.2209 -0.0920 -0.0920 -0.0814 -0.0814 0.0594 0.0594 0.3294 0.3294 0.3653 0.3653 0.3769 0.3769 0.4178 0.4178 1.0347 1.0347 1.2281 1.2281 1.2871 1.2871 1.5145 1.5145 1.5738 1.5738 1.8544 1.8544 2.1939 2.1939 2.4412 2.4412 2.4761 2.4761 2.5234 2.5234 2.6206 2.6206 2.7625 2.7625 2.9522 2.9522 2.9735 2.9735 3.7640 3.7640 3.9250 3.9250 4.2907 4.2907 4.3085 4.3085 4.3216 4.3216 4.5616 4.5616 4.8232 4.8232 4.8856 4.8856 4.9087 4.9087 4.9342 4.9342 5.2936 5.2936 5.3306 5.3306 5.4529 5.4529 5.6446 5.6446 6.1182 6.1182 6.2173 6.2173 6.3275 6.3275 6.6899 6.6899 k = 0.2885-0.0000-0.0000 ( 5090 PWs) bands (ev): -13.2599 -13.2599 -13.1310 -13.1310 -12.7586 -12.7586 -12.7287 -12.7287 -11.9691 -11.9691 -11.8154 -11.8154 -11.3969 -11.3969 -11.3701 -11.3701 -0.1873 -0.1873 -0.1150 -0.1150 -0.0616 -0.0616 0.0641 0.0641 0.3198 0.3198 0.3246 0.3246 0.3469 0.3469 0.4151 0.4151 1.0672 1.0672 1.2421 1.2421 1.2709 1.2709 1.4994 1.4994 1.6057 1.6057 1.8369 1.8369 2.2095 2.2095 2.4150 2.4150 2.4622 2.4622 2.4835 2.4835 2.6305 2.6305 2.7437 2.7437 2.9390 2.9390 2.9481 2.9481 3.7610 3.7610 3.8919 3.8919 4.2854 4.2854 4.3011 4.3011 4.3168 4.3168 4.5648 4.5648 4.8341 4.8341 4.8782 4.8782 4.9145 4.9145 4.9301 4.9301 5.3000 5.3000 5.3386 5.3386 5.4403 5.4403 5.6461 5.6461 6.1264 6.1264 6.2071 6.2071 6.3084 6.3084 6.6746 6.6746 k = 0.2981-0.0000-0.0000 ( 5098 PWs) bands (ev): -13.2385 -13.2385 -13.1152 -13.1152 -12.7561 -12.7561 -12.7291 -12.7291 -11.9533 -11.9533 -11.8062 -11.8062 -11.4007 -11.4007 -11.3758 -11.3758 -0.1543 -0.1543 -0.1400 -0.1400 -0.0425 -0.0425 0.0681 0.0681 0.2735 0.2735 0.3115 0.3115 0.3267 0.3267 0.4140 0.4140 1.1009 1.1009 1.2513 1.2513 1.2594 1.2594 1.4910 1.4910 1.6391 1.6391 1.8143 1.8143 2.2248 2.2248 2.3876 2.3876 2.4440 2.4440 2.4534 2.4534 2.6388 2.6388 2.7237 2.7237 2.9139 2.9139 2.9395 2.9395 3.7567 3.7567 3.8575 3.8575 4.2753 4.2753 4.2985 4.2985 4.3128 4.3128 4.5676 4.5676 4.8413 4.8413 4.8719 4.8719 4.9182 4.9182 4.9266 4.9266 5.3005 5.3005 5.3505 5.3505 5.4277 5.4277 5.6472 5.6472 6.1342 6.1342 6.1981 6.1981 6.2910 6.2910 6.6606 6.6606 k = 0.3077-0.0000-0.0000 ( 5096 PWs) bands (ev): -13.2170 -13.2170 -13.0993 -13.0993 -12.7541 -12.7541 -12.7298 -12.7298 -11.9371 -11.9371 -11.7968 -11.7968 -11.4049 -11.4049 -11.3819 -11.3819 -0.1665 -0.1665 -0.1221 -0.1221 -0.0246 -0.0246 0.0716 0.0716 0.2239 0.2239 0.3031 0.3031 0.3069 0.3069 0.4141 0.4141 1.1359 1.1359 1.2465 1.2465 1.2612 1.2612 1.4896 1.4896 1.6740 1.6740 1.7878 1.7878 2.2399 2.2399 2.3591 2.3591 2.4086 2.4086 2.4439 2.4439 2.6449 2.6449 2.7032 2.7032 2.8912 2.8912 2.9343 2.9343 3.7512 3.7512 3.8221 3.8221 4.2633 4.2633 4.2957 4.2957 4.3119 4.3119 4.5701 4.5701 4.8423 4.8423 4.8694 4.8694 4.9172 4.9172 4.9265 4.9265 5.2976 5.2976 5.3638 5.3638 5.4151 5.4151 5.6477 5.6477 6.1414 6.1414 6.1907 6.1907 6.2755 6.2755 6.6476 6.6476 k = 0.3173-0.0000-0.0000 ( 5088 PWs) bands (ev): -13.1956 -13.1956 -13.0835 -13.0835 -12.7525 -12.7525 -12.7309 -12.7309 -11.9206 -11.9206 -11.7871 -11.7871 -11.4095 -11.4095 -11.3883 -11.3883 -0.1938 -0.1938 -0.0911 -0.0911 -0.0089 -0.0089 0.0745 0.0745 0.1769 0.1769 0.2864 0.2864 0.2964 0.2964 0.4149 0.4149 1.1720 1.1720 1.2403 1.2403 1.2641 1.2641 1.4945 1.4945 1.7099 1.7099 1.7584 1.7584 2.2548 2.2548 2.3295 2.3295 2.3751 2.3751 2.4346 2.4346 2.6470 2.6470 2.6839 2.6839 2.8737 2.8737 2.9307 2.9307 3.7444 3.7444 3.7859 3.7859 4.2509 4.2509 4.2901 4.2901 4.3151 4.3151 4.5723 4.5723 4.8368 4.8368 4.8711 4.8711 4.9131 4.9131 4.9285 4.9285 5.2928 5.2928 5.3771 5.3771 5.4025 5.4025 5.6478 5.6478 6.1476 6.1476 6.1852 6.1852 6.2617 6.2617 6.6356 6.6356 k = 0.3269-0.0000-0.0000 ( 5088 PWs) bands (ev): -13.1743 -13.1743 -13.0677 -13.0677 -12.7515 -12.7515 -12.7324 -12.7324 -11.9038 -11.9038 -11.7771 -11.7771 -11.4145 -11.4145 -11.3952 -11.3952 -0.2216 -0.2216 -0.0616 -0.0616 0.0018 0.0018 0.0767 0.0767 0.1355 0.1355 0.2674 0.2674 0.2896 0.2896 0.4161 0.4161 1.2092 1.2092 1.2369 1.2369 1.2644 1.2644 1.5047 1.5047 1.7271 1.7271 1.7466 1.7466 2.2693 2.2693 2.2991 2.2991 2.3442 2.3442 2.4229 2.4229 2.6385 2.6385 2.6724 2.6724 2.8624 2.8624 2.9287 2.9287 3.7358 3.7358 3.7493 3.7493 4.2386 4.2386 4.2828 4.2828 4.3207 4.3207 4.5741 4.5741 4.8283 4.8283 4.8735 4.8735 4.9086 4.9086 4.9300 4.9300 5.2869 5.2869 5.3880 5.3880 5.3918 5.3918 5.6474 5.6474 6.1522 6.1522 6.1824 6.1824 6.2494 6.2494 6.6242 6.6242 k = 0.3365-0.0000-0.0000 ( 5088 PWs) bands (ev): -13.1531 -13.1531 -13.0520 -13.0520 -12.7510 -12.7510 -12.7343 -12.7343 -11.8866 -11.8866 -11.7669 -11.7669 -11.4200 -11.4200 -11.4025 -11.4025 -0.2495 -0.2495 -0.0342 -0.0342 0.0002 0.0002 0.0781 0.0781 0.1072 0.1072 0.2496 0.2496 0.2835 0.2835 0.4174 0.4174 1.2362 1.2362 1.2472 1.2472 1.2634 1.2634 1.5188 1.5188 1.6950 1.6950 1.7835 1.7835 2.2682 2.2682 2.2834 2.2834 2.3163 2.3163 2.4079 2.4079 2.6180 2.6180 2.6703 2.6703 2.8577 2.8577 2.9282 2.9282 3.7109 3.7109 3.7271 3.7271 4.2267 4.2267 4.2746 4.2746 4.3279 4.3279 4.5755 4.5755 4.8187 4.8187 4.8747 4.8747 4.9045 4.9045 4.9305 4.9305 5.2801 5.2801 5.3769 5.3769 5.4025 5.4025 5.6464 5.6464 6.1544 6.1544 6.1830 6.1830 6.2388 6.2388 6.6132 6.6132 k = 0.3462-0.0000-0.0000 ( 5080 PWs) bands (ev): -13.1320 -13.1320 -13.0365 -13.0365 -12.7511 -12.7511 -12.7366 -12.7366 -11.8693 -11.8693 -11.7565 -11.7565 -11.4258 -11.4258 -11.4102 -11.4102 -0.2769 -0.2769 -0.0213 -0.0213 -0.0094 -0.0094 0.0787 0.0787 0.0998 0.0998 0.2339 0.2339 0.2782 0.2782 0.4186 0.4186 1.2387 1.2387 1.2604 1.2604 1.2871 1.2871 1.5355 1.5355 1.6627 1.6627 1.8203 1.8203 2.2372 2.2372 2.2907 2.2907 2.2975 2.2975 2.3889 2.3889 2.5923 2.5923 2.6705 2.6705 2.8596 2.8596 2.9291 2.9291 3.6734 3.6734 3.7156 3.7156 4.2151 4.2151 4.2658 4.2658 4.3363 4.3363 4.5765 4.5765 4.8090 4.8090 4.8740 4.8740 4.9012 4.9012 4.9299 4.9299 5.2728 5.2728 5.3644 5.3644 5.4139 5.4139 5.6450 5.6450 6.1543 6.1543 6.1870 6.1870 6.2296 6.2296 6.6022 6.6022 k = 0.3558-0.0000-0.0000 ( 5074 PWs) bands (ev): -13.1112 -13.1112 -13.0210 -13.0210 -12.7518 -12.7518 -12.7394 -12.7394 -11.8518 -11.8518 -11.7458 -11.7458 -11.4321 -11.4321 -11.4183 -11.4183 -0.3036 -0.3036 -0.0563 -0.0563 0.0116 0.0116 0.0783 0.0783 0.1073 0.1073 0.2212 0.2212 0.2738 0.2738 0.4195 0.4195 1.2436 1.2436 1.2584 1.2584 1.3268 1.3268 1.5537 1.5537 1.6308 1.6308 1.8562 1.8562 2.2069 2.2069 2.2702 2.2702 2.3089 2.3089 2.3662 2.3662 2.5642 2.5642 2.6703 2.6703 2.8677 2.8677 2.9316 2.9316 3.6354 3.6354 3.7027 3.7027 4.2042 4.2042 4.2567 4.2567 4.3457 4.3457 4.5770 4.5770 4.7994 4.7994 4.8715 4.8715 4.8987 4.8987 4.9282 4.9282 5.2652 5.2652 5.3518 5.3518 5.4247 5.4247 5.6430 5.6430 6.1533 6.1533 6.1928 6.1928 6.2218 6.2218 6.5910 6.5910 k = 0.3654-0.0000-0.0000 ( 5078 PWs) bands (ev): -13.0907 -13.0907 -13.0058 -13.0058 -12.7530 -12.7530 -12.7426 -12.7426 -11.8341 -11.8341 -11.7350 -11.7350 -11.4388 -11.4388 -11.4268 -11.4268 -0.3292 -0.3292 -0.0960 -0.0960 0.0277 0.0277 0.0768 0.0768 0.1209 0.1209 0.2129 0.2129 0.2705 0.2705 0.4198 0.4198 1.2502 1.2502 1.2575 1.2575 1.3674 1.3674 1.5728 1.5728 1.5996 1.5996 1.8898 1.8898 2.1785 2.1785 2.2528 2.2528 2.3189 2.3189 2.3409 2.3409 2.5345 2.5345 2.6690 2.6690 2.8813 2.8813 2.9354 2.9354 3.5975 3.5975 3.6882 3.6882 4.1938 4.1938 4.2473 4.2473 4.3558 4.3558 4.5771 4.5771 4.7903 4.7903 4.8677 4.8677 4.8965 4.8965 4.9252 4.9252 5.2575 5.2575 5.3394 5.3394 5.4348 5.4348 5.6405 5.6405 6.1521 6.1521 6.1990 6.1990 6.2160 6.2160 6.5791 6.5791 k = 0.3750-0.0000-0.0000 ( 5074 PWs) bands (ev): -13.0704 -13.0704 -12.9908 -12.9908 -12.7550 -12.7550 -12.7463 -12.7463 -11.8164 -11.8164 -11.7239 -11.7239 -11.4460 -11.4460 -11.4358 -11.4358 -0.3536 -0.3536 -0.1363 -0.1363 0.0379 0.0379 0.0743 0.0743 0.1366 0.1366 0.2099 0.2099 0.2683 0.2683 0.4195 0.4195 1.2525 1.2525 1.2638 1.2638 1.4085 1.4085 1.5692 1.5692 1.5925 1.5925 1.9188 1.9188 2.1545 2.1545 2.2391 2.2391 2.3085 2.3085 2.3318 2.3318 2.5034 2.5034 2.6663 2.6663 2.8993 2.8993 2.9409 2.9409 3.5596 3.5596 3.6719 3.6719 4.1841 4.1841 4.2379 4.2379 4.3665 4.3665 4.5766 4.5766 4.7820 4.7820 4.8632 4.8632 4.8941 4.8941 4.9211 4.9211 5.2499 5.2499 5.3270 5.3270 5.4445 5.4445 5.6374 5.6374 6.1514 6.1514 6.2023 6.2023 6.2148 6.2148 6.5664 6.5664 k = 0.3846-0.0000-0.0000 ( 5078 PWs) bands (ev): -13.0506 -13.0506 -12.9760 -12.9760 -12.7576 -12.7576 -12.7504 -12.7504 -11.7986 -11.7986 -11.7127 -11.7127 -11.4535 -11.4535 -11.4453 -11.4453 -0.3764 -0.3764 -0.1759 -0.1759 0.0420 0.0420 0.0705 0.0705 0.1533 0.1533 0.2127 0.2127 0.2674 0.2674 0.4185 0.4185 1.2519 1.2519 1.2760 1.2760 1.4499 1.4499 1.5403 1.5403 1.6122 1.6122 1.9390 1.9390 2.1391 2.1391 2.2291 2.2291 2.2784 2.2784 2.3390 2.3390 2.4710 2.4710 2.6621 2.6621 2.9209 2.9209 2.9482 2.9482 3.5220 3.5220 3.6539 3.6539 4.1752 4.1752 4.2284 4.2284 4.3777 4.3777 4.5755 4.5755 4.7745 4.7745 4.8585 4.8585 4.8912 4.8912 4.9159 4.9159 5.2426 5.2426 5.3148 5.3148 5.4536 5.4536 5.6337 5.6337 6.1510 6.1510 6.2002 6.2002 6.2205 6.2205 6.5527 6.5527 k = 0.3942-0.0000-0.0000 ( 5078 PWs) bands (ev): -13.0312 -13.0312 -12.9616 -12.9616 -12.7609 -12.7609 -12.7549 -12.7549 -11.7808 -11.7808 -11.7013 -11.7013 -11.4615 -11.4615 -11.4553 -11.4553 -0.3974 -0.3974 -0.2139 -0.2139 0.0409 0.0409 0.0655 0.0655 0.1702 0.1702 0.2203 0.2203 0.2677 0.2677 0.4167 0.4167 1.2514 1.2514 1.2909 1.2909 1.4909 1.4909 1.5131 1.5131 1.6319 1.6319 1.9454 1.9454 2.1374 2.1374 2.2229 2.2229 2.2461 2.2461 2.3453 2.3453 2.4375 2.4375 2.6562 2.6562 2.9437 2.9437 2.9588 2.9588 3.4848 3.4848 3.6342 3.6342 4.1671 4.1671 4.2191 4.2191 4.3893 4.3893 4.5739 4.5739 4.7682 4.7682 4.8540 4.8540 4.8878 4.8878 4.9096 4.9096 5.2356 5.2356 5.3029 5.3029 5.4624 5.4624 5.6295 5.6295 6.1512 6.1512 6.1966 6.1966 6.2288 6.2288 6.5380 6.5380 k = 0.4038-0.0000-0.0000 ( 5084 PWs) bands (ev): -13.0122 -13.0122 -12.9474 -12.9474 -12.7652 -12.7652 -12.7596 -12.7596 -11.7630 -11.7630 -11.6898 -11.6898 -11.4699 -11.4699 -11.4657 -11.4657 -0.4165 -0.4165 -0.2500 -0.2500 0.0363 0.0363 0.0596 0.0596 0.1871 0.1871 0.2309 0.2309 0.2691 0.2691 0.4140 0.4140 1.2514 1.2514 1.3081 1.3081 1.4858 1.4858 1.5331 1.5331 1.6516 1.6516 1.9367 1.9367 2.1507 2.1507 2.2116 2.2116 2.2216 2.2216 2.3499 2.3499 2.4029 2.4029 2.6486 2.6486 2.9604 2.9604 2.9794 2.9794 3.4481 3.4481 3.6127 3.6127 4.1599 4.1599 4.2098 4.2098 4.4011 4.4011 4.5717 4.5717 4.7630 4.7630 4.8498 4.8498 4.8836 4.8836 4.9023 4.9023 5.2291 5.2291 5.2913 5.2913 5.4710 5.4710 5.6247 5.6247 6.1518 6.1518 6.1931 6.1931 6.2381 6.2381 6.5223 6.5223 k = 0.4135-0.0000-0.0000 ( 5080 PWs) bands (ev): -12.9937 -12.9937 -12.9336 -12.9336 -12.7706 -12.7706 -12.7645 -12.7645 -11.7453 -11.7453 -11.6781 -11.6781 -11.4786 -11.4786 -11.4766 -11.4766 -0.4334 -0.4334 -0.2839 -0.2839 0.0298 0.0298 0.0528 0.0528 0.2040 0.2040 0.2429 0.2429 0.2716 0.2716 0.4104 0.4104 1.2521 1.2521 1.3273 1.3273 1.4611 1.4611 1.5732 1.5732 1.6716 1.6716 1.9177 1.9177 2.1706 2.1706 2.1827 2.1827 2.2217 2.2217 2.3526 2.3526 2.3676 2.3676 2.6392 2.6392 2.9728 2.9728 3.0079 3.0079 3.4121 3.4121 3.5895 3.5895 4.1536 4.1536 4.2009 4.2009 4.4131 4.4131 4.5689 4.5689 4.7592 4.7592 4.8461 4.8461 4.8789 4.8789 4.8944 4.8944 5.2233 5.2233 5.2801 5.2801 5.4794 5.4794 5.6194 5.6194 6.1529 6.1529 6.1901 6.1901 6.2479 6.2479 6.5059 6.5059 k = 0.4231-0.0000-0.0000 ( 5086 PWs) bands (ev): -12.9758 -12.9758 -12.9202 -12.9202 -12.7768 -12.7768 -12.7697 -12.7697 -11.7277 -11.7277 -11.6664 -11.6664 -11.4880 -11.4880 -11.4878 -11.4878 -0.4481 -0.4481 -0.3154 -0.3154 0.0227 0.0227 0.0456 0.0456 0.2206 0.2206 0.2551 0.2551 0.2750 0.2750 0.4059 0.4059 1.2534 1.2534 1.3485 1.3485 1.4376 1.4376 1.6116 1.6116 1.6919 1.6919 1.8944 1.8944 2.1426 2.1426 2.2067 2.2067 2.2256 2.2256 2.3303 2.3303 2.3545 2.3545 2.6279 2.6279 2.9855 2.9855 3.0391 3.0391 3.3769 3.3769 3.5646 3.5646 4.1483 4.1483 4.1923 4.1923 4.4251 4.4251 4.5653 4.5653 4.7567 4.7567 4.8429 4.8429 4.8732 4.8732 4.8863 4.8863 5.2182 5.2182 5.2694 5.2694 5.4876 5.4876 5.6136 5.6136 6.1542 6.1542 6.1873 6.1873 6.2583 6.2583 6.4891 6.4891 k = 0.4327-0.0000-0.0000 ( 5090 PWs) bands (ev): -12.9584 -12.9584 -12.9071 -12.9071 -12.7839 -12.7839 -12.7752 -12.7752 -11.7103 -11.7103 -11.6546 -11.6546 -11.4998 -11.4998 -11.4973 -11.4973 -0.4603 -0.4603 -0.3445 -0.3445 0.0157 0.0157 0.0380 0.0380 0.2368 0.2368 0.2665 0.2665 0.2789 0.2789 0.4005 0.4005 1.2556 1.2556 1.3713 1.3713 1.4156 1.4156 1.6459 1.6459 1.7127 1.7127 1.8718 1.8718 2.1085 2.1085 2.2306 2.2306 2.2407 2.2407 2.2932 2.2932 2.3538 2.3538 2.6148 2.6148 2.9993 2.9993 3.0719 3.0719 3.3425 3.3425 3.5381 3.5381 4.1440 4.1440 4.1841 4.1841 4.4371 4.4371 4.5612 4.5612 4.7558 4.7558 4.8402 4.8402 4.8663 4.8663 4.8786 4.8786 5.2139 5.2139 5.2592 5.2592 5.4959 5.4959 5.6074 5.6074 6.1559 6.1559 6.1848 6.1848 6.2691 6.2691 6.4720 6.4720 k = 0.4423-0.0000-0.0000 ( 5092 PWs) bands (ev): -12.9415 -12.9415 -12.8945 -12.8945 -12.7918 -12.7918 -12.7812 -12.7812 -11.6930 -11.6930 -11.6427 -11.6427 -11.5121 -11.5121 -11.5071 -11.5071 -0.4701 -0.4701 -0.3710 -0.3710 0.0094 0.0094 0.0305 0.0305 0.2527 0.2527 0.2768 0.2768 0.2832 0.2832 0.3941 0.3941 1.2586 1.2586 1.3938 1.3938 1.3971 1.3971 1.6718 1.6718 1.7342 1.7342 1.8559 1.8559 2.0745 2.0745 2.2393 2.2393 2.2540 2.2540 2.2754 2.2754 2.3515 2.3515 2.5996 2.5996 3.0144 3.0144 3.1059 3.1059 3.3093 3.3093 3.5101 3.5101 4.1408 4.1408 4.1763 4.1763 4.4490 4.4490 4.5563 4.5563 4.7564 4.7564 4.8378 4.8378 4.8582 4.8582 4.8719 4.8719 5.2105 5.2105 5.2498 5.2498 5.5041 5.5041 5.6007 5.6007 6.1577 6.1577 6.1826 6.1826 6.2804 6.2804 6.4548 6.4548 k = 0.4519-0.0000-0.0000 ( 5078 PWs) bands (ev): -12.9253 -12.9253 -12.8823 -12.8823 -12.8004 -12.8004 -12.7877 -12.7877 -11.6760 -11.6760 -11.6308 -11.6308 -11.5249 -11.5249 -11.5173 -11.5173 -0.4773 -0.4773 -0.3948 -0.3948 0.0042 0.0042 0.0233 0.0233 0.2681 0.2681 0.2855 0.2855 0.2877 0.2877 0.3868 0.3868 1.2626 1.2626 1.3756 1.3756 1.4221 1.4221 1.6827 1.6827 1.7566 1.7566 1.8543 1.8543 2.0410 2.0410 2.2155 2.2155 2.2492 2.2492 2.3092 2.3092 2.3475 2.3475 2.5825 2.5825 3.0310 3.0310 3.1406 3.1406 3.2772 3.2772 3.4807 3.4807 4.1386 4.1386 4.1690 4.1690 4.4606 4.4606 4.5509 4.5509 4.7588 4.7588 4.8349 4.8349 4.8501 4.8501 4.8662 4.8662 5.2081 5.2081 5.2411 5.2411 5.5124 5.5124 5.5936 5.5936 6.1598 6.1598 6.1805 6.1805 6.2923 6.2923 6.4378 6.4378 k = 0.4615-0.0000-0.0000 ( 5082 PWs) bands (ev): -12.9098 -12.9098 -12.8705 -12.8705 -12.8098 -12.8098 -12.7948 -12.7948 -11.6593 -11.6593 -11.6189 -11.6189 -11.5381 -11.5381 -11.5278 -11.5278 -0.4817 -0.4817 -0.4158 -0.4158 0.0002 0.0002 0.0165 0.0165 0.2828 0.2828 0.2920 0.2920 0.2927 0.2927 0.3786 0.3786 1.2678 1.2678 1.3579 1.3579 1.4494 1.4494 1.6754 1.6754 1.7800 1.7800 1.8705 1.8705 2.0081 2.0081 2.1759 2.1759 2.2601 2.2601 2.3408 2.3408 2.3442 2.3442 2.5633 2.5633 3.0490 3.0490 3.1757 3.1757 3.2462 3.2462 3.4500 3.4500 4.1374 4.1374 4.1624 4.1624 4.4719 4.4719 4.5446 4.5446 4.7625 4.7625 4.8294 4.8294 4.8445 4.8445 4.8611 4.8611 5.2066 5.2066 5.2333 5.2333 5.5207 5.5207 5.5862 5.5862 6.1619 6.1619 6.1784 6.1784 6.3045 6.3045 6.4211 6.4211 k = 0.4712-0.0000-0.0000 ( 5082 PWs) bands (ev): -12.8949 -12.8949 -12.8592 -12.8592 -12.8198 -12.8198 -12.8024 -12.8024 -11.6429 -11.6429 -11.6071 -11.6071 -11.5518 -11.5518 -11.5385 -11.5385 -0.4835 -0.4835 -0.4341 -0.4341 -0.0024 -0.0024 0.0104 0.0104 0.2951 0.2951 0.2960 0.2960 0.2998 0.2998 0.3695 0.3695 1.2741 1.2741 1.3416 1.3416 1.4780 1.4780 1.6553 1.6553 1.8045 1.8045 1.8994 1.8994 1.9759 1.9759 2.1357 2.1357 2.2717 2.2717 2.3348 2.3348 2.3762 2.3762 2.5422 2.5422 3.0685 3.0685 3.2109 3.2109 3.2168 3.2168 3.4181 3.4181 4.1373 4.1373 4.1564 4.1564 4.4829 4.4829 4.5377 4.5377 4.7678 4.7678 4.8208 4.8208 4.8426 4.8426 4.8566 4.8566 5.2062 5.2062 5.2263 5.2263 5.5291 5.5291 5.5785 5.5785 6.1640 6.1640 6.1765 6.1765 6.3173 6.3173 6.4048 6.4048 k = 0.4808-0.0000-0.0000 ( 5086 PWs) bands (ev): -12.8806 -12.8806 -12.8485 -12.8485 -12.8306 -12.8306 -12.8105 -12.8105 -11.6267 -11.6267 -11.5953 -11.5953 -11.5660 -11.5660 -11.5495 -11.5495 -0.4824 -0.4824 -0.4495 -0.4495 -0.0036 -0.0036 0.0052 0.0052 0.2991 0.2991 0.3003 0.3003 0.3120 0.3120 0.3595 0.3595 1.2818 1.2818 1.3267 1.3267 1.5076 1.5076 1.6287 1.6287 1.8302 1.8302 1.9348 1.9348 1.9448 1.9448 2.0951 2.0951 2.2834 2.2834 2.3264 2.3264 2.4079 2.4079 2.5190 2.5190 3.0895 3.0895 3.1882 3.1882 3.2467 3.2467 3.3852 3.3852 4.1382 4.1382 4.1510 4.1510 4.4934 4.4934 4.5300 4.5300 4.7744 4.7744 4.8108 4.8108 4.8428 4.8428 4.8526 4.8526 5.2069 5.2069 5.2203 5.2203 5.5375 5.5375 5.5705 5.5705 6.1662 6.1662 6.1745 6.1745 6.3306 6.3306 6.3889 6.3889 k = 0.4904-0.0000-0.0000 ( 5094 PWs) bands (ev): -12.8671 -12.8671 -12.8421 -12.8421 -12.8382 -12.8382 -12.8192 -12.8192 -11.6110 -11.6110 -11.5837 -11.5837 -11.5806 -11.5806 -11.5607 -11.5607 -0.4785 -0.4785 -0.4620 -0.4620 -0.0034 -0.0034 0.0011 0.0011 0.3014 0.3014 0.3023 0.3023 0.3248 0.3248 0.3487 0.3487 1.2909 1.2909 1.3133 1.3133 1.5379 1.5379 1.5992 1.5992 1.8571 1.8571 1.9143 1.9143 1.9737 1.9737 2.0544 2.0544 2.2951 2.2951 2.3168 2.3168 2.4383 2.4383 2.4939 2.4939 3.1119 3.1119 3.1613 3.1613 3.2820 3.2820 3.3515 3.3515 4.1400 4.1400 4.1465 4.1465 4.5034 4.5034 4.5218 4.5218 4.7822 4.7822 4.8007 4.8007 4.8441 4.8441 4.8491 4.8491 5.2086 5.2086 5.2154 5.2154 5.5458 5.5458 5.5624 5.5624 6.1683 6.1683 6.1724 6.1724 6.3444 6.3444 6.3735 6.3735 k = 0.5000-0.0000-0.0000 ( 5088 PWs) bands (ev): -12.8542 -12.8542 -12.8542 -12.8542 -12.8284 -12.8284 -12.8284 -12.8284 -11.5956 -11.5956 -11.5956 -11.5956 -11.5721 -11.5721 -11.5721 -11.5721 -0.4717 -0.4717 -0.4717 -0.4717 -0.0018 -0.0018 -0.0018 -0.0018 0.3025 0.3025 0.3025 0.3025 0.3371 0.3371 0.3371 0.3371 1.3013 1.3013 1.3013 1.3013 1.5686 1.5686 1.5686 1.5686 1.8852 1.8852 1.8852 1.8852 2.0137 2.0137 2.0137 2.0137 2.3063 2.3063 2.3063 2.3063 2.4670 2.4670 2.4670 2.4670 3.1359 3.1359 3.1359 3.1359 3.3170 3.3170 3.3170 3.3170 4.1428 4.1428 4.1428 4.1428 4.5129 4.5129 4.5129 4.5129 4.7910 4.7910 4.7910 4.7910 4.8463 4.8463 4.8463 4.8463 5.2115 5.2115 5.2115 5.2115 5.5542 5.5542 5.5542 5.5542 6.1704 6.1704 6.1704 6.1704 6.3587 6.3587 6.3587 6.3587 k = 0.5000-0.0000-0.0000 ( 5088 PWs) bands (ev): -12.8542 -12.8542 -12.8542 -12.8542 -12.8284 -12.8284 -12.8284 -12.8284 -11.5956 -11.5956 -11.5956 -11.5956 -11.5721 -11.5721 -11.5721 -11.5721 -0.4717 -0.4717 -0.4717 -0.4717 -0.0018 -0.0018 -0.0018 -0.0018 0.3025 0.3025 0.3025 0.3025 0.3371 0.3371 0.3371 0.3371 1.3013 1.3013 1.3013 1.3013 1.5686 1.5686 1.5686 1.5686 1.8852 1.8852 1.8852 1.8852 2.0137 2.0137 2.0137 2.0137 2.3063 2.3063 2.3063 2.3063 2.4670 2.4670 2.4670 2.4670 3.1359 3.1359 3.1359 3.1359 3.3170 3.3170 3.3170 3.3170 4.1428 4.1428 4.1428 4.1428 4.5129 4.5129 4.5129 4.5129 4.7910 4.7910 4.7910 4.7910 4.8463 4.8463 4.8463 4.8463 5.2115 5.2115 5.2115 5.2115 5.5542 5.5542 5.5542 5.5542 6.1704 6.1704 6.1704 6.1704 6.3587 6.3587 6.3587 6.3587 k = 0.5000 0.0094-0.0000 ( 5096 PWs) bands (ev): -12.8542 -12.8542 -12.8542 -12.8542 -12.8284 -12.8284 -12.8284 -12.8284 -11.5956 -11.5956 -11.5956 -11.5956 -11.5722 -11.5722 -11.5722 -11.5722 -0.4717 -0.4717 -0.4717 -0.4717 -0.0021 -0.0021 -0.0018 -0.0018 0.3023 0.3023 0.3024 0.3024 0.3375 0.3375 0.3375 0.3375 1.2979 1.2979 1.2993 1.2993 1.5683 1.5683 1.5695 1.5695 1.8845 1.8845 1.8851 1.8851 2.0159 2.0159 2.0160 2.0160 2.3055 2.3055 2.3059 2.3059 2.4668 2.4668 2.4672 2.4672 3.1372 3.1372 3.1374 3.1374 3.3171 3.3171 3.3173 3.3173 4.1422 4.1422 4.1437 4.1437 4.5129 4.5129 4.5130 4.5130 4.7906 4.7906 4.7915 4.7915 4.8461 4.8461 4.8464 4.8464 5.2099 5.2099 5.2121 5.2121 5.5536 5.5536 5.5539 5.5539 6.1689 6.1689 6.1708 6.1708 6.3589 6.3589 6.3604 6.3604 k = 0.5000 0.0188-0.0000 ( 5096 PWs) bands (ev): -12.8540 -12.8540 -12.8540 -12.8540 -12.8283 -12.8283 -12.8283 -12.8283 -11.5957 -11.5957 -11.5957 -11.5957 -11.5723 -11.5723 -11.5723 -11.5723 -0.4718 -0.4718 -0.4718 -0.4718 -0.0026 -0.0026 -0.0021 -0.0021 0.3017 0.3017 0.3019 0.3019 0.3386 0.3386 0.3387 0.3387 1.2893 1.2893 1.2920 1.2920 1.5684 1.5684 1.5707 1.5707 1.8833 1.8833 1.8845 1.8845 2.0225 2.0225 2.0226 2.0226 2.3035 2.3035 2.3043 2.3043 2.4666 2.4666 2.4675 2.4675 3.1415 3.1415 3.1418 3.1418 3.3177 3.3177 3.3181 3.3181 4.1419 4.1419 4.1448 4.1448 4.5132 4.5132 4.5132 4.5132 4.7901 4.7901 4.7919 4.7919 4.8459 4.8459 4.8465 4.8465 5.2075 5.2075 5.2120 5.2120 5.5524 5.5524 5.5529 5.5529 6.1665 6.1665 6.1702 6.1702 6.3611 6.3611 6.3639 6.3639 k = 0.5000 0.0281-0.0000 ( 5100 PWs) bands (ev): -12.8537 -12.8537 -12.8536 -12.8536 -12.8282 -12.8282 -12.8281 -12.8281 -11.5959 -11.5959 -11.5958 -11.5958 -11.5726 -11.5726 -11.5726 -11.5726 -0.4720 -0.4720 -0.4719 -0.4719 -0.0034 -0.0034 -0.0026 -0.0026 0.3008 0.3008 0.3012 0.3012 0.3403 0.3403 0.3404 0.3404 1.2760 1.2760 1.2799 1.2799 1.5685 1.5685 1.5717 1.5717 1.8815 1.8815 1.8834 1.8834 2.0331 2.0331 2.0334 2.0334 2.3004 2.3004 2.3015 2.3015 2.4664 2.4664 2.4677 2.4677 3.1486 3.1486 3.1491 3.1491 3.3187 3.3187 3.3192 3.3192 4.1419 4.1419 4.1462 4.1462 4.5135 4.5135 4.5136 4.5136 4.7897 4.7897 4.7923 4.7923 4.8456 4.8456 4.8466 4.8466 5.2042 5.2042 5.2109 5.2109 5.5503 5.5503 5.5511 5.5511 6.1634 6.1634 6.1686 6.1686 6.3651 6.3651 6.3691 6.3691 k = 0.5000 0.0375-0.0000 ( 5096 PWs) bands (ev): -12.8533 -12.8533 -12.8532 -12.8532 -12.8280 -12.8280 -12.8278 -12.8278 -11.5961 -11.5961 -11.5960 -11.5960 -11.5730 -11.5730 -11.5730 -11.5730 -0.4722 -0.4722 -0.4721 -0.4721 -0.0044 -0.0044 -0.0034 -0.0034 0.2998 0.2998 0.3002 0.3002 0.3424 0.3424 0.3426 0.3426 1.2591 1.2591 1.2639 1.2639 1.5683 1.5683 1.5722 1.5722 1.8793 1.8793 1.8819 1.8819 2.0476 2.0476 2.0478 2.0478 2.2963 2.2963 2.2977 2.2977 2.4662 2.4662 2.4679 2.4679 3.1584 3.1584 3.1590 3.1590 3.3200 3.3200 3.3208 3.3208 4.1423 4.1423 4.1480 4.1480 4.5141 4.5141 4.5142 4.5142 4.7893 4.7893 4.7927 4.7927 4.8454 4.8454 4.8467 4.8467 5.2003 5.2003 5.2091 5.2091 5.5475 5.5475 5.5485 5.5485 6.1596 6.1596 6.1662 6.1662 6.3709 6.3709 6.3759 6.3759 k = 0.5000 0.0469-0.0000 ( 5088 PWs) bands (ev): -12.8528 -12.8528 -12.8527 -12.8527 -12.8277 -12.8277 -12.8275 -12.8275 -11.5963 -11.5963 -11.5963 -11.5963 -11.5735 -11.5735 -11.5735 -11.5735 -0.4724 -0.4724 -0.4722 -0.4722 -0.0056 -0.0056 -0.0044 -0.0044 0.2986 0.2986 0.2992 0.2992 0.3449 0.3449 0.3452 0.3452 1.2392 1.2392 1.2448 1.2448 1.5674 1.5674 1.5717 1.5717 1.8769 1.8769 1.8801 1.8801 2.0653 2.0653 2.0655 2.0655 2.2913 2.2913 2.2928 2.2928 2.4659 2.4659 2.4678 2.4678 3.1709 3.1709 3.1717 3.1717 3.3218 3.3218 3.3227 3.3227 4.1429 4.1429 4.1500 4.1500 4.5147 4.5147 4.5149 4.5149 4.7888 4.7888 4.7932 4.7932 4.8453 4.8453 4.8468 4.8468 5.1956 5.1956 5.2064 5.2064 5.5440 5.5440 5.5451 5.5451 6.1553 6.1553 6.1632 6.1632 6.3781 6.3781 6.3838 6.3838 k = 0.5000 0.0563-0.0000 ( 5080 PWs) bands (ev): -12.8521 -12.8521 -12.8520 -12.8520 -12.8273 -12.8273 -12.8271 -12.8271 -11.5966 -11.5966 -11.5966 -11.5966 -11.5741 -11.5741 -11.5741 -11.5741 -0.4726 -0.4726 -0.4724 -0.4724 -0.0071 -0.0071 -0.0056 -0.0056 0.2975 0.2975 0.2981 0.2981 0.3475 0.3475 0.3479 0.3479 1.2173 1.2173 1.2234 1.2234 1.5654 1.5654 1.5700 1.5700 1.8743 1.8743 1.8781 1.8781 2.0859 2.0859 2.0860 2.0860 2.2855 2.2855 2.2871 2.2871 2.4654 2.4654 2.4674 2.4674 3.1860 3.1860 3.1869 3.1869 3.3239 3.3239 3.3249 3.3249 4.1438 4.1438 4.1522 4.1522 4.5155 4.5155 4.5158 4.5158 4.7884 4.7884 4.7936 4.7936 4.8451 4.8451 4.8469 4.8469 5.1902 5.1902 5.2029 5.2029 5.5397 5.5397 5.5409 5.5409 6.1508 6.1508 6.1596 6.1596 6.3864 6.3864 6.3927 6.3927 k = 0.5000 0.0656-0.0000 ( 5088 PWs) bands (ev): -12.8514 -12.8514 -12.8512 -12.8512 -12.8269 -12.8269 -12.8267 -12.8267 -11.5970 -11.5970 -11.5970 -11.5970 -11.5748 -11.5748 -11.5748 -11.5748 -0.4727 -0.4727 -0.4725 -0.4725 -0.0087 -0.0087 -0.0071 -0.0071 0.2963 0.2963 0.2969 0.2969 0.3500 0.3500 0.3505 0.3505 1.1939 1.1939 1.2005 1.2005 1.5621 1.5621 1.5669 1.5669 1.8715 1.8715 1.8760 1.8760 2.1087 2.1087 2.1088 2.1088 2.2791 2.2791 2.2806 2.2806 2.4646 2.4646 2.4666 2.4666 3.2036 3.2036 3.2046 3.2046 3.3263 3.3263 3.3274 3.3274 4.1451 4.1451 4.1548 4.1548 4.5164 4.5164 4.5167 4.5167 4.7880 4.7880 4.7940 4.7940 4.8448 4.8448 4.8469 4.8469 5.1842 5.1842 5.1988 5.1988 5.5347 5.5347 5.5359 5.5359 6.1461 6.1461 6.1557 6.1557 6.3957 6.3957 6.4024 6.4024 k = 0.5000 0.0750-0.0000 ( 5088 PWs) bands (ev): -12.8505 -12.8505 -12.8504 -12.8504 -12.8265 -12.8265 -12.8262 -12.8262 -11.5974 -11.5974 -11.5974 -11.5974 -11.5756 -11.5756 -11.5756 -11.5756 -0.4728 -0.4728 -0.4725 -0.4725 -0.0105 -0.0105 -0.0087 -0.0087 0.2950 0.2950 0.2958 0.2958 0.3524 0.3524 0.3530 0.3530 1.1697 1.1697 1.1767 1.1767 1.5576 1.5576 1.5624 1.5624 1.8687 1.8687 1.8738 1.8738 2.1332 2.1332 2.1336 2.1336 2.2722 2.2722 2.2736 2.2736 2.4635 2.4635 2.4655 2.4655 3.2234 3.2234 3.2245 3.2245 3.3290 3.3290 3.3302 3.3302 4.1467 4.1467 4.1577 4.1577 4.5174 4.5174 4.5177 4.5177 4.7875 4.7875 4.7944 4.7944 4.8446 4.8446 4.8470 4.8470 5.1778 5.1778 5.1940 5.1940 5.5289 5.5289 5.5301 5.5301 6.1413 6.1413 6.1515 6.1515 6.4057 6.4057 6.4126 6.4126 k = 0.5000 0.0844-0.0000 ( 5088 PWs) bands (ev): -12.8496 -12.8496 -12.8494 -12.8494 -12.8260 -12.8260 -12.8257 -12.8257 -11.5979 -11.5979 -11.5978 -11.5978 -11.5765 -11.5765 -11.5764 -11.5764 -0.4727 -0.4727 -0.4724 -0.4724 -0.0125 -0.0125 -0.0105 -0.0105 0.2938 0.2938 0.2946 0.2946 0.3544 0.3544 0.3552 0.3552 1.1453 1.1453 1.1525 1.1525 1.5519 1.5519 1.5567 1.5567 1.8658 1.8658 1.8716 1.8716 2.1590 2.1590 2.1598 2.1598 2.2649 2.2649 2.2663 2.2663 2.4620 2.4620 2.4638 2.4638 3.2453 3.2453 3.2465 3.2465 3.3320 3.3320 3.3332 3.3332 4.1487 4.1487 4.1608 4.1608 4.5186 4.5186 4.5188 4.5188 4.7871 4.7871 4.7948 4.7948 4.8444 4.8444 4.8470 4.8470 5.1709 5.1709 5.1887 5.1887 5.5224 5.5224 5.5235 5.5235 6.1366 6.1366 6.1473 6.1473 6.4162 6.4162 6.4231 6.4231 k = 0.5000 0.0938-0.0000 ( 5088 PWs) bands (ev): -12.8486 -12.8486 -12.8483 -12.8483 -12.8254 -12.8254 -12.8251 -12.8251 -11.5983 -11.5983 -11.5983 -11.5983 -11.5775 -11.5775 -11.5774 -11.5774 -0.4725 -0.4725 -0.4722 -0.4722 -0.0146 -0.0146 -0.0125 -0.0125 0.2926 0.2926 0.2934 0.2934 0.3559 0.3559 0.3568 0.3568 1.1212 1.1212 1.1285 1.1285 1.5451 1.5451 1.5498 1.5498 1.8631 1.8631 1.8694 1.8694 2.1852 2.1852 2.1868 2.1868 2.2575 2.2575 2.2592 2.2592 2.4600 2.4600 2.4616 2.4616 3.2691 3.2691 3.2704 3.2704 3.3352 3.3352 3.3364 3.3364 4.1510 4.1510 4.1643 4.1643 4.5197 4.5197 4.5200 4.5200 4.7868 4.7868 4.7952 4.7952 4.8442 4.8442 4.8470 4.8470 5.1637 5.1637 5.1828 5.1828 5.5151 5.5151 5.5161 5.5161 6.1320 6.1320 6.1430 6.1430 6.4269 6.4269 6.4337 6.4337 k = 0.5000 0.1032-0.0000 ( 5090 PWs) bands (ev): -12.8474 -12.8474 -12.8472 -12.8472 -12.8248 -12.8248 -12.8245 -12.8245 -11.5989 -11.5989 -11.5988 -11.5988 -11.5785 -11.5785 -11.5784 -11.5784 -0.4720 -0.4720 -0.4717 -0.4717 -0.0168 -0.0168 -0.0146 -0.0146 0.2913 0.2913 0.2922 0.2922 0.3568 0.3568 0.3578 0.3578 1.0976 1.0976 1.1051 1.1051 1.5373 1.5373 1.5419 1.5419 1.8604 1.8604 1.8673 1.8673 2.2101 2.2101 2.2135 2.2135 2.2508 2.2508 2.2538 2.2538 2.4575 2.4575 2.4588 2.4588 3.2946 3.2946 3.2961 3.2961 3.3387 3.3387 3.3397 3.3397 4.1537 4.1537 4.1681 4.1681 4.5209 4.5209 4.5212 4.5212 4.7865 4.7865 4.7957 4.7957 4.8440 4.8440 4.8470 4.8470 5.1562 5.1562 5.1766 5.1766 5.5071 5.5071 5.5079 5.5079 6.1275 6.1275 6.1387 6.1387 6.4377 6.4377 6.4444 6.4444 k = 0.5000 0.1125-0.0000 ( 5078 PWs) bands (ev): -12.8463 -12.8463 -12.8460 -12.8460 -12.8242 -12.8242 -12.8238 -12.8238 -11.5994 -11.5994 -11.5994 -11.5994 -11.5796 -11.5796 -11.5795 -11.5795 -0.4713 -0.4713 -0.4711 -0.4711 -0.0191 -0.0191 -0.0167 -0.0167 0.2899 0.2899 0.2909 0.2909 0.3568 0.3568 0.3580 0.3580 1.0750 1.0750 1.0827 1.0827 1.5286 1.5286 1.5331 1.5331 1.8579 1.8579 1.8653 1.8653 2.2255 2.2255 2.2318 2.2318 2.2527 2.2527 2.2580 2.2580 2.4545 2.4545 2.4554 2.4554 3.3212 3.3212 3.3232 3.3232 3.3429 3.3429 3.3433 3.3433 4.1568 4.1568 4.1722 4.1722 4.5222 4.5222 4.5225 4.5225 4.7862 4.7862 4.7961 4.7961 4.8439 4.8439 4.8470 4.8470 5.1485 5.1485 5.1700 5.1700 5.4984 5.4984 5.4989 5.4989 6.1233 6.1233 6.1346 6.1346 6.4485 6.4485 6.4548 6.4548 k = 0.5000 0.1219-0.0000 ( 5078 PWs) bands (ev): -12.8450 -12.8450 -12.8447 -12.8447 -12.8236 -12.8236 -12.8231 -12.8231 -11.6000 -11.6000 -11.5999 -11.5999 -11.5808 -11.5808 -11.5807 -11.5807 -0.4704 -0.4704 -0.4701 -0.4701 -0.0215 -0.0215 -0.0190 -0.0190 0.2884 0.2884 0.2895 0.2895 0.3560 0.3560 0.3572 0.3572 1.0537 1.0537 1.0615 1.0615 1.5193 1.5193 1.5237 1.5237 1.8556 1.8556 1.8635 1.8635 2.2241 2.2241 2.2287 2.2287 2.2759 2.2759 2.2788 2.2788 2.4509 2.4509 2.4514 2.4514 3.3415 3.3415 3.3451 3.3451 3.3537 3.3537 3.3548 3.3548 4.1603 4.1603 4.1765 4.1765 4.5234 4.5234 4.5237 4.5237 4.7860 4.7860 4.7966 4.7966 4.8438 4.8438 4.8471 4.8471 5.1407 5.1407 5.1632 5.1632 5.4890 5.4890 5.4892 5.4892 6.1192 6.1192 6.1305 6.1305 6.4590 6.4590 6.4650 6.4650 k = 0.5000 0.1313-0.0000 ( 5090 PWs) bands (ev): -12.8437 -12.8437 -12.8434 -12.8434 -12.8229 -12.8229 -12.8224 -12.8224 -11.6006 -11.6006 -11.6006 -11.6006 -11.5820 -11.5820 -11.5819 -11.5819 -0.4692 -0.4692 -0.4689 -0.4689 -0.0239 -0.0239 -0.0214 -0.0214 0.2867 0.2867 0.2879 0.2879 0.3540 0.3540 0.3553 0.3553 1.0340 1.0340 1.0418 1.0418 1.5094 1.5094 1.5137 1.5137 1.8536 1.8536 1.8620 1.8620 2.2171 2.2171 2.2212 2.2212 2.3033 2.3033 2.3049 2.3049 2.4467 2.4467 2.4468 2.4468 3.3471 3.3471 3.3493 3.3493 3.3826 3.3826 3.3828 3.3828 4.1642 4.1642 4.1811 4.1811 4.5246 4.5246 4.5248 4.5248 4.7858 4.7858 4.7971 4.7971 4.8438 4.8438 4.8471 4.8471 5.1328 5.1328 5.1561 5.1561 5.4788 5.4788 5.4788 5.4788 6.1153 6.1153 6.1266 6.1266 6.4691 6.4691 6.4747 6.4747 k = 0.5000 0.1407-0.0000 ( 5090 PWs) bands (ev): -12.8423 -12.8423 -12.8420 -12.8420 -12.8222 -12.8222 -12.8217 -12.8217 -11.6013 -11.6013 -11.6012 -11.6012 -11.5832 -11.5832 -11.5831 -11.5831 -0.4676 -0.4676 -0.4673 -0.4673 -0.0263 -0.0263 -0.0238 -0.0238 0.2847 0.2847 0.2860 0.2860 0.3510 0.3510 0.3522 0.3522 1.0161 1.0161 1.0239 1.0239 1.4991 1.4991 1.5033 1.5033 1.8520 1.8520 1.8607 1.8607 2.2090 2.2090 2.2131 2.2131 2.3309 2.3309 2.3315 2.3315 2.4415 2.4415 2.4423 2.4423 3.3510 3.3510 3.3528 3.3528 3.4133 3.4133 3.4138 3.4138 4.1684 4.1684 4.1860 4.1860 4.5256 4.5256 4.5259 4.5259 4.7857 4.7857 4.7976 4.7976 4.8439 4.8439 4.8471 4.8471 5.1249 5.1249 5.1490 5.1490 5.4677 5.4677 5.4680 5.4680 6.1117 6.1117 6.1228 6.1228 6.4788 6.4788 6.4838 6.4838 k = 0.5000 0.1501-0.0000 ( 5088 PWs) bands (ev): -12.8409 -12.8409 -12.8405 -12.8405 -12.8215 -12.8215 -12.8210 -12.8210 -11.6019 -11.6019 -11.6018 -11.6018 -11.5845 -11.5845 -11.5844 -11.5844 -0.4657 -0.4657 -0.4654 -0.4654 -0.0288 -0.0288 -0.0262 -0.0262 0.2824 0.2824 0.2839 0.2839 0.3469 0.3469 0.3481 0.3481 1.0002 1.0002 1.0078 1.0078 1.4885 1.4885 1.4925 1.4925 1.8508 1.8508 1.8598 1.8598 2.2005 2.2005 2.2048 2.2048 2.3575 2.3575 2.3579 2.3579 2.4359 2.4359 2.4377 2.4377 3.3545 3.3545 3.3562 3.3562 3.4452 3.4452 3.4457 3.4457 4.1729 4.1729 4.1911 4.1911 4.5266 4.5266 4.5269 4.5269 4.7858 4.7858 4.7981 4.7981 4.8441 4.8441 4.8472 4.8472 5.1172 5.1172 5.1419 5.1419 5.4560 5.4560 5.4566 5.4566 6.1082 6.1082 6.1192 6.1192 6.4879 6.4879 6.4924 6.4924 k = 0.5000 0.1594-0.0000 ( 5088 PWs) bands (ev): -12.8394 -12.8394 -12.8391 -12.8391 -12.8208 -12.8208 -12.8203 -12.8203 -11.6025 -11.6025 -11.6024 -11.6024 -11.5858 -11.5858 -11.5857 -11.5857 -0.4633 -0.4633 -0.4631 -0.4631 -0.0312 -0.0312 -0.0287 -0.0287 0.2797 0.2797 0.2813 0.2813 0.3417 0.3417 0.3428 0.3428 0.9863 0.9863 0.9939 0.9939 1.4777 1.4777 1.4816 1.4816 1.8500 1.8500 1.8593 1.8593 2.1919 2.1919 2.1966 2.1966 2.3814 2.3814 2.3837 2.3837 2.4302 2.4302 2.4341 2.4341 3.3579 3.3579 3.3594 3.3594 3.4779 3.4779 3.4783 3.4783 4.1778 4.1778 4.1964 4.1964 4.5274 4.5274 4.5276 4.5276 4.7859 4.7859 4.7986 4.7986 4.8443 4.8443 4.8473 4.8473 5.1097 5.1097 5.1347 5.1347 5.4437 5.4437 5.4446 5.4446 6.1050 6.1050 6.1157 6.1157 6.4963 6.4963 6.5003 6.5003 k = 0.5000 0.1688-0.0000 ( 5076 PWs) bands (ev): -12.8380 -12.8380 -12.8376 -12.8376 -12.8201 -12.8201 -12.8196 -12.8196 -11.6032 -11.6032 -11.6031 -11.6031 -11.5871 -11.5871 -11.5870 -11.5870 -0.4606 -0.4606 -0.4604 -0.4604 -0.0336 -0.0336 -0.0311 -0.0311 0.2763 0.2763 0.2781 0.2781 0.3357 0.3357 0.3366 0.3366 0.9745 0.9745 0.9820 0.9820 1.4668 1.4668 1.4706 1.4706 1.8497 1.8497 1.8593 1.8593 2.1835 2.1835 2.1886 2.1886 2.3991 2.3991 2.4052 2.4052 2.4275 2.4275 2.4353 2.4353 3.3612 3.3612 3.3625 3.3625 3.5111 3.5111 3.5115 3.5115 4.1830 4.1830 4.2018 4.2018 4.5279 4.5279 4.5282 4.5282 4.7861 4.7861 4.7991 4.7991 4.8447 4.8447 4.8474 4.8474 5.1024 5.1024 5.1278 5.1278 5.4309 5.4309 5.4321 5.4321 6.1021 6.1021 6.1125 6.1125 6.5040 6.5040 6.5075 6.5075 k = 0.5000 0.1782-0.0000 ( 5076 PWs) bands (ev): -12.8365 -12.8365 -12.8361 -12.8361 -12.8195 -12.8195 -12.8189 -12.8189 -11.6038 -11.6038 -11.6037 -11.6037 -11.5885 -11.5885 -11.5883 -11.5883 -0.4576 -0.4576 -0.4573 -0.4573 -0.0360 -0.0360 -0.0336 -0.0336 0.2720 0.2720 0.2741 0.2741 0.3291 0.3291 0.3297 0.3297 0.9649 0.9649 0.9722 0.9722 1.4559 1.4559 1.4597 1.4597 1.8499 1.8499 1.8597 1.8597 2.1752 2.1752 2.1806 2.1806 2.4036 2.4036 2.4090 2.4090 2.4409 2.4409 2.4482 2.4482 3.3643 3.3643 3.3655 3.3655 3.5445 3.5445 3.5449 3.5449 4.1884 4.1884 4.2073 4.2073 4.5282 4.5282 4.5284 4.5284 4.7864 4.7864 4.7997 4.7997 4.8453 4.8453 4.8476 4.8476 5.0954 5.0954 5.1210 5.1210 5.4176 5.4176 5.4190 5.4190 6.0994 6.0994 6.1093 6.1093 6.5109 6.5109 6.5138 6.5138 k = 0.5000 0.1876-0.0000 ( 5076 PWs) bands (ev): -12.8350 -12.8350 -12.8346 -12.8346 -12.8188 -12.8188 -12.8183 -12.8183 -11.6045 -11.6045 -11.6043 -11.6043 -11.5898 -11.5898 -11.5896 -11.5896 -0.4541 -0.4541 -0.4539 -0.4539 -0.0383 -0.0383 -0.0360 -0.0360 0.2666 0.2666 0.2689 0.2689 0.3224 0.3224 0.3227 0.3227 0.9573 0.9573 0.9643 0.9643 1.4451 1.4451 1.4487 1.4487 1.8507 1.8507 1.8605 1.8605 2.1671 2.1671 2.1729 2.1729 2.3995 2.3995 2.4027 2.4027 2.4629 2.4629 2.4681 2.4681 3.3673 3.3673 3.3683 3.3683 3.5781 3.5781 3.5784 3.5784 4.1939 4.1939 4.2128 4.2128 4.5282 4.5282 4.5284 4.5284 4.7869 4.7869 4.8001 4.8001 4.8459 4.8459 4.8478 4.8478 5.0888 5.0888 5.1145 5.1145 5.4039 5.4039 5.4055 5.4055 6.0968 6.0968 6.1064 6.1064 6.5170 6.5170 6.5194 6.5194 k = 0.5000 0.1969-0.0000 ( 5076 PWs) bands (ev): -12.8335 -12.8335 -12.8331 -12.8331 -12.8182 -12.8182 -12.8176 -12.8176 -11.6051 -11.6051 -11.6050 -11.6050 -11.5910 -11.5910 -11.5909 -11.5909 -0.4503 -0.4503 -0.4501 -0.4501 -0.0406 -0.0406 -0.0383 -0.0383 0.2597 0.2597 0.2623 0.2623 0.3159 0.3159 0.3160 0.3160 0.9516 0.9516 0.9584 0.9584 1.4345 1.4345 1.4380 1.4380 1.8520 1.8520 1.8619 1.8619 2.1593 2.1593 2.1654 2.1654 2.3927 2.3927 2.3947 2.3947 2.4850 2.4850 2.4891 2.4891 3.3701 3.3701 3.3710 3.3710 3.6115 3.6115 3.6117 3.6117 4.1997 4.1997 4.2183 4.2183 4.5277 4.5277 4.5280 4.5280 4.7874 4.7874 4.8005 4.8005 4.8467 4.8467 4.8481 4.8481 5.0828 5.0828 5.1083 5.1083 5.3899 5.3899 5.3917 5.3917 6.0945 6.0945 6.1036 6.1036 6.5224 6.5224 6.5243 6.5243 k = 0.5000 0.2063-0.0000 ( 5078 PWs) bands (ev): -12.8321 -12.8321 -12.8316 -12.8316 -12.8177 -12.8177 -12.8170 -12.8170 -11.6057 -11.6057 -11.6055 -11.6055 -11.5923 -11.5923 -11.5921 -11.5921 -0.4461 -0.4461 -0.4460 -0.4460 -0.0428 -0.0428 -0.0406 -0.0406 0.2514 0.2514 0.2540 0.2540 0.3101 0.3101 0.3102 0.3102 0.9477 0.9477 0.9541 0.9541 1.4241 1.4241 1.4275 1.4275 1.8539 1.8539 1.8638 1.8638 2.1518 2.1518 2.1582 2.1582 2.3848 2.3848 2.3861 2.3861 2.5061 2.5061 2.5097 2.5097 3.3728 3.3728 3.3735 3.3735 3.6446 3.6446 3.6447 3.6447 4.2055 4.2055 4.2238 4.2238 4.5268 4.5268 4.5271 4.5271 4.7880 4.7880 4.8009 4.8009 4.8476 4.8476 4.8484 4.8484 5.0773 5.0773 5.1025 5.1025 5.3757 5.3757 5.3776 5.3776 6.0924 6.0924 6.1010 6.1010 6.5270 6.5270 6.5284 6.5284 k = 0.5000 0.2157-0.0000 ( 5086 PWs) bands (ev): -12.8306 -12.8306 -12.8301 -12.8301 -12.8171 -12.8171 -12.8165 -12.8165 -11.6062 -11.6062 -11.6061 -11.6061 -11.5935 -11.5935 -11.5934 -11.5934 -0.4417 -0.4417 -0.4415 -0.4415 -0.0449 -0.0449 -0.0429 -0.0429 0.2415 0.2415 0.2442 0.2442 0.3050 0.3050 0.3053 0.3053 0.9453 0.9453 0.9513 0.9513 1.4140 1.4140 1.4173 1.4173 1.8563 1.8563 1.8661 1.8661 2.1446 2.1446 2.1512 2.1512 2.3764 2.3764 2.3772 2.3772 2.5260 2.5260 2.5291 2.5291 3.3753 3.3753 3.3759 3.3759 3.6770 3.6770 3.6770 3.6770 4.2114 4.2114 4.2291 4.2291 4.5255 4.5255 4.5258 4.5258 4.7888 4.7888 4.8012 4.8012 4.8486 4.8486 4.8488 4.8488 5.0724 5.0724 5.0972 5.0972 5.3613 5.3613 5.3633 5.3633 6.0905 6.0905 6.0986 6.0986 6.5308 6.5308 6.5318 6.5318 k = 0.5000 0.2251-0.0000 ( 5098 PWs) bands (ev): -12.8293 -12.8293 -12.8287 -12.8287 -12.8167 -12.8167 -12.8160 -12.8160 -11.6068 -11.6068 -11.6067 -11.6067 -11.5947 -11.5947 -11.5945 -11.5945 -0.4370 -0.4370 -0.4369 -0.4369 -0.0470 -0.0470 -0.0450 -0.0450 0.2305 0.2305 0.2331 0.2331 0.3008 0.3008 0.3012 0.3012 0.9442 0.9442 0.9499 0.9499 1.4044 1.4044 1.4075 1.4075 1.8593 1.8593 1.8689 1.8689 2.1378 2.1378 2.1445 2.1445 2.3678 2.3678 2.3682 2.3682 2.5446 2.5446 2.5473 2.5473 3.3776 3.3776 3.3780 3.3780 3.7084 3.7084 3.7085 3.7085 4.2172 4.2172 4.2342 4.2342 4.5237 4.5237 4.5240 4.5240 4.7896 4.7896 4.8015 4.8015 4.8492 4.8492 4.8497 4.8497 5.0683 5.0683 5.0924 5.0924 5.3470 5.3470 5.3490 5.3490 6.0889 6.0889 6.0963 6.0963 6.5340 6.5340 6.5346 6.5346 k = 0.5000 0.2345-0.0000 ( 5102 PWs) bands (ev): -12.8279 -12.8279 -12.8274 -12.8274 -12.8162 -12.8162 -12.8156 -12.8156 -11.6073 -11.6073 -11.6072 -11.6072 -11.5958 -11.5958 -11.5956 -11.5956 -0.4322 -0.4322 -0.4321 -0.4321 -0.0489 -0.0489 -0.0471 -0.0471 0.2187 0.2187 0.2212 0.2212 0.2975 0.2975 0.2978 0.2978 0.9442 0.9442 0.9495 0.9495 1.3952 1.3952 1.3981 1.3981 1.8627 1.8627 1.8720 1.8720 2.1313 2.1313 2.1381 2.1381 2.3591 2.3591 2.3592 2.3592 2.5617 2.5617 2.5642 2.5642 3.3797 3.3797 3.3801 3.3801 3.7388 3.7388 3.7389 3.7389 4.2230 4.2230 4.2391 4.2391 4.5215 4.5215 4.5218 4.5218 4.7905 4.7905 4.8017 4.8017 4.8497 4.8497 4.8507 4.8507 5.0651 5.0651 5.0883 5.0883 5.3328 5.3328 5.3347 5.3347 6.0874 6.0874 6.0942 6.0942 6.5366 6.5366 6.5369 6.5369 k = 0.5000 0.2438-0.0000 ( 5098 PWs) bands (ev): -12.8266 -12.8266 -12.8261 -12.8261 -12.8159 -12.8159 -12.8152 -12.8152 -11.6077 -11.6077 -11.6076 -11.6076 -11.5968 -11.5968 -11.5967 -11.5967 -0.4273 -0.4273 -0.4272 -0.4272 -0.0507 -0.0507 -0.0491 -0.0491 0.2066 0.2066 0.2089 0.2089 0.2947 0.2947 0.2950 0.2950 0.9450 0.9450 0.9499 0.9499 1.3865 1.3865 1.3893 1.3893 1.8665 1.8665 1.8754 1.8754 2.1253 2.1253 2.1320 2.1320 2.3504 2.3504 2.3505 2.3505 2.5773 2.5773 2.5795 2.5795 3.3817 3.3817 3.3819 3.3819 3.7676 3.7676 3.7678 3.7678 4.2287 4.2287 4.2438 4.2438 4.5189 4.5189 4.5193 4.5193 4.7915 4.7915 4.8018 4.8018 4.8503 4.8503 4.8518 4.8518 5.0627 5.0627 5.0848 5.0848 5.3190 5.3190 5.3207 5.3207 6.0861 6.0861 6.0923 6.0923 6.5387 6.5387 6.5388 6.5388 k = 0.5000 0.2532-0.0000 ( 5098 PWs) bands (ev): -12.8254 -12.8254 -12.8249 -12.8249 -12.8156 -12.8156 -12.8149 -12.8149 -11.6082 -11.6082 -11.6080 -11.6080 -11.5978 -11.5978 -11.5976 -11.5976 -0.4224 -0.4224 -0.4224 -0.4224 -0.0524 -0.0524 -0.0509 -0.0509 0.1946 0.1946 0.1967 0.1967 0.2925 0.2925 0.2927 0.2927 0.9465 0.9465 0.9510 0.9510 1.3785 1.3785 1.3811 1.3811 1.8706 1.8706 1.8791 1.8791 2.1197 2.1197 2.1262 2.1262 2.3420 2.3420 2.3423 2.3423 2.5914 2.5914 2.5933 2.5933 3.3834 3.3834 3.3835 3.3835 3.7948 3.7948 3.7950 3.7950 4.2341 4.2341 4.2480 4.2480 4.5159 4.5159 4.5163 4.5163 4.7924 4.7924 4.8018 4.8018 4.8509 4.8509 4.8528 4.8528 5.0613 5.0613 5.0821 5.0821 5.3055 5.3055 5.3071 5.3071 6.0850 6.0850 6.0906 6.0906 6.5402 6.5402 6.5403 6.5403 k = 0.5000 0.2626-0.0000 ( 5098 PWs) bands (ev): -12.8243 -12.8243 -12.8237 -12.8237 -12.8153 -12.8153 -12.8147 -12.8147 -11.6085 -11.6085 -11.6084 -11.6084 -11.5986 -11.5986 -11.5985 -11.5985 -0.4177 -0.4177 -0.4176 -0.4176 -0.0539 -0.0539 -0.0527 -0.0527 0.1831 0.1831 0.1849 0.1849 0.2906 0.2906 0.2908 0.2908 0.9485 0.9485 0.9524 0.9524 1.3712 1.3712 1.3735 1.3735 1.8749 1.8749 1.8828 1.8828 2.1145 2.1145 2.1208 2.1208 2.3341 2.3341 2.3345 2.3345 2.6039 2.6039 2.6056 2.6056 3.3850 3.3850 3.3850 3.3850 3.8199 3.8199 3.8202 3.8202 4.2393 4.2393 4.2519 4.2519 4.5127 4.5127 4.5130 4.5130 4.7934 4.7934 4.8017 4.8017 4.8515 4.8515 4.8537 4.8537 5.0608 5.0608 5.0799 5.0799 5.2927 5.2927 5.2940 5.2940 6.0841 6.0841 6.0891 6.0891 6.5412 6.5412 6.5415 6.5415 k = 0.5000 0.2720-0.0000 ( 5102 PWs) bands (ev): -12.8232 -12.8232 -12.8227 -12.8227 -12.8151 -12.8151 -12.8146 -12.8146 -11.6088 -11.6088 -11.6087 -11.6087 -11.5994 -11.5994 -11.5993 -11.5993 -0.4132 -0.4132 -0.4131 -0.4131 -0.0553 -0.0553 -0.0542 -0.0542 0.1724 0.1724 0.1740 0.1740 0.2890 0.2890 0.2892 0.2892 0.9506 0.9506 0.9541 0.9541 1.3647 1.3647 1.3667 1.3667 1.8793 1.8793 1.8864 1.8864 2.1099 2.1099 2.1158 2.1158 2.3269 2.3269 2.3273 2.3273 2.6148 2.6148 2.6162 2.6162 3.3863 3.3863 3.3863 3.3863 3.8426 3.8426 3.8429 3.8429 4.2442 4.2442 4.2553 4.2553 4.5092 4.5092 4.5096 4.5096 4.7944 4.7944 4.8016 4.8016 4.8522 4.8522 4.8545 4.8545 5.0612 5.0612 5.0783 5.0783 5.2808 5.2808 5.2818 5.2818 6.0834 6.0834 6.0877 6.0877 6.5420 6.5420 6.5423 6.5423 k = 0.5000 0.2814-0.0000 ( 5098 PWs) bands (ev): -12.8223 -12.8223 -12.8218 -12.8218 -12.8150 -12.8150 -12.8145 -12.8145 -11.6091 -11.6091 -11.6090 -11.6090 -11.6001 -11.6001 -11.6000 -11.6000 -0.4091 -0.4091 -0.4090 -0.4090 -0.0566 -0.0566 -0.0556 -0.0556 0.1629 0.1629 0.1642 0.1642 0.2877 0.2877 0.2878 0.2878 0.9528 0.9528 0.9558 0.9558 1.3590 1.3590 1.3608 1.3608 1.8835 1.8835 1.8897 1.8897 2.1060 2.1060 2.1112 2.1112 2.3205 2.3205 2.3209 2.3209 2.6241 2.6241 2.6253 2.6253 3.3874 3.3874 3.3874 3.3874 3.8626 3.8626 3.8629 3.8629 4.2486 4.2486 4.2581 4.2581 4.5059 4.5059 4.5062 4.5062 4.7953 4.7953 4.8013 4.8013 4.8528 4.8528 4.8551 4.8551 5.0624 5.0624 5.0773 5.0773 5.2699 5.2699 5.2707 5.2707 6.0829 6.0829 6.0864 6.0864 6.5426 6.5426 6.5429 6.5429 k = 0.5000 0.2907-0.0000 ( 5096 PWs) bands (ev): -12.8214 -12.8214 -12.8210 -12.8210 -12.8149 -12.8149 -12.8144 -12.8144 -11.6093 -11.6093 -11.6092 -11.6092 -11.6006 -11.6006 -11.6005 -11.6005 -0.4055 -0.4055 -0.4055 -0.4055 -0.0576 -0.0576 -0.0569 -0.0569 0.1547 0.1547 0.1558 0.1558 0.2867 0.2867 0.2868 0.2868 0.9550 0.9550 0.9574 0.9574 1.3543 1.3543 1.3558 1.3558 1.8874 1.8874 1.8926 1.8926 2.1027 2.1027 2.1071 2.1071 2.3150 2.3150 2.3155 2.3155 2.6317 2.6317 2.6327 2.6327 3.3883 3.3883 3.3883 3.3883 3.8796 3.8796 3.8798 3.8798 4.2527 4.2527 4.2604 4.2604 4.5027 4.5027 4.5030 4.5030 4.7962 4.7962 4.8011 4.8011 4.8534 4.8534 4.8555 4.8555 5.0641 5.0641 5.0765 5.0765 5.2604 5.2604 5.2609 5.2609 6.0825 6.0825 6.0853 6.0853 6.5429 6.5429 6.5433 6.5433 k = 0.5000 0.3001-0.0000 ( 5088 PWs) bands (ev): -12.8207 -12.8207 -12.8203 -12.8203 -12.8149 -12.8149 -12.8145 -12.8145 -11.6095 -11.6095 -11.6094 -11.6094 -11.6011 -11.6011 -11.6010 -11.6010 -0.4025 -0.4025 -0.4025 -0.4025 -0.0584 -0.0584 -0.0579 -0.0579 0.1481 0.1481 0.1489 0.1489 0.2859 0.2859 0.2860 0.2860 0.9568 0.9568 0.9587 0.9587 1.3506 1.3506 1.3517 1.3517 1.8909 1.8909 1.8950 1.8950 2.1002 2.1002 2.1037 2.1037 2.3107 2.3107 2.3111 2.3111 2.6376 2.6376 2.6384 2.6384 3.3890 3.3890 3.3891 3.3891 3.8931 3.8931 3.8934 3.8934 4.2561 4.2561 4.2620 4.2620 4.5000 4.5000 4.5002 4.5002 4.7971 4.7971 4.8007 4.8007 4.8540 4.8540 4.8557 4.8557 5.0663 5.0663 5.0759 5.0759 5.2526 5.2526 5.2529 5.2529 6.0823 6.0823 6.0844 6.0844 6.5432 6.5432 6.5435 6.5435 k = 0.5000 0.3095-0.0000 ( 5084 PWs) bands (ev): -12.8201 -12.8201 -12.8198 -12.8198 -12.8149 -12.8149 -12.8146 -12.8146 -11.6096 -11.6096 -11.6096 -11.6096 -11.6014 -11.6014 -11.6013 -11.6013 -0.4003 -0.4003 -0.4003 -0.4003 -0.0590 -0.0590 -0.0586 -0.0586 0.1434 0.1434 0.1439 0.1439 0.2853 0.2853 0.2854 0.2854 0.9584 0.9584 0.9596 0.9596 1.3480 1.3480 1.3487 1.3487 1.8938 1.8938 1.8966 1.8966 2.0985 2.0985 2.1009 2.1009 2.3075 2.3075 2.3078 2.3078 2.6420 2.6420 2.6425 2.6425 3.3895 3.3895 3.3896 3.3896 3.9031 3.9031 3.9032 3.9032 4.2589 4.2589 4.2629 4.2629 4.4979 4.4979 4.4980 4.4980 4.7979 4.7979 4.8003 4.8003 4.8546 4.8546 4.8558 4.8558 5.0686 5.0686 5.0751 5.0751 5.2468 5.2468 5.2469 5.2469 6.0822 6.0822 6.0837 6.0837 6.5434 6.5434 6.5436 6.5436 k = 0.5000 0.3189-0.0000 ( 5096 PWs) bands (ev): -12.8197 -12.8197 -12.8196 -12.8196 -12.8148 -12.8148 -12.8147 -12.8147 -11.6097 -11.6097 -11.6097 -11.6097 -11.6016 -11.6016 -11.6015 -11.6015 -0.3990 -0.3990 -0.3990 -0.3990 -0.0593 -0.0593 -0.0591 -0.0591 0.1405 0.1405 0.1408 0.1408 0.2850 0.2850 0.2850 0.2850 0.9594 0.9594 0.9600 0.9600 1.3465 1.3465 1.3468 1.3468 1.8958 1.8958 1.8973 1.8973 2.0977 2.0977 2.0990 2.0990 2.3056 2.3056 2.3058 2.3058 2.6446 2.6446 2.6448 2.6448 3.3898 3.3898 3.3899 3.3899 3.9091 3.9091 3.9092 3.9092 4.2610 4.2610 4.2630 4.2630 4.4965 4.4965 4.4966 4.4966 4.7986 4.7986 4.7998 4.7998 4.8550 4.8550 4.8556 4.8556 5.0707 5.0707 5.0741 5.0741 5.2431 5.2431 5.2431 5.2431 6.0823 6.0823 6.0831 6.0831 6.5435 6.5435 6.5436 6.5436 k = 0.5000 0.3282-0.0000 ( 5112 PWs) bands (ev): -12.8196 -12.8196 -12.8196 -12.8196 -12.8148 -12.8148 -12.8148 -12.8148 -11.6097 -11.6097 -11.6097 -11.6097 -11.6016 -11.6016 -11.6016 -11.6016 -0.3985 -0.3985 -0.3985 -0.3985 -0.0594 -0.0594 -0.0594 -0.0594 0.1396 0.1396 0.1396 0.1396 0.2849 0.2849 0.2849 0.2849 0.9600 0.9600 0.9600 0.9600 1.3461 1.3461 1.3461 1.3461 1.8970 1.8970 1.8970 1.8970 2.0979 2.0979 2.0979 2.0979 2.3050 2.3050 2.3050 2.3050 2.6455 2.6455 2.6455 2.6455 3.3899 3.3899 3.3899 3.3899 3.9112 3.9112 3.9112 3.9112 4.2624 4.2624 4.2624 4.2624 4.4960 4.4960 4.4960 4.4960 4.7992 4.7992 4.7992 4.7992 4.8553 4.8553 4.8553 4.8553 5.0726 5.0726 5.0726 5.0726 5.2418 5.2418 5.2418 5.2418 6.0826 6.0826 6.0826 6.0826 6.5436 6.5436 6.5436 6.5436 k = 0.5000 0.3282-0.0000 ( 5112 PWs) bands (ev): -12.8196 -12.8196 -12.8196 -12.8196 -12.8148 -12.8148 -12.8148 -12.8148 -11.6097 -11.6097 -11.6097 -11.6097 -11.6016 -11.6016 -11.6016 -11.6016 -0.3985 -0.3985 -0.3985 -0.3985 -0.0594 -0.0594 -0.0594 -0.0594 0.1396 0.1396 0.1396 0.1396 0.2849 0.2849 0.2849 0.2849 0.9600 0.9600 0.9600 0.9600 1.3461 1.3461 1.3461 1.3461 1.8970 1.8970 1.8970 1.8970 2.0979 2.0979 2.0979 2.0979 2.3050 2.3050 2.3050 2.3050 2.6455 2.6455 2.6455 2.6455 3.3899 3.3899 3.3899 3.3899 3.9112 3.9112 3.9112 3.9112 4.2624 4.2624 4.2624 4.2624 4.4960 4.4960 4.4960 4.4960 4.7992 4.7992 4.7992 4.7992 4.8553 4.8553 4.8553 4.8553 5.0726 5.0726 5.0726 5.0726 5.2418 5.2418 5.2418 5.2418 6.0826 6.0826 6.0826 6.0826 6.5436 6.5436 6.5436 6.5436 k = 0.4904 0.3282-0.0000 ( 5096 PWs) bands (ev): -12.8203 -12.8203 -12.8194 -12.8194 -12.8155 -12.8155 -12.8146 -12.8146 -11.6186 -11.6186 -11.6182 -11.6182 -11.5935 -11.5935 -11.5931 -11.5931 -0.3980 -0.3980 -0.3978 -0.3978 -0.0594 -0.0594 -0.0587 -0.0587 0.1399 0.1399 0.1400 0.1400 0.2847 0.2847 0.2851 0.2851 0.9589 0.9589 0.9593 0.9593 1.3470 1.3470 1.3478 1.3478 1.8925 1.8925 1.8957 1.8957 2.0999 2.0999 2.1030 2.1030 2.3041 2.3041 2.3046 2.3046 2.6463 2.6463 2.6470 2.6470 3.3882 3.3882 3.3893 3.3893 3.9099 3.9099 3.9113 3.9113 4.2620 4.2620 4.2629 4.2629 4.4963 4.4963 4.4980 4.4980 4.7993 4.7993 4.7997 4.7997 4.8542 4.8542 4.8572 4.8572 5.0720 5.0720 5.0746 5.0746 5.2416 5.2416 5.2420 5.2420 6.0819 6.0819 6.0826 6.0826 6.5432 6.5432 6.5438 6.5438 k = 0.4808 0.3282-0.0000 ( 5094 PWs) bands (ev): -12.8216 -12.8216 -12.8199 -12.8199 -12.8167 -12.8167 -12.8149 -12.8149 -11.6308 -11.6308 -11.6303 -11.6303 -11.5825 -11.5825 -11.5822 -11.5822 -0.3962 -0.3962 -0.3958 -0.3958 -0.0589 -0.0589 -0.0575 -0.0575 0.1409 0.1409 0.1412 0.1412 0.2846 0.2846 0.2854 0.2854 0.9563 0.9563 0.9569 0.9569 1.3505 1.3505 1.3520 1.3520 1.8832 1.8832 1.8891 1.8891 2.1085 2.1085 2.1142 2.1142 2.3017 2.3017 2.3027 2.3027 2.6492 2.6492 2.6506 2.6506 3.3841 3.3841 3.3863 3.3863 3.9073 3.9073 3.9102 3.9102 4.2618 4.2618 4.2637 4.2637 4.4985 4.4985 4.5019 4.5019 4.8000 4.8000 4.8007 4.8007 4.8536 4.8536 4.8596 4.8596 5.0727 5.0727 5.0780 5.0780 5.2412 5.2412 5.2419 5.2419 6.0803 6.0803 6.0817 6.0817 6.5426 6.5426 6.5437 6.5437 k = 0.4712 0.3282-0.0000 ( 5098 PWs) bands (ev): -12.8234 -12.8234 -12.8211 -12.8211 -12.8183 -12.8183 -12.8158 -12.8158 -11.6435 -11.6435 -11.6430 -11.6430 -11.5718 -11.5718 -11.5715 -11.5715 -0.3931 -0.3931 -0.3926 -0.3926 -0.0578 -0.0578 -0.0557 -0.0557 0.1427 0.1427 0.1431 0.1431 0.2846 0.2846 0.2858 0.2858 0.9522 0.9522 0.9532 0.9532 1.3560 1.3560 1.3582 1.3582 1.8709 1.8709 1.8789 1.8789 2.1220 2.1220 2.1297 2.1297 2.2983 2.2983 2.2997 2.2997 2.6541 2.6541 2.6562 2.6562 3.3778 3.3778 3.3809 3.3809 3.9037 3.9037 3.9081 3.9081 4.2618 4.2618 4.2649 4.2649 4.5027 4.5027 4.5075 4.5075 4.8012 4.8012 4.8022 4.8022 4.8538 4.8538 4.8625 4.8625 5.0747 5.0747 5.0825 5.0825 5.2406 5.2406 5.2417 5.2417 6.0779 6.0779 6.0801 6.0801 6.5417 6.5417 6.5434 6.5434 k = 0.4615 0.3282-0.0000 ( 5094 PWs) bands (ev): -12.8259 -12.8259 -12.8231 -12.8231 -12.8202 -12.8202 -12.8172 -12.8172 -11.6567 -11.6567 -11.6561 -11.6561 -11.5615 -11.5615 -11.5612 -11.5612 -0.3889 -0.3889 -0.3883 -0.3883 -0.0562 -0.0562 -0.0534 -0.0534 0.1453 0.1453 0.1458 0.1458 0.2846 0.2846 0.2862 0.2862 0.9471 0.9471 0.9484 0.9484 1.3630 1.3630 1.3659 1.3659 1.8577 1.8577 1.8671 1.8671 2.1385 2.1385 2.1477 2.1477 2.2944 2.2944 2.2960 2.2960 2.6609 2.6609 2.6636 2.6636 3.3692 3.3692 3.3733 3.3733 3.8990 3.8990 3.9051 3.9051 4.2619 4.2619 4.2666 4.2666 4.5085 4.5085 4.5144 4.5144 4.8030 4.8030 4.8043 4.8043 4.8546 4.8546 4.8660 4.8660 5.0781 5.0781 5.0884 5.0884 5.2399 5.2399 5.2413 5.2413 6.0748 6.0748 6.0777 6.0777 6.5406 6.5406 6.5429 6.5429 k = 0.4519 0.3282-0.0000 ( 5092 PWs) bands (ev): -12.8289 -12.8289 -12.8259 -12.8259 -12.8224 -12.8224 -12.8191 -12.8191 -11.6701 -11.6701 -11.6694 -11.6694 -11.5516 -11.5516 -11.5514 -11.5514 -0.3837 -0.3837 -0.3829 -0.3829 -0.0542 -0.0542 -0.0508 -0.0508 0.1486 0.1486 0.1492 0.1492 0.2849 0.2849 0.2868 0.2868 0.9413 0.9413 0.9430 0.9430 1.3705 1.3705 1.3741 1.3741 1.8452 1.8452 1.8556 1.8556 2.1560 2.1560 2.1664 2.1664 2.2907 2.2907 2.2924 2.2924 2.6693 2.6693 2.6726 2.6726 3.3585 3.3585 3.3635 3.3635 3.8936 3.8936 3.9013 3.9013 4.2625 4.2625 4.2688 4.2688 4.5156 4.5156 4.5223 4.5223 4.8055 4.8055 4.8069 4.8069 4.8562 4.8562 4.8699 4.8699 5.0828 5.0828 5.0953 5.0953 5.2392 5.2392 5.2408 5.2408 6.0711 6.0711 6.0746 6.0746 6.5394 6.5394 6.5423 6.5423 k = 0.4423 0.3282-0.0000 ( 5088 PWs) bands (ev): -12.8324 -12.8324 -12.8294 -12.8294 -12.8249 -12.8249 -12.8216 -12.8216 -11.6838 -11.6838 -11.6831 -11.6831 -11.5423 -11.5423 -11.5421 -11.5421 -0.3775 -0.3775 -0.3766 -0.3766 -0.0518 -0.0518 -0.0478 -0.0478 0.1527 0.1527 0.1534 0.1534 0.2853 0.2853 0.2876 0.2876 0.9354 0.9354 0.9373 0.9373 1.3777 1.3777 1.3819 1.3819 1.8347 1.8347 1.8459 1.8459 2.1726 2.1726 2.1842 2.1842 2.2885 2.2885 2.2900 2.2900 2.6790 2.6790 2.6828 2.6828 3.3459 3.3459 3.3516 3.3516 3.8877 3.8877 3.8970 3.8970 4.2634 4.2634 4.2717 4.2717 4.5236 4.5236 4.5308 4.5308 4.8085 4.8085 4.8099 4.8099 4.8584 4.8584 4.8743 4.8743 5.0887 5.0887 5.1034 5.1034 5.2383 5.2383 5.2400 5.2400 6.0668 6.0668 6.0710 6.0710 6.5382 6.5382 6.5416 6.5416 k = 0.4327 0.3282-0.0000 ( 5088 PWs) bands (ev): -12.8366 -12.8366 -12.8336 -12.8336 -12.8279 -12.8279 -12.8245 -12.8245 -11.6977 -11.6977 -11.6969 -11.6969 -11.5334 -11.5334 -11.5333 -11.5333 -0.3705 -0.3705 -0.3695 -0.3695 -0.0492 -0.0492 -0.0447 -0.0447 0.1575 0.1575 0.1583 0.1583 0.2861 0.2861 0.2888 0.2888 0.9296 0.9296 0.9319 0.9319 1.3837 1.3837 1.3884 1.3884 1.8276 1.8276 1.8392 1.8392 2.1863 2.1863 2.1988 2.1988 2.2894 2.2894 2.2908 2.2908 2.6898 2.6898 2.6940 2.6940 3.3314 3.3314 3.3378 3.3378 3.8815 3.8815 3.8925 3.8925 4.2648 4.2648 4.2751 4.2751 4.5321 4.5321 4.5396 4.5396 4.8120 4.8120 4.8134 4.8134 4.8613 4.8613 4.8790 4.8790 5.0957 5.0957 5.1124 5.1124 5.2373 5.2373 5.2391 5.2391 6.0620 6.0620 6.0668 6.0668 6.5368 6.5368 6.5409 6.5409 k = 0.4231 0.3282-0.0000 ( 5084 PWs) bands (ev): -12.8412 -12.8412 -12.8384 -12.8384 -12.8312 -12.8312 -12.8279 -12.8279 -11.7117 -11.7117 -11.7110 -11.7110 -11.5251 -11.5251 -11.5249 -11.5249 -0.3628 -0.3628 -0.3618 -0.3618 -0.0464 -0.0464 -0.0414 -0.0414 0.1628 0.1628 0.1638 0.1638 0.2875 0.2875 0.2905 0.2905 0.9243 0.9243 0.9269 0.9269 1.3877 1.3877 1.3928 1.3928 1.8245 1.8245 1.8364 1.8364 2.1951 2.1951 2.2080 2.2080 2.2953 2.2953 2.2968 2.2968 2.7014 2.7014 2.7059 2.7059 3.3152 3.3152 3.3223 3.3223 3.8753 3.8753 3.8880 3.8880 4.2668 4.2668 4.2792 4.2792 4.5406 4.5406 4.5482 4.5482 4.8161 4.8161 4.8173 4.8173 4.8650 4.8650 4.8840 4.8840 5.1037 5.1037 5.1223 5.1223 5.2363 5.2363 5.2381 5.2381 6.0568 6.0568 6.0623 6.0623 6.5355 6.5355 6.5401 6.5401 k = 0.4135 0.3282-0.0000 ( 5080 PWs) bands (ev): -12.8465 -12.8465 -12.8437 -12.8437 -12.8350 -12.8350 -12.8318 -12.8318 -11.7260 -11.7260 -11.7252 -11.7252 -11.5172 -11.5172 -11.5171 -11.5171 -0.3547 -0.3547 -0.3537 -0.3537 -0.0434 -0.0434 -0.0380 -0.0380 0.1683 0.1683 0.1693 0.1693 0.2899 0.2899 0.2932 0.2932 0.9196 0.9196 0.9226 0.9226 1.3893 1.3893 1.3947 1.3947 1.8261 1.8261 1.8380 1.8380 2.1984 2.1984 2.2111 2.2111 2.3067 2.3067 2.3088 2.3088 2.7137 2.7137 2.7185 2.7185 3.2975 3.2975 3.3051 3.3051 3.8693 3.8693 3.8835 3.8835 4.2693 4.2693 4.2837 4.2837 4.5489 4.5489 4.5565 4.5565 4.8207 4.8207 4.8217 4.8217 4.8693 4.8693 4.8894 4.8894 5.1126 5.1126 5.1329 5.1329 5.2354 5.2354 5.2369 5.2369 6.0515 6.0515 6.0576 6.0576 6.5343 6.5343 6.5394 6.5394 k = 0.4038 0.3282-0.0000 ( 5076 PWs) bands (ev): -12.8523 -12.8523 -12.8497 -12.8497 -12.8392 -12.8392 -12.8361 -12.8361 -11.7403 -11.7403 -11.7394 -11.7394 -11.5099 -11.5099 -11.5098 -11.5098 -0.3465 -0.3465 -0.3455 -0.3455 -0.0402 -0.0402 -0.0345 -0.0345 0.1735 0.1735 0.1747 0.1747 0.2936 0.2936 0.2972 0.2972 0.9159 0.9159 0.9193 0.9193 1.3883 1.3883 1.3937 1.3937 1.8325 1.8325 1.8442 1.8442 2.1973 2.1973 2.2096 2.2096 2.3226 2.3226 2.3253 2.3253 2.7263 2.7263 2.7313 2.7313 3.2784 3.2784 3.2867 3.2867 3.8637 3.8637 3.8794 3.8794 4.2723 4.2723 4.2887 4.2887 4.5567 4.5567 4.5641 4.5641 4.8258 4.8258 4.8263 4.8263 4.8742 4.8742 4.8950 4.8950 5.1220 5.1220 5.1441 5.1441 5.2347 5.2347 5.2355 5.2355 6.0462 6.0462 6.0529 6.0529 6.5333 6.5333 6.5389 6.5389 k = 0.3942 0.3282-0.0000 ( 5076 PWs) bands (ev): -12.8586 -12.8586 -12.8562 -12.8562 -12.8438 -12.8438 -12.8408 -12.8408 -11.7547 -11.7547 -11.7538 -11.7538 -11.5031 -11.5031 -11.5031 -11.5031 -0.3383 -0.3383 -0.3374 -0.3374 -0.0367 -0.0367 -0.0309 -0.0309 0.1780 0.1780 0.1792 0.1792 0.2992 0.2992 0.3030 0.3030 0.9130 0.9130 0.9169 0.9169 1.3850 1.3850 1.3903 1.3903 1.8435 1.8435 1.8546 1.8546 2.1938 2.1938 2.2057 2.2057 2.3413 2.3413 2.3445 2.3445 2.7393 2.7393 2.7444 2.7444 3.2583 3.2583 3.2670 3.2670 3.8587 3.8587 3.8757 3.8757 4.2758 4.2758 4.2940 4.2940 4.5637 4.5637 4.5708 4.5708 4.8312 4.8312 4.8313 4.8313 4.8796 4.8796 4.9007 4.9007 5.1316 5.1316 5.1556 5.1556 5.2343 5.2343 5.2343 5.2343 6.0409 6.0409 6.0482 6.0482 6.5325 6.5325 6.5387 6.5387 k = 0.3846 0.3282-0.0000 ( 5072 PWs) bands (ev): -12.8654 -12.8654 -12.8632 -12.8632 -12.8488 -12.8488 -12.8459 -12.8459 -11.7691 -11.7691 -11.7682 -11.7682 -11.4968 -11.4968 -11.4968 -11.4968 -0.3304 -0.3304 -0.3297 -0.3297 -0.0329 -0.0329 -0.0271 -0.0271 0.1812 0.1812 0.1824 0.1824 0.3073 0.3073 0.3112 0.3112 0.9111 0.9111 0.9154 0.9154 1.3798 1.3798 1.3850 1.3850 1.8584 1.8584 1.8689 1.8689 2.1892 2.1892 2.2008 2.2008 2.3615 2.3615 2.3650 2.3650 2.7523 2.7523 2.7576 2.7576 3.2372 3.2372 3.2465 3.2465 3.8544 3.8544 3.8725 3.8725 4.2797 4.2797 4.2996 4.2996 4.5697 4.5697 4.5766 4.5766 4.8365 4.8365 4.8370 4.8370 4.8855 4.8855 4.9066 4.9066 5.1412 5.1412 5.1671 5.1671 5.2332 5.2332 5.2345 5.2345 6.0360 6.0360 6.0439 6.0439 6.5322 6.5322 6.5389 6.5389 k = 0.3750 0.3282-0.0000 ( 5076 PWs) bands (ev): -12.8727 -12.8727 -12.8707 -12.8707 -12.8542 -12.8542 -12.8514 -12.8514 -11.7835 -11.7835 -11.7826 -11.7826 -11.4911 -11.4911 -11.4911 -11.4911 -0.3231 -0.3231 -0.3227 -0.3227 -0.0288 -0.0288 -0.0231 -0.0231 0.1828 0.1828 0.1839 0.1839 0.3182 0.3182 0.3220 0.3220 0.9100 0.9100 0.9148 0.9148 1.3736 1.3736 1.3785 1.3785 1.8763 1.8763 1.8860 1.8860 2.1847 2.1847 2.1959 2.1959 2.3826 2.3826 2.3861 2.3861 2.7652 2.7652 2.7706 2.7706 3.2155 3.2155 3.2252 3.2252 3.8509 3.8509 3.8699 3.8699 4.2839 4.2839 4.3054 4.3054 4.5747 4.5747 4.5813 4.5813 4.8419 4.8419 4.8430 4.8430 4.8917 4.8917 4.9125 4.9125 5.1500 5.1500 5.1781 5.1781 5.2327 5.2327 5.2357 5.2357 6.0316 6.0316 6.0399 6.0399 6.5322 6.5322 6.5395 6.5395 k = 0.3654 0.3282-0.0000 ( 5068 PWs) bands (ev): -12.8806 -12.8806 -12.8787 -12.8787 -12.8599 -12.8599 -12.8573 -12.8573 -11.7979 -11.7979 -11.7969 -11.7969 -11.4858 -11.4858 -11.4858 -11.4858 -0.3167 -0.3167 -0.3166 -0.3166 -0.0242 -0.0242 -0.0187 -0.0187 0.1828 0.1828 0.1838 0.1838 0.3318 0.3318 0.3356 0.3356 0.9096 0.9096 0.9149 0.9149 1.3672 1.3672 1.3718 1.3718 1.8964 1.8964 1.9050 1.9050 2.1810 2.1810 2.1919 2.1919 2.4043 2.4043 2.4076 2.4076 2.7780 2.7780 2.7834 2.7834 3.1934 3.1934 3.2036 3.2036 3.8481 3.8481 3.8678 3.8678 4.2884 4.2884 4.3113 4.3113 4.5785 4.5785 4.5848 4.5848 4.8474 4.8474 4.8492 4.8492 4.8981 4.8981 4.9183 4.9183 5.1576 5.1576 5.1875 5.1875 5.2338 5.2338 5.2385 5.2385 6.0278 6.0278 6.0367 6.0367 6.5329 6.5329 6.5407 6.5407 k = 0.3558 0.3282-0.0000 ( 5076 PWs) bands (ev): -12.8888 -12.8888 -12.8871 -12.8871 -12.8660 -12.8660 -12.8635 -12.8635 -11.8122 -11.8122 -11.8111 -11.8111 -11.4811 -11.4811 -11.4810 -11.4810 -0.3118 -0.3118 -0.3115 -0.3115 -0.0193 -0.0193 -0.0142 -0.0142 0.1814 0.1814 0.1823 0.1823 0.3482 0.3482 0.3519 0.3519 0.9095 0.9095 0.9153 0.9153 1.3614 1.3614 1.3657 1.3657 1.9175 1.9175 1.9249 1.9249 2.1790 2.1790 2.1894 2.1894 2.4262 2.4262 2.4292 2.4292 2.7904 2.7904 2.7958 2.7958 3.1710 3.1710 3.1817 3.1817 3.8460 3.8460 3.8663 3.8663 4.2932 4.2932 4.3172 4.3172 4.5812 4.5812 4.5872 4.5872 4.8529 4.8529 4.8553 4.8553 4.9046 4.9046 4.9241 4.9241 5.1632 5.1632 5.1940 5.1940 5.2377 5.2377 5.2432 5.2432 6.0249 6.0249 6.0343 6.0343 6.5341 6.5341 6.5425 6.5425 k = 0.3462 0.3282-0.0000 ( 5092 PWs) bands (ev): -12.8976 -12.8976 -12.8960 -12.8960 -12.8723 -12.8723 -12.8700 -12.8700 -11.8263 -11.8263 -11.8253 -11.8253 -11.4768 -11.4768 -11.4767 -11.4767 -0.3084 -0.3084 -0.3077 -0.3077 -0.0141 -0.0141 -0.0096 -0.0096 0.1791 0.1791 0.1799 0.1799 0.3668 0.3668 0.3705 0.3705 0.9095 0.9095 0.9158 0.9158 1.3569 1.3569 1.3609 1.3609 1.9385 1.9385 1.9444 1.9444 2.1793 2.1793 2.1890 2.1890 2.4485 2.4485 2.4512 2.4512 2.8023 2.8023 2.8075 2.8075 3.1488 3.1488 3.1599 3.1599 3.8445 3.8445 3.8653 3.8653 4.2980 4.2980 4.3231 4.3231 4.5826 4.5826 4.5883 4.5883 4.8584 4.8584 4.8613 4.8613 4.9110 4.9110 4.9295 4.9295 5.1666 5.1666 5.1965 5.1965 5.2451 5.2451 5.2502 5.2502 6.0230 6.0230 6.0330 6.0330 6.5360 6.5360 6.5451 6.5451 k = 0.3365 0.3282-0.0000 ( 5092 PWs) bands (ev): -12.9067 -12.9067 -12.9053 -12.9053 -12.8790 -12.8790 -12.8768 -12.8768 -11.8403 -11.8403 -11.8393 -11.8393 -11.4730 -11.4730 -11.4729 -11.4729 -0.3066 -0.3066 -0.3054 -0.3054 -0.0090 -0.0090 -0.0051 -0.0051 0.1764 0.1764 0.1772 0.1772 0.3876 0.3876 0.3911 0.3911 0.9093 0.9093 0.9161 0.9161 1.3546 1.3546 1.3582 1.3582 1.9582 1.9582 1.9624 1.9624 2.1830 2.1830 2.1916 2.1916 2.4712 2.4712 2.4734 2.4734 2.8133 2.8133 2.8185 2.8185 3.1270 3.1270 3.1387 3.1387 3.8436 3.8436 3.8646 3.8646 4.3031 4.3031 4.3290 4.3290 4.5831 4.5831 4.5884 4.5884 4.8637 4.8637 4.8672 4.8672 4.9174 4.9174 4.9347 4.9347 5.1676 5.1676 5.1958 5.1958 5.2554 5.2554 5.2593 5.2593 6.0224 6.0224 6.0329 6.0329 6.5388 6.5388 6.5485 6.5485 k = 0.3269 0.3282-0.0000 ( 5088 PWs) bands (ev): -12.9163 -12.9163 -12.9150 -12.9150 -12.8859 -12.8859 -12.8838 -12.8838 -11.8542 -11.8542 -11.8531 -11.8531 -11.4696 -11.4696 -11.4695 -11.4695 -0.3065 -0.3065 -0.3047 -0.3047 -0.0043 -0.0043 -0.0012 -0.0012 0.1740 0.1740 0.1749 0.1749 0.4099 0.4099 0.4134 0.4134 0.9086 0.9086 0.9159 0.9159 1.3548 1.3548 1.3582 1.3582 1.9757 1.9757 1.9777 1.9777 2.1907 2.1907 2.1980 2.1980 2.4944 2.4944 2.4962 2.4962 2.8233 2.8233 2.8283 2.8283 3.1061 3.1061 3.1183 3.1183 3.8431 3.8431 3.8642 3.8642 4.3082 4.3082 4.3348 4.3348 4.5824 4.5824 4.5874 4.5874 4.8686 4.8686 4.8727 4.8727 4.9235 4.9235 4.9396 4.9396 5.1668 5.1668 5.1930 5.1930 5.2675 5.2675 5.2701 5.2701 6.0233 6.0233 6.0343 6.0343 6.5424 6.5424 6.5528 6.5528 k = 0.3173 0.3282-0.0000 ( 5092 PWs) bands (ev): -12.9262 -12.9262 -12.9251 -12.9251 -12.8930 -12.8930 -12.8910 -12.8910 -11.8678 -11.8678 -11.8667 -11.8667 -11.4666 -11.4666 -11.4665 -11.4665 -0.3081 -0.3081 -0.3058 -0.3058 -0.0007 -0.0007 0.0015 0.0015 0.1728 0.1728 0.1739 0.1739 0.4337 0.4337 0.4372 0.4372 0.9071 0.9071 0.9148 0.9148 1.3581 1.3581 1.3610 1.3610 1.9897 1.9897 1.9899 1.9899 2.2030 2.2030 2.2086 2.2086 2.5183 2.5183 2.5195 2.5195 2.8317 2.8317 2.8366 2.8366 3.0864 3.0864 3.0991 3.0991 3.8429 3.8429 3.8639 3.8639 4.3134 4.3134 4.3406 4.3406 4.5807 4.5807 4.5852 4.5852 4.8732 4.8732 4.8777 4.8777 4.9294 4.9294 4.9440 4.9440 5.1644 5.1644 5.1888 5.1888 5.2805 5.2805 5.2821 5.2821 6.0257 6.0257 6.0372 6.0372 6.5469 6.5469 6.5581 6.5581 k = 0.3077 0.3282-0.0000 ( 5092 PWs) bands (ev): -12.9364 -12.9364 -12.9355 -12.9355 -12.9003 -12.9003 -12.8985 -12.8985 -11.8812 -11.8812 -11.8800 -11.8800 -11.4641 -11.4641 -11.4640 -11.4640 -0.3114 -0.3114 -0.3086 -0.3086 0.0013 0.0013 0.0025 0.0025 0.1736 0.1736 0.1749 0.1749 0.4584 0.4584 0.4620 0.4620 0.9048 0.9048 0.9128 0.9128 1.3646 1.3646 1.3671 1.3671 1.9981 1.9981 2.0005 2.0005 2.2197 2.2197 2.2238 2.2238 2.5429 2.5429 2.5437 2.5437 2.8382 2.8382 2.8430 2.8430 3.0686 3.0686 3.0818 3.0818 3.8428 3.8428 3.8636 3.8636 4.3186 4.3186 4.3463 4.3463 4.5780 4.5780 4.5821 4.5821 4.8772 4.8772 4.8821 4.8821 4.9349 4.9349 4.9480 4.9480 5.1609 5.1609 5.1835 5.1835 5.2939 5.2939 5.2949 5.2949 6.0299 6.0299 6.0419 6.0419 6.5522 6.5522 6.5643 6.5643 k = 0.2981 0.3282-0.0000 ( 5092 PWs) bands (ev): -12.9469 -12.9469 -12.9461 -12.9461 -12.9078 -12.9078 -12.9061 -12.9061 -11.8943 -11.8943 -11.8931 -11.8931 -11.4619 -11.4619 -11.4618 -11.4618 -0.3165 -0.3165 -0.3131 -0.3131 0.0010 0.0010 0.0013 0.0013 0.1770 0.1770 0.1786 0.1786 0.4839 0.4839 0.4876 0.4876 0.9015 0.9015 0.9098 0.9098 1.3742 1.3742 1.3762 1.3762 2.0034 2.0034 2.0077 2.0077 2.2405 2.2405 2.2431 2.2431 2.5684 2.5684 2.5687 2.5687 2.8423 2.8423 2.8470 2.8470 3.0533 3.0533 3.0668 3.0668 3.8425 3.8425 3.8630 3.8630 4.3239 4.3239 4.3519 4.3519 4.5744 4.5744 4.5780 4.5780 4.8805 4.8805 4.8857 4.8857 4.9399 4.9399 4.9515 4.9515 5.1564 5.1564 5.1774 5.1774 5.3075 5.3075 5.3083 5.3083 6.0358 6.0358 6.0484 6.0484 6.5585 6.5585 6.5715 6.5715 k = 0.2885 0.3282-0.0000 ( 5084 PWs) bands (ev): -12.9577 -12.9577 -12.9570 -12.9570 -12.9155 -12.9155 -12.9138 -12.9138 -11.9071 -11.9071 -11.9059 -11.9059 -11.4602 -11.4602 -11.4600 -11.4600 -0.3231 -0.3231 -0.3193 -0.3193 -0.0024 -0.0024 -0.0018 -0.0018 0.1835 0.1835 0.1853 0.1853 0.5099 0.5099 0.5136 0.5136 0.8975 0.8975 0.9059 0.9059 1.3869 1.3869 1.3883 1.3883 2.0062 2.0062 2.0122 2.0122 2.2645 2.2645 2.2660 2.2660 2.5947 2.5947 2.5948 2.5948 2.8437 2.8437 2.8481 2.8481 3.0409 3.0409 3.0548 3.0548 3.8421 3.8421 3.8620 3.8620 4.3294 4.3294 4.3576 4.3576 4.5698 4.5698 4.5730 4.5730 4.8830 4.8830 4.8884 4.8884 4.9446 4.9446 4.9544 4.9544 5.1512 5.1512 5.1707 5.1707 5.3211 5.3211 5.3219 5.3219 6.0438 6.0438 6.0569 6.0569 6.5656 6.5656 6.5796 6.5796 k = 0.2788 0.3282-0.0000 ( 5084 PWs) bands (ev): -12.9687 -12.9687 -12.9681 -12.9681 -12.9232 -12.9232 -12.9217 -12.9217 -11.9196 -11.9196 -11.9184 -11.9184 -11.4587 -11.4587 -11.4586 -11.4586 -0.3312 -0.3312 -0.3270 -0.3270 -0.0085 -0.0085 -0.0071 -0.0071 0.1931 0.1931 0.1951 0.1951 0.5361 0.5361 0.5399 0.5399 0.8927 0.8927 0.9013 0.9013 1.4021 1.4021 1.4030 1.4030 2.0074 2.0074 2.0146 2.0146 2.2908 2.2908 2.2914 2.2914 2.6216 2.6216 2.6219 2.6219 2.8420 2.8420 2.8463 2.8463 3.0319 3.0319 3.0460 3.0460 3.8413 3.8413 3.8606 3.8606 4.3351 4.3351 4.3633 4.3633 4.5643 4.5643 4.5670 4.5670 4.8846 4.8846 4.8900 4.8900 4.9487 4.9487 4.9569 4.9569 5.1454 5.1454 5.1633 5.1633 5.3347 5.3347 5.3355 5.3355 6.0537 6.0537 6.0674 6.0674 6.5734 6.5734 6.5885 6.5885 k = 0.2692 0.3282-0.0000 ( 5076 PWs) bands (ev): -12.9799 -12.9799 -12.9794 -12.9794 -12.9311 -12.9311 -12.9296 -12.9296 -11.9317 -11.9317 -11.9306 -11.9306 -11.4576 -11.4576 -11.4575 -11.4575 -0.3407 -0.3407 -0.3361 -0.3361 -0.0167 -0.0167 -0.0146 -0.0146 0.2056 0.2056 0.2078 0.2078 0.5621 0.5621 0.5661 0.5661 0.8874 0.8874 0.8962 0.8962 1.4196 1.4196 1.4200 1.4200 2.0078 2.0078 2.0158 2.0158 2.3187 2.3187 2.3188 2.3188 2.6492 2.6492 2.6497 2.6497 2.8377 2.8377 2.8417 2.8417 3.0264 3.0264 3.0406 3.0406 3.8401 3.8401 3.8585 3.8585 4.3409 4.3409 4.3690 4.3690 4.5580 4.5580 4.5602 4.5602 4.8852 4.8852 4.8904 4.8904 4.9522 4.9522 4.9588 4.9588 5.1392 5.1392 5.1554 5.1554 5.3481 5.3481 5.3491 5.3491 6.0656 6.0656 6.0801 6.0801 6.5818 6.5818 6.5979 6.5979 k = 0.2596 0.3282-0.0000 ( 5072 PWs) bands (ev): -12.9912 -12.9912 -12.9908 -12.9908 -12.9390 -12.9390 -12.9376 -12.9376 -11.9436 -11.9436 -11.9424 -11.9424 -11.4568 -11.4568 -11.4567 -11.4567 -0.3515 -0.3515 -0.3466 -0.3466 -0.0265 -0.0265 -0.0240 -0.0240 0.2206 0.2206 0.2229 0.2229 0.5877 0.5877 0.5919 0.5919 0.8820 0.8820 0.8908 0.8908 1.4386 1.4386 1.4386 1.4386 2.0080 2.0080 2.0166 2.0166 2.3473 2.3473 2.3476 2.3476 2.6772 2.6772 2.6776 2.6776 2.8315 2.8315 2.8355 2.8355 3.0241 3.0241 3.0383 3.0383 3.8383 3.8383 3.8558 3.8558 4.3470 4.3470 4.3747 4.3747 4.5507 4.5507 4.5527 4.5527 4.8847 4.8847 4.8895 4.8895 4.9552 4.9552 4.9601 4.9601 5.1326 5.1326 5.1470 5.1470 5.3613 5.3613 5.3626 5.3626 6.0796 6.0796 6.0948 6.0948 6.5905 6.5905 6.6077 6.6077 k = 0.2500 0.3282-0.0000 ( 5084 PWs) bands (ev): -13.0026 -13.0026 -13.0022 -13.0022 -12.9469 -12.9469 -12.9456 -12.9456 -11.9550 -11.9550 -11.9539 -11.9539 -11.4562 -11.4562 -11.4561 -11.4561 -0.3634 -0.3634 -0.3583 -0.3583 -0.0376 -0.0376 -0.0346 -0.0346 0.2378 0.2378 0.2401 0.2401 0.6126 0.6126 0.6170 0.6170 0.8766 0.8766 0.8855 0.8855 1.4583 1.4583 1.4588 1.4588 2.0086 2.0086 2.0175 2.0175 2.3763 2.3763 2.3767 2.3767 2.7046 2.7046 2.7046 2.7046 2.8251 2.8251 2.8295 2.8295 3.0243 3.0243 3.0385 3.0385 3.8359 3.8359 3.8524 3.8524 4.3533 4.3533 4.3804 4.3804 4.5426 4.5426 4.5443 4.5443 4.8830 4.8830 4.8872 4.8872 4.9573 4.9573 4.9606 4.9606 5.1257 5.1257 5.1383 5.1383 5.3743 5.3743 5.3758 5.3758 6.0956 6.0956 6.1116 6.1116 6.5992 6.5992 6.6174 6.6174 k = 0.2404 0.3282-0.0000 ( 5092 PWs) bands (ev): -13.0140 -13.0140 -13.0137 -13.0137 -12.9549 -12.9549 -12.9537 -12.9537 -11.9661 -11.9661 -11.9649 -11.9649 -11.4559 -11.4559 -11.4558 -11.4558 -0.3764 -0.3764 -0.3711 -0.3711 -0.0495 -0.0495 -0.0463 -0.0463 0.2568 0.2568 0.2591 0.2591 0.6365 0.6365 0.6411 0.6411 0.8714 0.8714 0.8804 0.8804 1.4785 1.4785 1.4793 1.4793 2.0102 2.0102 2.0193 2.0193 2.4048 2.4048 2.4053 2.4053 2.7284 2.7284 2.7293 2.7293 2.8215 2.8215 2.8269 2.8269 3.0265 3.0265 3.0409 3.0409 3.8329 3.8329 3.8483 3.8483 4.3598 4.3598 4.3861 4.3861 4.5337 4.5337 4.5353 4.5353 4.8801 4.8801 4.8835 4.8835 4.9587 4.9587 4.9605 4.9605 5.1187 5.1187 5.1292 5.1292 5.3869 5.3869 5.3887 5.3887 6.1136 6.1136 6.1304 6.1304 6.6077 6.6077 6.6267 6.6267 k = 0.2308 0.3282-0.0000 ( 5080 PWs) bands (ev): -13.0254 -13.0254 -13.0252 -13.0252 -12.9628 -12.9628 -12.9616 -12.9616 -11.9768 -11.9768 -11.9756 -11.9756 -11.4559 -11.4559 -11.4558 -11.4558 -0.3903 -0.3903 -0.3848 -0.3848 -0.0620 -0.0620 -0.0585 -0.0585 0.2774 0.2774 0.2796 0.2796 0.6593 0.6593 0.6641 0.6641 0.8667 0.8667 0.8757 0.8757 1.4985 1.4985 1.4996 1.4996 2.0135 2.0135 2.0225 2.0225 2.4322 2.4322 2.4325 2.4325 2.7451 2.7451 2.7469 2.7469 2.8262 2.8262 2.8329 2.8329 3.0302 3.0302 3.0450 3.0450 3.8293 3.8293 3.8436 3.8436 4.3667 4.3667 4.3918 4.3918 4.5241 4.5241 4.5259 4.5259 4.8760 4.8760 4.8784 4.8784 4.9591 4.9591 4.9595 4.9595 5.1115 5.1115 5.1200 5.1200 5.3992 5.3992 5.4012 5.4012 6.1335 6.1335 6.1512 6.1512 6.6157 6.6157 6.6351 6.6351 k = 0.2212 0.3282-0.0000 ( 5072 PWs) bands (ev): -13.0368 -13.0368 -13.0367 -13.0367 -12.9706 -12.9706 -12.9696 -12.9696 -11.9871 -11.9871 -11.9860 -11.9860 -11.4560 -11.4560 -11.4559 -11.4559 -0.4050 -0.4050 -0.3994 -0.3994 -0.0748 -0.0748 -0.0712 -0.0712 0.2993 0.2993 0.3015 0.3015 0.6808 0.6808 0.6857 0.6857 0.8627 0.8627 0.8717 0.8717 1.5178 1.5178 1.5190 1.5190 2.0188 2.0188 2.0277 2.0277 2.4574 2.4574 2.4574 2.4574 2.7523 2.7523 2.7539 2.7539 2.8436 2.8436 2.8507 2.8507 3.0354 3.0354 3.0506 3.0506 3.8253 3.8253 3.8382 3.8382 4.3738 4.3738 4.3973 4.3973 4.5137 4.5137 4.5160 4.5160 4.8707 4.8707 4.8719 4.8719 4.9576 4.9576 4.9584 4.9584 5.1044 5.1044 5.1107 5.1107 5.4111 5.4111 5.4134 5.4134 6.1551 6.1551 6.1737 6.1737 6.6228 6.6228 6.6424 6.6424 k = 0.2115 0.3282-0.0000 ( 5060 PWs) bands (ev): -13.0481 -13.0481 -13.0480 -13.0480 -12.9784 -12.9784 -12.9774 -12.9774 -11.9969 -11.9969 -11.9958 -11.9958 -11.4564 -11.4564 -11.4562 -11.4562 -0.4202 -0.4202 -0.4146 -0.4146 -0.0877 -0.0877 -0.0840 -0.0840 0.3224 0.3224 0.3245 0.3245 0.7006 0.7006 0.7057 0.7057 0.8594 0.8594 0.8685 0.8685 1.5355 1.5355 1.5368 1.5368 2.0269 2.0269 2.0354 2.0354 2.4786 2.4786 2.4791 2.4791 2.7535 2.7535 2.7543 2.7543 2.8705 2.8705 2.8777 2.8777 3.0420 3.0420 3.0577 3.0577 3.8208 3.8208 3.8324 3.8324 4.3812 4.3812 4.4024 4.4024 4.5027 4.5027 4.5060 4.5060 4.8641 4.8641 4.8642 4.8642 4.9547 4.9547 4.9567 4.9567 5.0972 5.0972 5.1014 5.1014 5.4227 5.4227 5.4251 5.4251 6.1784 6.1784 6.1979 6.1979 6.6291 6.6291 6.6484 6.6484 k = 0.2019 0.3282-0.0000 ( 5054 PWs) bands (ev): -13.0593 -13.0593 -13.0592 -13.0592 -12.9860 -12.9860 -12.9851 -12.9851 -12.0064 -12.0064 -12.0053 -12.0053 -11.4568 -11.4568 -11.4567 -11.4567 -0.4359 -0.4359 -0.4304 -0.4304 -0.1006 -0.1006 -0.0968 -0.0968 0.3464 0.3464 0.3484 0.3484 0.7188 0.7188 0.7240 0.7240 0.8570 0.8570 0.8661 0.8661 1.5512 1.5512 1.5523 1.5523 2.0379 2.0379 2.0460 2.0460 2.4952 2.4952 2.4961 2.4961 2.7533 2.7533 2.7536 2.7536 2.9023 2.9023 2.9096 2.9096 3.0503 3.0503 3.0668 3.0668 3.8161 3.8161 3.8262 3.8262 4.3885 4.3885 4.4067 4.4067 4.4911 4.4911 4.4962 4.4962 4.8552 4.8552 4.8563 4.8563 4.9507 4.9507 4.9536 4.9536 5.0899 5.0899 5.0922 5.0922 5.4338 5.4338 5.4363 5.4363 6.2029 6.2029 6.2235 6.2235 6.6344 6.6344 6.6533 6.6533 k = 0.1923 0.3282-0.0000 ( 5062 PWs) bands (ev): -13.0703 -13.0703 -13.0703 -13.0703 -12.9935 -12.9935 -12.9927 -12.9927 -12.0154 -12.0154 -12.0144 -12.0144 -11.4575 -11.4575 -11.4574 -11.4574 -0.4520 -0.4520 -0.4465 -0.4465 -0.1134 -0.1134 -0.1096 -0.1096 0.3712 0.3712 0.3731 0.3731 0.7353 0.7353 0.7404 0.7404 0.8557 0.8557 0.8645 0.8645 1.5642 1.5642 1.5652 1.5652 2.0523 2.0523 2.0598 2.0598 2.5063 2.5063 2.5078 2.5078 2.7536 2.7536 2.7547 2.7547 2.9364 2.9364 2.9442 2.9442 3.0610 3.0610 3.0782 3.0782 3.8110 3.8110 3.8197 3.8197 4.3958 4.3958 4.4098 4.4098 4.4792 4.4792 4.4870 4.4870 4.8451 4.8451 4.8473 4.8473 4.9455 4.9455 4.9490 4.9490 5.0827 5.0827 5.0831 5.0831 5.4444 5.4444 5.4470 5.4470 6.2283 6.2283 6.2501 6.2501 6.6390 6.6390 6.6575 6.6575 k = 0.1827 0.3282-0.0000 ( 5054 PWs) bands (ev): -13.0811 -13.0811 -13.0810 -13.0810 -13.0008 -13.0008 -13.0001 -13.0001 -12.0241 -12.0241 -12.0230 -12.0230 -11.4582 -11.4582 -11.4581 -11.4581 -0.4682 -0.4682 -0.4629 -0.4629 -0.1259 -0.1259 -0.1222 -0.1222 0.3967 0.3967 0.3986 0.3986 0.7500 0.7500 0.7550 0.7550 0.8553 0.8553 0.8639 0.8639 1.5744 1.5744 1.5751 1.5751 2.0700 2.0700 2.0770 2.0770 2.5121 2.5121 2.5141 2.5141 2.7555 2.7555 2.7573 2.7573 2.9715 2.9715 2.9800 2.9800 3.0749 3.0749 3.0931 3.0931 3.8059 3.8059 3.8131 3.8131 4.4027 4.4027 4.4109 4.4109 4.4674 4.4674 4.4792 4.4792 4.8340 4.8340 4.8372 4.8372 4.9392 4.9392 4.9431 4.9431 5.0743 5.0743 5.0754 5.0754 5.4546 5.4546 5.4572 5.4572 6.2545 6.2545 6.2773 6.2773 6.6433 6.6433 6.6614 6.6614 k = 0.1731 0.3282-0.0000 ( 5056 PWs) bands (ev): -13.0916 -13.0916 -13.0915 -13.0915 -13.0080 -13.0080 -13.0072 -13.0072 -12.0322 -12.0322 -12.0313 -12.0313 -11.4591 -11.4591 -11.4590 -11.4590 -0.4845 -0.4845 -0.4793 -0.4793 -0.1382 -0.1382 -0.1345 -0.1345 0.4228 0.4228 0.4246 0.4246 0.7631 0.7631 0.7678 0.7678 0.8558 0.8558 0.8640 0.8640 1.5815 1.5815 1.5818 1.5818 2.0908 2.0908 2.0972 2.0972 2.5134 2.5134 2.5156 2.5156 2.7584 2.7584 2.7605 2.7605 3.0061 3.0061 3.0152 3.0152 3.0938 3.0938 3.1126 3.1126 3.8006 3.8006 3.8063 3.8063 4.4085 4.4085 4.4093 4.4093 4.4561 4.4561 4.4735 4.4735 4.8220 4.8220 4.8260 4.8260 4.9318 4.9318 4.9357 4.9357 5.0658 5.0658 5.0681 5.0681 5.4643 5.4643 5.4669 5.4669 6.2810 6.2810 6.3049 6.3049 6.6477 6.6477 6.6654 6.6654 k = 0.1635 0.3282-0.0000 ( 5052 PWs) bands (ev): -13.1018 -13.1018 -13.1017 -13.1017 -13.0149 -13.0149 -13.0142 -13.0142 -12.0400 -12.0400 -12.0390 -12.0390 -11.4600 -11.4600 -11.4599 -11.4599 -0.5007 -0.5007 -0.4956 -0.4956 -0.1501 -0.1501 -0.1465 -0.1465 0.4494 0.4494 0.4511 0.4511 0.7748 0.7748 0.7790 0.7790 0.8572 0.8572 0.8648 0.8648 1.5856 1.5856 1.5857 1.5857 2.1141 2.1141 2.1199 2.1199 2.5116 2.5116 2.5137 2.5137 2.7611 2.7611 2.7630 2.7630 3.0386 3.0386 3.0474 3.0474 3.1201 3.1201 3.1382 3.1382 3.7953 3.7953 3.7995 3.7995 4.4046 4.4046 4.4114 4.4114 4.4474 4.4474 4.4702 4.4702 4.8093 4.8093 4.8138 4.8138 4.9234 4.9234 4.9269 4.9269 5.0575 5.0575 5.0606 5.0606 5.4735 5.4735 5.4760 5.4760 6.3073 6.3073 6.3322 6.3322 6.6526 6.6526 6.6701 6.6701 k = 0.1538 0.3282-0.0000 ( 5066 PWs) bands (ev): -13.1116 -13.1116 -13.1115 -13.1115 -13.0215 -13.0215 -13.0209 -13.0209 -12.0473 -12.0473 -12.0464 -12.0464 -11.4610 -11.4610 -11.4609 -11.4609 -0.5166 -0.5166 -0.5118 -0.5118 -0.1616 -0.1616 -0.1582 -0.1582 0.4762 0.4762 0.4779 0.4779 0.7851 0.7851 0.7887 0.7887 0.8592 0.8592 0.8661 0.8661 1.5866 1.5866 1.5870 1.5870 2.1391 2.1391 2.1443 2.1443 2.5082 2.5082 2.5101 2.5101 2.7625 2.7625 2.7640 2.7640 3.0678 3.0678 3.0747 3.0747 3.1550 3.1550 3.1710 3.1710 3.7900 3.7900 3.7927 3.7927 4.3972 4.3972 4.4087 4.4087 4.4438 4.4438 4.4690 4.4690 4.7960 4.7960 4.8007 4.8007 4.9140 4.9140 4.9168 4.9168 5.0494 5.0494 5.0529 5.0529 5.4822 5.4822 5.4846 5.4846 6.3328 6.3328 6.3586 6.3586 6.6586 6.6586 6.6759 6.6759 k = 0.1442 0.3282-0.0000 ( 5066 PWs) bands (ev): -13.1211 -13.1211 -13.1210 -13.1210 -13.0279 -13.0279 -13.0274 -13.0274 -12.0541 -12.0541 -12.0533 -12.0533 -11.4620 -11.4620 -11.4619 -11.4619 -0.5322 -0.5322 -0.5276 -0.5276 -0.1726 -0.1726 -0.1694 -0.1694 0.5032 0.5032 0.5048 0.5048 0.7944 0.7944 0.7973 0.7973 0.8617 0.8617 0.8677 0.8677 1.5852 1.5852 1.5859 1.5859 2.1646 2.1646 2.1695 2.1695 2.5048 2.5048 2.5063 2.5063 2.7619 2.7619 2.7629 2.7629 3.0936 3.0936 3.0982 3.0982 3.1972 3.1972 3.2104 3.2104 3.7846 3.7846 3.7859 3.7859 4.3881 4.3881 4.4002 4.4002 4.4456 4.4456 4.4690 4.4690 4.7821 4.7821 4.7868 4.7868 4.9040 4.9040 4.9057 4.9057 5.0416 5.0416 5.0451 5.0451 5.4904 5.4904 5.4927 5.4927 6.3571 6.3571 6.3833 6.3833 6.6665 6.6665 6.6834 6.6834 k = 0.1346 0.3282-0.0000 ( 5066 PWs) bands (ev): -13.1301 -13.1301 -13.1300 -13.1300 -13.0340 -13.0340 -13.0335 -13.0335 -12.0606 -12.0606 -12.0597 -12.0597 -11.4630 -11.4630 -11.4629 -11.4629 -0.5473 -0.5473 -0.5429 -0.5429 -0.1832 -0.1832 -0.1801 -0.1801 0.5303 0.5303 0.5317 0.5317 0.8029 0.8029 0.8050 0.8050 0.8643 0.8643 0.8694 0.8694 1.5817 1.5817 1.5827 1.5827 2.1892 2.1892 2.1938 2.1938 2.5030 2.5030 2.5039 2.5039 2.7592 2.7592 2.7595 2.7595 3.1167 3.1167 3.1194 3.1194 3.2441 3.2441 3.2550 3.2550 3.7792 3.7792 3.7793 3.7793 4.3781 4.3781 4.3891 4.3891 4.4496 4.4496 4.4691 4.4691 4.7679 4.7679 4.7723 4.7723 4.8936 4.8936 4.8938 4.8938 5.0338 5.0338 5.0370 5.0370 5.4981 5.4981 5.5003 5.5003 6.3796 6.3796 6.4059 6.4059 6.6767 6.6767 6.6930 6.6930 k = 0.1250 0.3282-0.0000 ( 5062 PWs) bands (ev): -13.1387 -13.1387 -13.1386 -13.1386 -13.0398 -13.0398 -13.0393 -13.0393 -12.0665 -12.0665 -12.0658 -12.0658 -11.4640 -11.4640 -11.4640 -11.4640 -0.5618 -0.5618 -0.5577 -0.5577 -0.1932 -0.1932 -0.1903 -0.1903 0.5572 0.5572 0.5585 0.5585 0.8107 0.8107 0.8120 0.8120 0.8668 0.8668 0.8711 0.8711 1.5765 1.5765 1.5777 1.5777 2.2116 2.2116 2.2160 2.2160 2.5043 2.5043 2.5045 2.5045 2.7542 2.7542 2.7546 2.7546 3.1380 3.1380 3.1393 3.1393 3.2938 3.2938 3.3029 3.3029 3.7724 3.7724 3.7738 3.7738 4.3678 4.3678 4.3773 4.3773 4.4539 4.4539 4.4688 4.4688 4.7533 4.7533 4.7571 4.7571 4.8814 4.8814 4.8829 4.8829 5.0260 5.0260 5.0287 5.0287 5.5053 5.5053 5.5073 5.5073 6.3997 6.3997 6.4256 6.4256 6.6897 6.6897 6.7050 6.7050 k = 0.1154 0.3282-0.0000 ( 5062 PWs) bands (ev): -13.1468 -13.1468 -13.1466 -13.1466 -13.0452 -13.0452 -13.0448 -13.0448 -12.0721 -12.0721 -12.0713 -12.0713 -11.4651 -11.4651 -11.4650 -11.4650 -0.5756 -0.5756 -0.5718 -0.5718 -0.2026 -0.2026 -0.1999 -0.1999 0.5837 0.5837 0.5849 0.5849 0.8182 0.8182 0.8187 0.8187 0.8691 0.8691 0.8725 0.8725 1.5700 1.5700 1.5714 1.5714 2.2301 2.2301 2.2344 2.2344 2.5093 2.5093 2.5098 2.5098 2.7472 2.7472 2.7483 2.7483 3.1577 3.1577 3.1582 3.1582 3.3451 3.3451 3.3530 3.3530 3.7656 3.7656 3.7683 3.7683 4.3578 4.3578 4.3655 4.3655 4.4575 4.4575 4.4674 4.4674 4.7386 4.7386 4.7416 4.7416 4.8689 4.8689 4.8725 4.8725 5.0182 5.0182 5.0201 5.0201 5.5119 5.5119 5.5138 5.5138 6.4172 6.4172 6.4420 6.4420 6.7059 6.7059 6.7197 6.7197 k = 0.1058 0.3282-0.0000 ( 5062 PWs) bands (ev): -13.1543 -13.1543 -13.1542 -13.1542 -13.0503 -13.0503 -13.0499 -13.0499 -12.0771 -12.0771 -12.0765 -12.0765 -11.4661 -11.4661 -11.4660 -11.4660 -0.5886 -0.5886 -0.5851 -0.5851 -0.2115 -0.2115 -0.2090 -0.2090 0.6096 0.6096 0.6107 0.6107 0.8249 0.8249 0.8253 0.8253 0.8711 0.8711 0.8736 0.8736 1.5625 1.5625 1.5639 1.5639 2.2438 2.2438 2.2479 2.2479 2.5192 2.5192 2.5205 2.5205 2.7389 2.7389 2.7407 2.7407 3.1759 3.1759 3.1760 3.1760 3.3971 3.3971 3.4041 3.4041 3.7588 3.7588 3.7627 3.7627 4.3483 4.3483 4.3543 4.3543 4.4598 4.4598 4.4647 4.4647 4.7237 4.7237 4.7258 4.7258 4.8567 4.8567 4.8625 4.8625 5.0103 5.0103 5.0113 5.0113 5.5181 5.5181 5.5198 5.5198 6.4319 6.4319 6.4550 6.4550 6.7252 6.7252 6.7369 6.7369 k = 0.0962 0.3282-0.0000 ( 5070 PWs) bands (ev): -13.1613 -13.1613 -13.1612 -13.1612 -13.0550 -13.0550 -13.0546 -13.0546 -12.0818 -12.0818 -12.0812 -12.0812 -11.4670 -11.4670 -11.4670 -11.4670 -0.6007 -0.6007 -0.5975 -0.5975 -0.2197 -0.2197 -0.2174 -0.2174 0.6349 0.6349 0.6358 0.6358 0.8308 0.8308 0.8320 0.8320 0.8728 0.8728 0.8744 0.8744 1.5542 1.5542 1.5557 1.5557 2.2523 2.2523 2.2563 2.2563 2.5341 2.5341 2.5362 2.5362 2.7300 2.7300 2.7325 2.7325 3.1924 3.1924 3.1929 3.1929 3.4490 3.4490 3.4555 3.4555 3.7521 3.7521 3.7571 3.7571 4.3397 4.3397 4.3439 4.3439 4.4602 4.4602 4.4603 4.4603 4.7087 4.7087 4.7099 4.7099 4.8452 4.8452 4.8534 4.8534 5.0023 5.0023 5.0024 5.0024 5.5237 5.5237 5.5252 5.5252 6.4438 6.4438 6.4649 6.4649 6.7471 6.7471 6.7565 6.7565 k = 0.0865 0.3282-0.0000 ( 5078 PWs) bands (ev): -13.1677 -13.1677 -13.1676 -13.1676 -13.0593 -13.0593 -13.0589 -13.0589 -12.0860 -12.0860 -12.0854 -12.0854 -11.4679 -11.4679 -11.4679 -11.4679 -0.6119 -0.6119 -0.6090 -0.6090 -0.2272 -0.2272 -0.2251 -0.2251 0.6591 0.6591 0.6598 0.6598 0.8363 0.8363 0.8382 0.8382 0.8743 0.8743 0.8750 0.8750 1.5455 1.5455 1.5470 1.5470 2.2563 2.2563 2.2600 2.2600 2.5532 2.5532 2.5559 2.5559 2.7208 2.7208 2.7240 2.7240 3.2074 3.2074 3.2082 3.2082 3.4999 3.4999 3.5062 3.5062 3.7454 3.7454 3.7515 3.7515 4.3322 4.3322 4.3345 4.3345 4.4537 4.4537 4.4586 4.4586 4.6939 4.6939 4.6942 4.6942 4.8350 4.8350 4.8454 4.8454 4.9932 4.9932 4.9945 4.9945 5.5288 5.5288 5.5302 5.5302 6.4533 6.4533 6.4721 6.4721 6.7711 6.7711 6.7781 6.7781 k = 0.0769 0.3282-0.0000 ( 5080 PWs) bands (ev): -13.1735 -13.1735 -13.1734 -13.1734 -13.0631 -13.0631 -13.0629 -13.0629 -12.0897 -12.0897 -12.0892 -12.0892 -11.4688 -11.4688 -11.4687 -11.4687 -0.6221 -0.6221 -0.6195 -0.6195 -0.2340 -0.2340 -0.2322 -0.2322 0.6820 0.6820 0.6826 0.6826 0.8412 0.8412 0.8438 0.8438 0.8756 0.8756 0.8758 0.8758 1.5367 1.5367 1.5382 1.5382 2.2568 2.2568 2.2601 2.2601 2.5746 2.5746 2.5781 2.5781 2.7120 2.7120 2.7160 2.7160 3.2209 3.2209 3.2218 3.2218 3.5491 3.5491 3.5555 3.5555 3.7391 3.7391 3.7463 3.7463 4.3260 4.3260 4.3263 4.3263 4.4452 4.4452 4.4543 4.4543 4.6791 4.6791 4.6795 4.6795 4.8263 4.8263 4.8387 4.8387 4.9842 4.9842 4.9865 4.9865 5.5334 5.5334 5.5346 5.5346 6.4607 6.4607 6.4771 6.4771 6.7967 6.7967 6.8012 6.8012 k = 0.0673 0.3282-0.0000 ( 5080 PWs) bands (ev): -13.1787 -13.1787 -13.1786 -13.1786 -13.0666 -13.0666 -13.0664 -13.0664 -12.0930 -12.0930 -12.0926 -12.0926 -11.4695 -11.4695 -11.4695 -11.4695 -0.6312 -0.6312 -0.6289 -0.6289 -0.2401 -0.2401 -0.2385 -0.2385 0.7036 0.7036 0.7039 0.7039 0.8450 0.8450 0.8482 0.8482 0.8767 0.8767 0.8775 0.8775 1.5280 1.5280 1.5294 1.5294 2.2549 2.2549 2.2578 2.2578 2.5965 2.5965 2.6008 2.6008 2.7041 2.7041 2.7090 2.7090 3.2328 3.2328 3.2337 3.2337 3.5952 3.5952 3.6023 3.6023 3.7335 3.7335 3.7421 3.7421 4.3196 4.3196 4.3213 4.3213 4.4346 4.4346 4.4472 4.4472 4.6650 4.6650 4.6658 4.6658 4.8195 4.8195 4.8334 4.8334 4.9754 4.9754 4.9787 4.9787 5.5374 5.5374 5.5385 5.5385 6.4663 6.4663 6.4804 6.4804 6.8231 6.8231 6.8252 6.8252 k = 0.0577 0.3282-0.0000 ( 5076 PWs) bands (ev): -13.1832 -13.1832 -13.1831 -13.1831 -13.0696 -13.0696 -13.0694 -13.0694 -12.0959 -12.0959 -12.0955 -12.0955 -11.4702 -11.4702 -11.4702 -11.4702 -0.6391 -0.6391 -0.6371 -0.6371 -0.2454 -0.2454 -0.2440 -0.2440 0.7233 0.7233 0.7235 0.7235 0.8474 0.8474 0.8510 0.8510 0.8785 0.8785 0.8798 0.8798 1.5197 1.5197 1.5210 1.5210 2.2517 2.2517 2.2541 2.2541 2.6168 2.6168 2.6221 2.6221 2.6981 2.6981 2.7040 2.7040 3.2429 3.2429 3.2438 3.2438 3.6363 3.6363 3.6447 3.6447 3.7298 3.7298 3.7402 3.7402 4.3145 4.3145 4.3181 4.3181 4.4221 4.4221 4.4373 4.4373 4.6521 4.6521 4.6530 4.6530 4.8147 4.8147 4.8293 4.8293 4.9671 4.9671 4.9711 4.9711 5.5409 5.5409 5.5418 5.5418 6.4706 6.4706 6.4824 6.4824 6.8497 6.8497 6.8498 6.8498 k = 0.0481 0.3282-0.0000 ( 5068 PWs) bands (ev): -13.1870 -13.1870 -13.1870 -13.1870 -13.0722 -13.0722 -13.0720 -13.0720 -12.0983 -12.0983 -12.0980 -12.0980 -11.4708 -11.4708 -11.4708 -11.4708 -0.6459 -0.6459 -0.6442 -0.6442 -0.2499 -0.2499 -0.2487 -0.2487 0.7412 0.7412 0.7412 0.7412 0.8483 0.8483 0.8517 0.8517 0.8814 0.8814 0.8827 0.8827 1.5120 1.5120 1.5132 1.5132 2.2479 2.2479 2.2499 2.2499 2.6331 2.6331 2.6393 2.6393 2.6956 2.6956 2.7024 2.7024 3.2514 3.2514 3.2522 3.2522 3.6684 3.6684 3.6784 3.6784 3.7317 3.7317 3.7438 3.7438 4.3110 4.3110 4.3166 4.3166 4.4081 4.4081 4.4249 4.4249 4.6409 4.6409 4.6417 4.6417 4.8118 4.8118 4.8263 4.8263 4.9594 4.9594 4.9639 4.9639 5.5439 5.5439 5.5447 5.5447 6.4739 6.4739 6.4836 6.4836 6.8742 6.8742 6.8764 6.8764 k = 0.0385 0.3282-0.0000 ( 5068 PWs) bands (ev): -13.1902 -13.1902 -13.1901 -13.1901 -13.0743 -13.0743 -13.0742 -13.0742 -12.1003 -12.1003 -12.1000 -12.1000 -11.4713 -11.4713 -11.4713 -11.4713 -0.6514 -0.6514 -0.6501 -0.6501 -0.2536 -0.2536 -0.2527 -0.2527 0.7566 0.7566 0.7568 0.7568 0.8478 0.8478 0.8507 0.8507 0.8849 0.8849 0.8859 0.8859 1.5053 1.5053 1.5063 1.5063 2.2442 2.2442 2.2458 2.2458 2.6435 2.6435 2.6494 2.6494 2.6988 2.6988 2.7052 2.7052 3.2581 3.2581 3.2588 3.2588 3.6865 3.6865 3.6944 3.6944 3.7470 3.7470 3.7570 3.7570 4.3095 4.3095 4.3168 4.3168 4.3933 4.3933 4.4106 4.4106 4.6314 4.6314 4.6320 4.6320 4.8106 4.8106 4.8240 4.8240 4.9528 4.9528 4.9573 4.9573 5.5464 5.5464 5.5470 5.5470 6.4765 6.4765 6.4840 6.4840 6.8983 6.8983 6.9025 6.9025 k = 0.0288 0.3282-0.0000 ( 5072 PWs) bands (ev): -13.1927 -13.1927 -13.1926 -13.1926 -13.0760 -13.0760 -13.0759 -13.0759 -12.1018 -12.1018 -12.1016 -12.1016 -11.4717 -11.4717 -11.4717 -11.4717 -0.6558 -0.6558 -0.6548 -0.6548 -0.2565 -0.2565 -0.2558 -0.2558 0.7696 0.7696 0.7699 0.7699 0.8462 0.8462 0.8486 0.8486 0.8883 0.8883 0.8891 0.8891 1.4998 1.4998 1.5006 1.5006 2.2409 2.2409 2.2421 2.2421 2.6482 2.6482 2.6525 2.6525 2.7068 2.7068 2.7115 2.7115 3.2632 3.2632 3.2638 3.2638 3.6927 3.6927 3.6969 3.6969 3.7708 3.7708 3.7768 3.7768 4.3099 4.3099 4.3186 4.3186 4.3786 4.3786 4.3954 4.3954 4.6240 4.6240 4.6243 4.6243 4.8109 4.8109 4.8222 4.8222 4.9474 4.9474 4.9515 4.9515 5.5483 5.5483 5.5488 5.5488 6.4784 6.4784 6.4840 6.4840 6.9217 6.9217 6.9276 6.9276 k = 0.0192 0.3282-0.0000 ( 5072 PWs) bands (ev): -13.1944 -13.1944 -13.1944 -13.1944 -13.0771 -13.0771 -13.0771 -13.0771 -12.1029 -12.1029 -12.1028 -12.1028 -11.4719 -11.4719 -11.4719 -11.4719 -0.6588 -0.6588 -0.6582 -0.6582 -0.2585 -0.2585 -0.2581 -0.2581 0.7797 0.7797 0.7800 0.7800 0.8442 0.8442 0.8459 0.8459 0.8912 0.8912 0.8917 0.8917 1.4958 1.4958 1.4963 1.4963 2.2384 2.2384 2.2392 2.2392 2.6496 2.6496 2.6522 2.6522 2.7155 2.7155 2.7184 2.7184 3.2668 3.2668 3.2672 3.2672 3.6938 3.6938 3.6959 3.6959 3.7918 3.7918 3.7952 3.7952 4.3124 4.3124 4.3215 4.3215 4.3657 4.3657 4.3805 4.3805 4.6185 4.6185 4.6187 4.6187 4.8122 4.8122 4.8204 4.8204 4.9437 4.9437 4.9467 4.9467 5.5497 5.5497 5.5500 5.5500 6.4800 6.4800 6.4837 6.4837 6.9439 6.9439 6.9511 6.9511 k = 0.0096 0.3282-0.0000 ( 5074 PWs) bands (ev): -13.1955 -13.1955 -13.1955 -13.1955 -13.0778 -13.0778 -13.0778 -13.0778 -12.1035 -12.1035 -12.1035 -12.1035 -11.4721 -11.4721 -11.4721 -11.4721 -0.6606 -0.6606 -0.6603 -0.6603 -0.2597 -0.2597 -0.2595 -0.2595 0.7864 0.7864 0.7866 0.7866 0.8426 0.8426 0.8435 0.8435 0.8932 0.8932 0.8934 0.8934 1.4933 1.4933 1.4936 1.4936 2.2370 2.2370 2.2374 2.2374 2.6500 2.6500 2.6512 2.6512 2.7218 2.7218 2.7232 2.7232 3.2690 3.2690 3.2692 3.2692 3.6938 3.6938 3.6946 3.6946 3.8058 3.8058 3.8073 3.8073 4.3168 4.3168 4.3236 4.3236 4.3577 4.3577 4.3675 4.3675 4.6152 4.6152 4.6153 4.6153 4.8141 4.8141 4.8184 4.8184 4.9417 4.9417 4.9433 4.9433 5.5506 5.5506 5.5508 5.5508 6.4812 6.4812 6.4830 6.4830 6.9641 6.9641 6.9713 6.9713 k = 0.0000 0.3282-0.0000 ( 5078 PWs) bands (ev): -13.1959 -13.1959 -13.1959 -13.1959 -13.0781 -13.0781 -13.0781 -13.0781 -12.1037 -12.1037 -12.1037 -12.1037 -11.4722 -11.4722 -11.4722 -11.4722 -0.6611 -0.6611 -0.6611 -0.6611 -0.2600 -0.2600 -0.2600 -0.2600 0.7889 0.7889 0.7889 0.7889 0.8423 0.8423 0.8423 0.8423 0.8939 0.8939 0.8939 0.8939 1.4925 1.4925 1.4925 1.4925 2.2366 2.2366 2.2366 2.2366 2.6503 2.6503 2.6503 2.6503 2.7245 2.7245 2.7245 2.7245 3.2698 3.2698 3.2698 3.2698 3.6939 3.6939 3.6939 3.6939 3.8111 3.8111 3.8111 3.8111 4.3216 4.3216 4.3216 4.3216 4.3586 4.3586 4.3586 4.3586 4.6141 4.6141 4.6141 4.6141 4.8163 4.8163 4.8163 4.8163 4.9416 4.9416 4.9416 4.9416 5.5509 5.5509 5.5509 5.5509 6.4822 6.4822 6.4822 6.4822 6.9778 6.9778 6.9778 6.9778 k = 0.0000 0.3282-0.0000 ( 5078 PWs) bands (ev): -13.1959 -13.1959 -13.1959 -13.1959 -13.0781 -13.0781 -13.0781 -13.0781 -12.1037 -12.1037 -12.1037 -12.1037 -11.4722 -11.4722 -11.4722 -11.4722 -0.6611 -0.6611 -0.6611 -0.6611 -0.2600 -0.2600 -0.2600 -0.2600 0.7889 0.7889 0.7889 0.7889 0.8423 0.8423 0.8423 0.8423 0.8939 0.8939 0.8939 0.8939 1.4925 1.4925 1.4925 1.4925 2.2366 2.2366 2.2366 2.2366 2.6503 2.6503 2.6503 2.6503 2.7245 2.7245 2.7245 2.7245 3.2698 3.2698 3.2698 3.2698 3.6939 3.6939 3.6939 3.6939 3.8111 3.8111 3.8111 3.8111 4.3216 4.3216 4.3216 4.3216 4.3586 4.3586 4.3586 4.3586 4.6141 4.6141 4.6141 4.6141 4.8163 4.8163 4.8163 4.8163 4.9416 4.9416 4.9416 4.9416 5.5509 5.5509 5.5509 5.5509 6.4822 6.4822 6.4822 6.4822 6.9778 6.9778 6.9778 6.9778 k = 0.0000 0.3189-0.0000 ( 5079 PWs) bands (ev): -13.2157 -13.2157 -13.1761 -13.1761 -13.0928 -13.0928 -13.0634 -13.0634 -12.1116 -12.1116 -12.0958 -12.0958 -11.4737 -11.4737 -11.4701 -11.4701 -0.6785 -0.6785 -0.6430 -0.6430 -0.2615 -0.2615 -0.2584 -0.2584 0.7683 0.7683 0.8088 0.8088 0.8417 0.8417 0.8430 0.8430 0.8939 0.8939 0.8940 0.8940 1.4423 1.4423 1.5435 1.5435 2.2296 2.2296 2.2377 2.2377 2.6449 2.6449 2.6602 2.6602 2.7221 2.7221 2.7264 2.7264 3.2596 3.2596 3.2802 3.2802 3.6920 3.6920 3.6968 3.6968 3.7986 3.7986 3.8230 3.8230 4.3180 4.3180 4.3235 4.3235 4.3566 4.3566 4.3625 4.3625 4.6077 4.6077 4.6205 4.6205 4.8052 4.8052 4.8274 4.8274 4.9273 4.9273 4.9560 4.9560 5.5285 5.5285 5.5726 5.5726 6.4559 6.4559 6.5076 6.5076 6.9551 6.9551 6.9958 6.9958 k = 0.0000 0.3095-0.0000 ( 5075 PWs) bands (ev): -13.2357 -13.2357 -13.1567 -13.1567 -13.1077 -13.1077 -13.0488 -13.0488 -12.1194 -12.1194 -12.0879 -12.0879 -11.4747 -11.4747 -11.4676 -11.4676 -0.6952 -0.6952 -0.6242 -0.6242 -0.2626 -0.2626 -0.2566 -0.2566 0.7471 0.7471 0.8281 0.8281 0.8417 0.8417 0.8440 0.8440 0.8942 0.8942 0.8944 0.8944 1.3931 1.3931 1.5945 1.5945 2.2178 2.2178 2.2328 2.2328 2.6433 2.6433 2.6746 2.6746 2.7194 2.7194 2.7281 2.7281 3.2497 3.2497 3.2909 3.2909 3.6911 3.6911 3.7009 3.7009 3.7856 3.7856 3.8343 3.8343 4.3134 4.3134 4.3232 4.3232 4.3571 4.3571 4.3675 4.3675 4.6013 4.6013 4.6267 4.6267 4.7940 4.7940 4.8383 4.8383 4.9133 4.9133 4.9708 4.9708 5.5053 5.5053 5.5933 5.5933 6.4288 6.4288 6.5321 6.5321 6.9315 6.9315 6.9962 6.9962 k = 0.0000 0.3001-0.0000 ( 5069 PWs) bands (ev): -13.2558 -13.2558 -13.1375 -13.1375 -13.1225 -13.1225 -13.0344 -13.0344 -12.1271 -12.1271 -12.0801 -12.0801 -11.4752 -11.4752 -11.4645 -11.4645 -0.7111 -0.7111 -0.6047 -0.6047 -0.2635 -0.2635 -0.2547 -0.2547 0.7252 0.7252 0.8405 0.8405 0.8451 0.8451 0.8485 0.8485 0.8947 0.8947 0.8950 0.8950 1.3454 1.3454 1.6452 1.6452 2.2022 2.2022 2.2222 2.2222 2.6443 2.6443 2.6929 2.6929 2.7165 2.7165 2.7299 2.7299 3.2400 3.2400 3.3020 3.3020 3.6910 3.6910 3.7062 3.7062 3.7720 3.7720 3.8449 3.8449 4.3082 4.3082 4.3211 4.3211 4.3599 4.3599 4.3734 4.3734 4.5950 4.5950 4.6328 4.6328 4.7829 4.7829 4.8488 4.8488 4.8997 4.8997 4.9858 4.9858 5.4815 5.4815 5.6132 5.6132 6.4011 6.4011 6.5557 6.5557 6.9077 6.9077 6.9912 6.9912 k = 0.0000 0.2907-0.0000 ( 5067 PWs) bands (ev): -13.2758 -13.2758 -13.1375 -13.1375 -13.1186 -13.1186 -13.0202 -13.0202 -12.1346 -12.1346 -12.0724 -12.0724 -11.4751 -11.4751 -11.4610 -11.4610 -0.7262 -0.7262 -0.5847 -0.5847 -0.2640 -0.2640 -0.2529 -0.2529 0.7025 0.7025 0.8412 0.8412 0.8466 0.8466 0.8667 0.8667 0.8953 0.8953 0.8957 0.8957 1.2995 1.2995 1.6947 1.6947 2.1845 2.1845 2.2063 2.2063 2.6468 2.6468 2.7094 2.7094 2.7164 2.7164 2.7336 2.7336 3.2307 3.2307 3.3136 3.3136 3.6915 3.6915 3.7128 3.7128 3.7580 3.7580 3.8549 3.8549 4.3026 4.3026 4.3177 4.3177 4.3643 4.3643 4.3798 4.3798 4.5888 4.5888 4.6386 4.6386 4.7718 4.7718 4.8582 4.8582 4.8870 4.8870 5.0011 5.0011 5.4570 5.4570 5.6320 5.6320 6.3727 6.3727 6.5782 6.5782 6.8840 6.8840 6.9863 6.9863 k = 0.0000 0.2814-0.0000 ( 5065 PWs) bands (ev): -13.2957 -13.2957 -13.1523 -13.1523 -13.1003 -13.1003 -13.0063 -13.0063 -12.1420 -12.1420 -12.0648 -12.0648 -11.4746 -11.4746 -11.4570 -11.4570 -0.7404 -0.7404 -0.5642 -0.5642 -0.2641 -0.2641 -0.2511 -0.2511 0.6791 0.6791 0.8416 0.8416 0.8483 0.8483 0.8850 0.8850 0.8962 0.8962 0.8967 0.8967 1.2557 1.2557 1.7420 1.7420 2.1662 2.1662 2.1861 2.1861 2.6498 2.6498 2.7078 2.7078 2.7248 2.7248 2.7493 2.7493 3.2217 3.2217 3.3258 3.3258 3.6926 3.6926 3.7207 3.7207 3.7436 3.7436 3.8643 3.8643 4.2967 4.2967 4.3137 4.3137 4.3697 4.3697 4.3866 4.3866 4.5827 4.5827 4.6440 4.6440 4.7609 4.7609 4.8618 4.8618 4.8799 4.8799 5.0167 5.0167 5.4321 5.4321 5.6499 5.6499 6.3438 6.3438 6.5998 6.5998 6.8604 6.8604 6.9818 6.9818 k = 0.0000 0.2720-0.0000 ( 5067 PWs) bands (ev): -13.3156 -13.3156 -13.1671 -13.1671 -13.0825 -13.0825 -12.9925 -12.9925 -12.1491 -12.1491 -12.0573 -12.0573 -11.4735 -11.4735 -11.4525 -11.4525 -0.7539 -0.7539 -0.5433 -0.5433 -0.2639 -0.2639 -0.2496 -0.2496 0.6549 0.6549 0.8423 0.8423 0.8501 0.8501 0.8967 0.8967 0.8979 0.8979 0.9037 0.9037 1.2142 1.2142 1.7857 1.7857 2.1492 2.1492 2.1627 2.1627 2.6522 2.6522 2.7036 2.7036 2.7265 2.7265 2.7756 2.7756 3.2131 3.2131 3.3388 3.3388 3.6941 3.6941 3.7263 3.7263 3.7327 3.7327 3.8730 3.8730 4.2906 4.2906 4.3094 4.3094 4.3757 4.3757 4.3937 4.3937 4.5769 4.5769 4.6491 4.6491 4.7501 4.7501 4.8526 4.8526 4.8853 4.8853 5.0326 5.0326 5.4067 5.4067 5.6666 5.6666 6.3145 6.3145 6.6203 6.6203 6.8370 6.8370 6.9779 6.9779 k = 0.0000 0.2626-0.0000 ( 5067 PWs) bands (ev): -13.3352 -13.3352 -13.1818 -13.1818 -13.0652 -13.0652 -12.9789 -12.9789 -12.1558 -12.1558 -12.0501 -12.0501 -11.4720 -11.4720 -11.4476 -11.4476 -0.7665 -0.7665 -0.5219 -0.5219 -0.2632 -0.2632 -0.2485 -0.2485 0.6302 0.6302 0.8432 0.8432 0.8521 0.8521 0.8981 0.8981 0.8993 0.8993 0.9216 0.9216 1.1752 1.1752 1.8236 1.8236 2.1323 2.1323 2.1402 2.1402 2.6536 2.6536 2.6988 2.6988 2.7265 2.7265 2.8047 2.8047 3.2052 3.2052 3.3527 3.3527 3.6958 3.6958 3.7127 3.7127 3.7420 3.7420 3.8810 3.8810 4.2844 4.2844 4.3051 4.3051 4.3822 4.3822 4.4011 4.4011 4.5713 4.5713 4.6538 4.6538 4.7395 4.7395 4.8394 4.8394 4.8944 4.8944 5.0488 5.0488 5.3810 5.3810 5.6822 5.6822 6.2851 6.2851 6.6400 6.6400 6.8137 6.8137 6.9744 6.9744 k = 0.0000 0.2532-0.0000 ( 5067 PWs) bands (ev): -13.3546 -13.3546 -13.1963 -13.1963 -13.0486 -13.0486 -12.9657 -12.9657 -12.1623 -12.1623 -12.0431 -12.0431 -11.4700 -11.4700 -11.4424 -11.4424 -0.7783 -0.7783 -0.5003 -0.5003 -0.2622 -0.2622 -0.2478 -0.2478 0.6050 0.6050 0.8443 0.8443 0.8543 0.8543 0.8994 0.8994 0.9009 0.9009 0.9396 0.9396 1.1387 1.1387 1.8529 1.8529 2.1053 2.1053 2.1327 2.1327 2.6532 2.6532 2.6937 2.6937 2.7258 2.7258 2.8349 2.8349 3.1981 3.1981 3.3675 3.3675 3.6963 3.6963 3.6986 3.6986 3.7544 3.7544 3.8884 3.8884 4.2781 4.2781 4.3008 4.3008 4.3892 4.3892 4.4087 4.4087 4.5661 4.5661 4.6579 4.6579 4.7291 4.7291 4.8254 4.8254 4.9040 4.9040 5.0654 5.0654 5.3551 5.3551 5.6966 5.6966 6.2556 6.2556 6.6586 6.6586 6.7906 6.7906 6.9715 6.9715 k = 0.0000 0.2438-0.0000 ( 5065 PWs) bands (ev): -13.3737 -13.3737 -13.2107 -13.2107 -13.0328 -13.0328 -12.9526 -12.9526 -12.1684 -12.1684 -12.0363 -12.0363 -11.4676 -11.4676 -11.4367 -11.4367 -0.7892 -0.7892 -0.4784 -0.4784 -0.2607 -0.2607 -0.2478 -0.2478 0.5797 0.5797 0.8456 0.8456 0.8566 0.8566 0.9008 0.9008 0.9027 0.9027 0.9574 0.9574 1.1048 1.1048 1.8709 1.8709 2.0748 2.0748 2.1370 2.1370 2.6509 2.6509 2.6882 2.6882 2.7247 2.7247 2.8652 2.8652 3.1921 3.1921 3.3833 3.3833 3.6812 3.6812 3.6999 3.6999 3.7684 3.7684 3.8952 3.8952 4.2719 4.2719 4.2966 4.2966 4.3964 4.3964 4.4167 4.4167 4.5612 4.5612 4.6616 4.6616 4.7189 4.7189 4.8110 4.8110 4.9134 4.9134 5.0823 5.0823 5.3290 5.3290 5.7099 5.7099 6.2262 6.2262 6.6764 6.6764 6.7676 6.7676 6.9690 6.9690 k = 0.0000 0.2345-0.0000 ( 5077 PWs) bands (ev): -13.3925 -13.3925 -13.2248 -13.2248 -13.0177 -13.0177 -12.9399 -12.9399 -12.1740 -12.1740 -12.0297 -12.0297 -11.4647 -11.4647 -11.4308 -11.4308 -0.7992 -0.7992 -0.4564 -0.4564 -0.2587 -0.2587 -0.2487 -0.2487 0.5546 0.5546 0.8471 0.8471 0.8590 0.8590 0.9022 0.9022 0.9047 0.9047 0.9751 0.9751 1.0734 1.0734 1.8766 1.8766 2.0428 2.0428 2.1524 2.1524 2.6465 2.6465 2.6824 2.6824 2.7232 2.7232 2.8948 2.8948 3.1874 3.1874 3.4002 3.4002 3.6651 3.6651 3.7019 3.7019 3.7839 3.7839 3.9014 3.9014 4.2657 4.2657 4.2924 4.2924 4.4040 4.4040 4.4248 4.4248 4.5567 4.5567 4.6645 4.6645 4.7090 4.7090 4.7966 4.7966 4.9226 4.9226 5.0995 5.0995 5.3029 5.3029 5.7220 5.7220 6.1970 6.1970 6.6932 6.6932 6.7446 6.7446 6.9669 6.9669 k = 0.0000 0.2251-0.0000 ( 5071 PWs) bands (ev): -13.4109 -13.4109 -13.2387 -13.2387 -13.0035 -13.0035 -12.9274 -12.9274 -12.1792 -12.1792 -12.0234 -12.0234 -11.4615 -11.4615 -11.4246 -11.4246 -0.8084 -0.8084 -0.4343 -0.4343 -0.2564 -0.2564 -0.2506 -0.2506 0.5301 0.5301 0.8487 0.8487 0.8616 0.8616 0.9039 0.9039 0.9068 0.9068 0.9925 0.9925 1.0445 1.0445 1.8722 1.8722 2.0099 2.0099 2.1768 2.1768 2.6400 2.6400 2.6764 2.6764 2.7215 2.7215 2.9229 2.9229 3.1846 3.1846 3.4180 3.4180 3.6488 3.6488 3.7040 3.7040 3.8008 3.8008 3.9069 3.9069 4.2597 4.2597 4.2884 4.2884 4.4118 4.4118 4.4332 4.4332 4.5527 4.5527 4.6665 4.6665 4.6995 4.6995 4.7822 4.7822 4.9316 4.9316 5.1170 5.1170 5.2769 5.2769 5.7328 5.7328 6.1682 6.1682 6.7091 6.7091 6.7217 6.7217 6.9654 6.9654 k = 0.0000 0.2157-0.0000 ( 5069 PWs) bands (ev): -13.4289 -13.4289 -13.2523 -13.2523 -12.9901 -12.9901 -12.9152 -12.9152 -12.1840 -12.1840 -12.0175 -12.0175 -11.4579 -11.4579 -11.4182 -11.4182 -0.8168 -0.8168 -0.4123 -0.4123 -0.2538 -0.2538 -0.2536 -0.2536 0.5065 0.5065 0.8506 0.8506 0.8642 0.8642 0.9056 0.9056 0.9091 0.9091 1.0076 1.0076 1.0201 1.0201 1.8610 1.8610 1.9763 1.9763 2.2065 2.2065 2.6316 2.6316 2.6701 2.6701 2.7195 2.7195 2.9488 2.9488 3.1840 3.1840 3.4366 3.4366 3.6325 3.6325 3.7059 3.7059 3.8190 3.8190 3.9119 3.9119 4.2539 4.2539 4.2844 4.2844 4.4198 4.4198 4.4418 4.4418 4.5491 4.5491 4.6676 4.6676 4.6902 4.6902 4.7680 4.7680 4.9401 4.9401 5.1347 5.1347 5.2510 5.2510 5.7423 5.7423 6.1401 6.1401 6.6986 6.6986 6.7244 6.7244 6.9643 6.9643 k = 0.0000 0.2063-0.0000 ( 5077 PWs) bands (ev): -13.4465 -13.4465 -13.2655 -13.2655 -12.9777 -12.9777 -12.9033 -12.9033 -12.1883 -12.1883 -12.0117 -12.0117 -11.4540 -11.4540 -11.4116 -11.4116 -0.8244 -0.8244 -0.3904 -0.3904 -0.2583 -0.2583 -0.2504 -0.2504 0.4844 0.4844 0.8526 0.8526 0.8669 0.8669 0.9074 0.9074 0.9115 0.9115 0.9911 0.9911 1.0290 1.0290 1.8459 1.8459 1.9423 1.9423 2.2383 2.2383 2.6217 2.6217 2.6637 2.6637 2.7173 2.7173 2.9716 2.9716 3.1864 3.1864 3.4561 3.4561 3.6161 3.6161 3.7077 3.7077 3.8384 3.8384 3.9163 3.9163 4.2484 4.2484 4.2805 4.2805 4.4281 4.4281 4.4506 4.4506 4.5460 4.5460 4.6670 4.6670 4.6815 4.6815 4.7544 4.7544 4.9483 4.9483 5.1524 5.1524 5.2256 5.2256 5.7506 5.7506 6.1127 6.1127 6.6755 6.6755 6.7388 6.7388 6.9636 6.9636 k = 0.0000 0.1969-0.0000 ( 5083 PWs) bands (ev): -13.4635 -13.4635 -13.2784 -13.2784 -12.9662 -12.9662 -12.8917 -12.8917 -12.1920 -12.1920 -12.0063 -12.0063 -11.4499 -11.4499 -11.4048 -11.4048 -0.8311 -0.8311 -0.3688 -0.3688 -0.2643 -0.2643 -0.2467 -0.2467 0.4642 0.4642 0.8548 0.8548 0.8697 0.8697 0.9092 0.9092 0.9140 0.9140 0.9681 0.9681 1.0460 1.0460 1.8290 1.8290 1.9082 1.9082 2.2697 2.2697 2.6109 2.6109 2.6572 2.6572 2.7149 2.7149 2.9905 2.9905 3.1923 3.1923 3.4761 3.4761 3.5998 3.5998 3.7093 3.7093 3.8588 3.8588 3.9203 3.9203 4.2431 4.2431 4.2767 4.2767 4.4364 4.4364 4.4597 4.4597 4.5436 4.5436 4.6640 4.6640 4.6738 4.6738 4.7418 4.7418 4.9560 4.9560 5.1696 5.1696 5.2012 5.2012 5.7576 5.7576 6.0863 6.0863 6.6524 6.6524 6.7524 6.7524 6.9633 6.9633 k = 0.0000 0.1876-0.0000 ( 5083 PWs) bands (ev): -13.4800 -13.4800 -13.2910 -13.2910 -12.9556 -12.9556 -12.8804 -12.8804 -12.1953 -12.1953 -12.0012 -12.0012 -11.4455 -11.4455 -11.3980 -11.3980 -0.8371 -0.8371 -0.3476 -0.3476 -0.2720 -0.2720 -0.2427 -0.2427 0.4463 0.4463 0.8570 0.8570 0.8725 0.8725 0.9111 0.9111 0.9166 0.9166 0.9463 0.9463 1.0630 1.0630 1.8116 1.8116 1.8743 1.8743 2.2987 2.2987 2.6000 2.6000 2.6505 2.6505 2.7124 2.7124 3.0051 3.0051 3.2019 3.2019 3.4967 3.4967 3.5836 3.5836 3.7108 3.7108 3.8802 3.8802 3.9238 3.9238 4.2382 4.2382 4.2729 4.2729 4.4447 4.4447 4.4691 4.4691 4.5418 4.5418 4.6577 4.6577 4.6673 4.6673 4.7311 4.7311 4.9633 4.9633 5.1716 5.1716 5.1926 5.1926 5.7634 5.7634 6.0610 6.0610 6.6292 6.6292 6.7653 6.7653 6.9633 6.9633 k = 0.0000 0.1782-0.0000 ( 5085 PWs) bands (ev): -13.4959 -13.4959 -13.3031 -13.3031 -12.9460 -12.9460 -12.8696 -12.8696 -12.1981 -12.1981 -11.9963 -11.9963 -11.4409 -11.4409 -11.3911 -11.3911 -0.8424 -0.8424 -0.3269 -0.3269 -0.2814 -0.2814 -0.2384 -0.2384 0.4309 0.4309 0.8594 0.8594 0.8753 0.8753 0.9130 0.9130 0.9188 0.9188 0.9261 0.9261 1.0799 1.0799 1.7945 1.7945 1.8408 1.8408 2.3236 2.3236 2.5903 2.5903 2.6437 2.6437 2.7099 2.7099 3.0154 3.0154 3.2152 3.2152 3.5176 3.5176 3.5676 3.5676 3.7120 3.7120 3.9021 3.9021 3.9270 3.9270 4.2336 4.2336 4.2693 4.2693 4.4530 4.4530 4.4786 4.4786 4.5407 4.5407 4.6489 4.6489 4.6608 4.6608 4.7227 4.7227 4.9700 4.9700 5.1491 5.1491 5.2090 5.2090 5.7679 5.7679 6.0370 6.0370 6.6059 6.6059 6.7776 6.7776 6.9637 6.9637 k = 0.0000 0.1688-0.0000 ( 5093 PWs) bands (ev): -13.5112 -13.5112 -13.3148 -13.3148 -12.9372 -12.9372 -12.8592 -12.8592 -12.2003 -12.2003 -11.9918 -11.9918 -11.4362 -11.4362 -11.3842 -11.3842 -0.8469 -0.8469 -0.3068 -0.3068 -0.2924 -0.2924 -0.2336 -0.2336 0.4183 0.4183 0.8618 0.8618 0.8781 0.8781 0.9057 0.9057 0.9149 0.9149 0.9224 0.9224 1.0966 1.0966 1.7782 1.7782 1.8078 1.8078 2.3425 2.3425 2.5833 2.5833 2.6370 2.6370 2.7072 2.7072 3.0220 3.0220 3.2313 3.2313 3.5383 3.5383 3.5524 3.5524 3.7131 3.7131 3.9225 3.9225 3.9318 3.9318 4.2295 4.2295 4.2657 4.2657 4.4611 4.4611 4.4882 4.4882 4.5403 4.5403 4.6383 4.6383 4.6536 4.6536 4.7168 4.7168 4.9762 4.9762 5.1257 5.1257 5.2270 5.2270 5.7712 5.7712 6.0143 6.0143 6.5825 6.5825 6.7892 6.7892 6.9644 6.9644 k = 0.0000 0.1594-0.0000 ( 5083 PWs) bands (ev): -13.5258 -13.5258 -13.3260 -13.3260 -12.9294 -12.9294 -12.8492 -12.8492 -12.2022 -12.2022 -11.9875 -11.9875 -11.4313 -11.4313 -11.3773 -11.3773 -0.8507 -0.8507 -0.3050 -0.3050 -0.2874 -0.2874 -0.2285 -0.2285 0.4086 0.4086 0.8643 0.8643 0.8801 0.8801 0.8877 0.8877 0.9169 0.9169 0.9250 0.9250 1.1131 1.1131 1.7633 1.7633 1.7756 1.7756 2.3535 2.3535 2.5808 2.5808 2.6302 2.6302 2.7046 2.7046 3.0257 3.0257 3.2494 3.2494 3.5356 3.5356 3.5611 3.5611 3.7140 3.7140 3.9299 3.9299 3.9493 3.9493 4.2260 4.2260 4.2623 4.2623 4.4688 4.4688 4.4979 4.4979 4.5408 4.5408 4.6262 4.6262 4.6462 4.6462 4.7130 4.7130 4.9817 4.9817 5.1030 5.1030 5.2453 5.2453 5.7733 5.7733 5.9934 5.9934 6.5590 6.5590 6.8002 6.8002 6.9653 6.9653 k = 0.0000 0.1501-0.0000 ( 5091 PWs) bands (ev): -13.5398 -13.5398 -13.3367 -13.3367 -12.9223 -12.9223 -12.8397 -12.8397 -12.2035 -12.2035 -11.9836 -11.9836 -11.4265 -11.4265 -11.3706 -11.3706 -0.8539 -0.8539 -0.3190 -0.3190 -0.2689 -0.2689 -0.2231 -0.2231 0.4019 0.4019 0.8659 0.8659 0.8687 0.8687 0.8844 0.8844 0.9187 0.9187 0.9278 0.9278 1.1292 1.1292 1.7442 1.7442 1.7499 1.7499 2.3557 2.3557 2.5836 2.5836 2.6236 2.6236 2.7019 2.7019 3.0272 3.0272 3.2685 3.2685 3.5207 3.5207 3.5825 3.5825 3.7147 3.7147 3.9322 3.9322 3.9713 3.9713 4.2229 4.2229 4.2590 4.2590 4.4759 4.4759 4.5074 4.5074 4.5418 4.5418 4.6133 4.6133 4.6391 4.6391 4.7105 4.7105 4.9862 4.9862 5.0812 5.0812 5.2635 5.2635 5.7742 5.7742 5.9740 5.9740 6.5355 6.5355 6.8105 6.8105 6.9665 6.9665 k = 0.0000 0.1407-0.0000 ( 5095 PWs) bands (ev): -13.5531 -13.5531 -13.3469 -13.3469 -12.9160 -12.9160 -12.8307 -12.8307 -12.2045 -12.2045 -11.9799 -11.9799 -11.4215 -11.4215 -11.3640 -11.3640 -0.8564 -0.8564 -0.3341 -0.3341 -0.2514 -0.2514 -0.2175 -0.2175 0.3981 0.3981 0.8498 0.8498 0.8696 0.8696 0.8869 0.8869 0.9206 0.9206 0.9306 0.9306 1.1449 1.1449 1.7141 1.7141 1.7381 1.7381 2.3494 2.3494 2.5913 2.5913 2.6173 2.6173 2.6993 2.6993 3.0274 3.0274 3.2879 3.2879 3.5061 3.5061 3.6041 3.6041 3.7152 3.7152 3.9339 3.9339 3.9931 3.9931 4.2205 4.2205 4.2558 4.2558 4.4822 4.4822 4.5163 4.5163 4.5431 4.5431 4.6012 4.6012 4.6325 4.6325 4.7090 4.7090 4.9893 4.9893 5.0611 5.0611 5.2817 5.2817 5.7739 5.7739 5.9566 5.9566 6.5121 6.5121 6.8203 6.8203 6.9680 6.9680 k = 0.0000 0.1313-0.0000 ( 5105 PWs) bands (ev): -13.5656 -13.5656 -13.3565 -13.3565 -12.9104 -12.9104 -12.8223 -12.8223 -12.2051 -12.2051 -11.9765 -11.9765 -11.4167 -11.4167 -11.3576 -11.3576 -0.8585 -0.8585 -0.3502 -0.3502 -0.2350 -0.2350 -0.2115 -0.2115 0.3971 0.3971 0.8321 0.8321 0.8720 0.8720 0.8895 0.8895 0.9223 0.9223 0.9333 0.9333 1.1601 1.1601 1.6853 1.6853 1.7282 1.7282 2.3363 2.3363 2.6018 2.6018 2.6120 2.6120 2.6967 2.6967 3.0266 3.0266 3.3070 3.3070 3.4920 3.4920 3.6258 3.6258 3.7156 3.7156 3.9351 3.9351 4.0141 4.0141 4.2186 4.2186 4.2527 4.2527 4.4868 4.4868 4.5235 4.5235 4.5444 4.5444 4.5923 4.5923 4.6263 4.6263 4.7080 4.7080 4.9897 4.9897 5.0437 5.0437 5.2997 5.2997 5.7724 5.7724 5.9411 5.9411 6.4887 6.4887 6.8295 6.8295 6.9696 6.9696 k = 0.0000 0.1219-0.0000 ( 5109 PWs) bands (ev): -13.5774 -13.5774 -13.3656 -13.3656 -12.9055 -12.9055 -12.8144 -12.8144 -12.2053 -12.2053 -11.9733 -11.9733 -11.4119 -11.4119 -11.3515 -11.3515 -0.8599 -0.8599 -0.3668 -0.3668 -0.2200 -0.2200 -0.2051 -0.2051 0.3987 0.3987 0.8144 0.8144 0.8746 0.8746 0.8920 0.8920 0.9241 0.9241 0.9360 0.9360 1.1748 1.1748 1.6579 1.6579 1.7203 1.7203 2.3182 2.3182 2.6030 2.6030 2.6182 2.6182 2.6942 2.6942 3.0252 3.0252 3.3254 3.3254 3.4785 3.4785 3.6475 3.6475 3.7158 3.7158 3.9361 3.9361 4.0338 4.0338 4.2174 4.2174 4.2499 4.2499 4.4882 4.4882 4.5271 4.5271 4.5471 4.5471 4.5890 4.5890 4.6207 4.6207 4.7072 4.7072 4.9852 4.9852 5.0316 5.0316 5.3175 5.3175 5.7699 5.7699 5.9275 5.9275 6.4655 6.4655 6.8381 6.8381 6.9713 6.9713 k = 0.0000 0.1125-0.0000 ( 5113 PWs) bands (ev): -13.5884 -13.5884 -13.3741 -13.3741 -12.9012 -12.9012 -12.8071 -12.8071 -12.2053 -12.2053 -11.9704 -11.9704 -11.4073 -11.4073 -11.3456 -11.3456 -0.8610 -0.8610 -0.3837 -0.3837 -0.2068 -0.2068 -0.1980 -0.1980 0.4028 0.4028 0.7966 0.7966 0.8770 0.8770 0.8945 0.8945 0.9257 0.9257 0.9386 0.9386 1.1890 1.1890 1.6320 1.6320 1.7144 1.7144 2.2968 2.2968 2.5976 2.5976 2.6319 2.6319 2.6919 2.6919 3.0236 3.0236 3.3428 3.3428 3.4656 3.4656 3.6691 3.6691 3.7160 3.7160 3.9369 3.9369 4.0519 4.0519 4.2168 4.2168 4.2472 4.2472 4.4838 4.4838 4.5277 4.5277 4.5529 4.5529 4.5917 4.5917 4.6156 4.6156 4.7066 4.7066 4.9742 4.9742 5.0262 5.0262 5.3349 5.3349 5.7664 5.7664 5.9161 5.9161 6.4426 6.4426 6.8461 6.8461 6.9731 6.9731 k = 0.0000 0.1032-0.0000 ( 5121 PWs) bands (ev): -13.5986 -13.5986 -13.3819 -13.3819 -12.8974 -12.8974 -12.8004 -12.8004 -12.2050 -12.2050 -11.9678 -11.9678 -11.4028 -11.4028 -11.3400 -11.3400 -0.8616 -0.8616 -0.4005 -0.4005 -0.1967 -0.1967 -0.1891 -0.1891 0.4091 0.4091 0.7788 0.7788 0.8794 0.8794 0.8968 0.8968 0.9273 0.9273 0.9411 0.9411 1.2024 1.2024 1.6079 1.6079 1.7105 1.7105 2.2732 2.2732 2.5921 2.5921 2.6458 2.6458 2.6897 2.6897 3.0218 3.0218 3.3590 3.3590 3.4535 3.4535 3.6904 3.6904 3.7161 3.7161 3.9374 3.9374 4.0683 4.0683 4.2170 4.2170 4.2447 4.2447 4.4727 4.4727 4.5294 4.5294 4.5604 4.5604 4.5985 4.5985 4.6110 4.6110 4.7062 4.7062 4.9589 4.9589 5.0253 5.0253 5.3520 5.3520 5.7619 5.7619 5.9067 5.9067 6.4201 6.4201 6.8535 6.8535 6.9749 6.9749 k = 0.0000 0.0938-0.0000 ( 5123 PWs) bands (ev): -13.6080 -13.6080 -13.3892 -13.3892 -12.8942 -12.8942 -12.7943 -12.7943 -12.2046 -12.2046 -11.9654 -11.9654 -11.3986 -11.3986 -11.3348 -11.3348 -0.8618 -0.8618 -0.4170 -0.4170 -0.1892 -0.1892 -0.1789 -0.1789 0.4173 0.4173 0.7607 0.7607 0.8817 0.8817 0.8990 0.8990 0.9288 0.9288 0.9435 0.9435 1.2151 1.2151 1.5856 1.5856 1.7086 1.7086 2.2483 2.2483 2.5868 2.5868 2.6590 2.6590 2.6876 2.6876 3.0199 3.0199 3.3739 3.3739 3.4423 3.4423 3.7103 3.7103 3.7173 3.7173 3.9379 3.9379 4.0826 4.0826 4.2177 4.2177 4.2424 4.2424 4.4571 4.4571 4.5329 4.5329 4.5687 4.5687 4.6061 4.6061 4.6088 4.6088 4.7059 4.7059 4.9419 4.9419 5.0263 5.0263 5.3687 5.3687 5.7566 5.7566 5.8992 5.8992 6.3982 6.3982 6.8603 6.8603 6.9768 6.9768 k = 0.0000 0.0844-0.0000 ( 5123 PWs) bands (ev): -13.6165 -13.6165 -13.3958 -13.3958 -12.8915 -12.8915 -12.7887 -12.7887 -12.2040 -12.2040 -11.9633 -11.9633 -11.3946 -11.3946 -11.3300 -11.3300 -0.8617 -0.8617 -0.4328 -0.4328 -0.1827 -0.1827 -0.1692 -0.1692 0.4274 0.4274 0.7425 0.7425 0.8839 0.8839 0.9011 0.9011 0.9301 0.9301 0.9457 0.9457 1.2269 1.2269 1.5652 1.5652 1.7085 1.7085 2.2229 2.2229 2.5819 2.5819 2.6710 2.6710 2.6858 2.6858 3.0181 3.0181 3.3873 3.3873 3.4319 3.4319 3.7151 3.7151 3.7329 3.7329 3.9382 3.9382 4.0949 4.0949 4.2191 4.2191 4.2404 4.2404 4.4389 4.4389 4.5371 4.5371 4.5772 4.5772 4.6029 4.6029 4.6197 4.6197 4.7056 4.7056 4.9243 4.9243 5.0280 5.0280 5.3849 5.3849 5.7506 5.7506 5.8936 5.8936 6.3771 6.3771 6.8666 6.8666 6.9786 6.9786 k = 0.0000 0.0750-0.0000 ( 5123 PWs) bands (ev): -13.6242 -13.6242 -13.4017 -13.4017 -12.8891 -12.8891 -12.7838 -12.7838 -12.2033 -12.2033 -11.9614 -11.9614 -11.3909 -11.3909 -11.3256 -11.3256 -0.8614 -0.8614 -0.4476 -0.4476 -0.1765 -0.1765 -0.1606 -0.1606 0.4390 0.4390 0.7240 0.7240 0.8859 0.8859 0.9029 0.9029 0.9314 0.9314 0.9477 0.9477 1.2379 1.2379 1.5468 1.5468 1.7102 1.7102 2.1976 2.1976 2.5774 2.5774 2.6808 2.6808 2.6850 2.6850 3.0165 3.0165 3.3991 3.3991 3.4227 3.4227 3.7151 3.7151 3.7526 3.7526 3.9383 3.9383 4.1053 4.1053 4.2211 4.2211 4.2387 4.2387 4.4197 4.4197 4.5415 4.5415 4.5853 4.5853 4.5997 4.5997 4.6324 4.6324 4.7055 4.7055 4.9067 4.9067 5.0298 5.0298 5.4004 5.4004 5.7440 5.7440 5.8897 5.8897 6.3570 6.3570 6.8722 6.8722 6.9803 6.9803 k = 0.0000 0.0656-0.0000 ( 5135 PWs) bands (ev): -13.6310 -13.6310 -13.4070 -13.4070 -12.8872 -12.8872 -12.7795 -12.7795 -12.2026 -12.2026 -11.9598 -11.9598 -11.3876 -11.3876 -11.3216 -11.3216 -0.8610 -0.8610 -0.4613 -0.4613 -0.1706 -0.1706 -0.1533 -0.1533 0.4521 0.4521 0.7052 0.7052 0.8878 0.8878 0.9046 0.9046 0.9324 0.9324 0.9496 0.9496 1.2477 1.2477 1.5305 1.5305 1.7133 1.7133 2.1730 2.1730 2.5733 2.5733 2.6817 2.6817 2.6918 2.6918 3.0149 3.0149 3.4077 3.4077 3.4162 3.4162 3.7150 3.7150 3.7714 3.7714 3.9384 3.9384 4.1137 4.1137 4.2234 4.2234 4.2375 4.2375 4.4000 4.4000 4.5457 4.5457 4.5921 4.5921 4.5979 4.5979 4.6462 4.6462 4.7055 4.7055 4.8892 4.8892 5.0316 5.0316 5.4151 5.4151 5.7371 5.7371 5.8873 5.8873 6.3381 6.3381 6.8772 6.8772 6.9820 6.9820 k = 0.0000 0.0563-0.0000 ( 5131 PWs) bands (ev): -13.6369 -13.6369 -13.4116 -13.4116 -12.8855 -12.8855 -12.7757 -12.7757 -12.2019 -12.2019 -11.9583 -11.9583 -11.3846 -11.3846 -11.3181 -11.3181 -0.8604 -0.8604 -0.4736 -0.4736 -0.1651 -0.1651 -0.1473 -0.1473 0.4663 0.4663 0.6863 0.6863 0.8894 0.8894 0.9061 0.9061 0.9334 0.9334 0.9512 0.9512 1.2565 1.2565 1.5162 1.5162 1.7176 1.7176 2.1496 2.1496 2.5697 2.5697 2.6806 2.6806 2.6997 2.6997 3.0136 3.0136 3.4048 3.4048 3.4207 3.4207 3.7148 3.7148 3.7890 3.7890 3.9384 3.9384 4.1206 4.1206 4.2257 4.2257 4.2373 4.2373 4.3805 4.3805 4.5495 4.5495 4.5929 4.5929 4.6018 4.6018 4.6608 4.6608 4.7058 4.7058 4.8718 4.8718 5.0332 5.0332 5.4289 5.4289 5.7300 5.7300 5.8862 5.8862 6.3208 6.3208 6.8816 6.8816 6.9835 6.9835 k = 0.0000 0.0469-0.0000 ( 5131 PWs) bands (ev): -13.6420 -13.6420 -13.4155 -13.4155 -12.8842 -12.8842 -12.7726 -12.7726 -12.2012 -12.2012 -11.9571 -11.9571 -11.3821 -11.3821 -11.3152 -11.3152 -0.8598 -0.8598 -0.4844 -0.4844 -0.1600 -0.1600 -0.1426 -0.1426 0.4817 0.4817 0.6672 0.6672 0.8909 0.8909 0.9074 0.9074 0.9342 0.9342 0.9526 0.9526 1.2641 1.2641 1.5042 1.5042 1.7228 1.7228 2.1280 2.1280 2.5666 2.5666 2.6794 2.6794 2.7063 2.7063 3.0124 3.0124 3.3989 3.3989 3.4280 3.4280 3.7146 3.7146 3.8050 3.8050 3.9384 3.9384 4.1260 4.1260 4.2274 4.2274 4.2386 4.2386 4.3615 4.3615 4.5529 4.5529 4.5912 4.5912 4.6077 4.6077 4.6754 4.6754 4.7069 4.7069 4.8544 4.8544 5.0347 5.0347 5.4414 5.4414 5.7231 5.7231 5.8860 5.8860 6.3053 6.3053 6.8854 6.8854 6.9848 6.9848 k = 0.0000 0.0375-0.0000 ( 5135 PWs) bands (ev): -13.6461 -13.6461 -13.4187 -13.4187 -12.8832 -12.8832 -12.7700 -12.7700 -12.2006 -12.2006 -11.9562 -11.9562 -11.3800 -11.3800 -11.3127 -11.3127 -0.8591 -0.8591 -0.4934 -0.4934 -0.1554 -0.1554 -0.1391 -0.1391 0.4979 0.4979 0.6479 0.6479 0.8921 0.8921 0.9084 0.9084 0.9349 0.9349 0.9538 0.9538 1.2705 1.2705 1.4943 1.4943 1.7282 1.7282 2.1089 2.1089 2.5640 2.5640 2.6785 2.6785 2.7117 2.7117 3.0115 3.0115 3.3937 3.3937 3.4342 3.4342 3.7144 3.7144 3.8189 3.8189 3.9384 3.9384 4.1302 4.1302 4.2281 4.2281 4.2420 4.2420 4.3435 4.3435 4.5557 4.5557 4.5895 4.5895 4.6129 4.6129 4.6882 4.6882 4.7105 4.7105 4.8372 4.8372 5.0358 5.0358 5.4525 5.4525 5.7166 5.7166 5.8865 5.8865 6.2920 6.2920 6.8885 6.8885 6.9859 6.9859 k = 0.0000 0.0281-0.0000 ( 5123 PWs) bands (ev): -13.6493 -13.6493 -13.4212 -13.4212 -12.8824 -12.8824 -12.7680 -12.7680 -12.2001 -12.2001 -11.9554 -11.9554 -11.3783 -11.3783 -11.3108 -11.3108 -0.8586 -0.8586 -0.5006 -0.5006 -0.1515 -0.1515 -0.1367 -0.1367 0.5149 0.5149 0.6287 0.6287 0.8931 0.8931 0.9093 0.9093 0.9355 0.9355 0.9547 0.9547 1.2755 1.2755 1.4866 1.4866 1.7334 1.7334 2.0930 2.0930 2.5620 2.5620 2.6777 2.6777 2.7158 2.7158 3.0107 3.0107 3.3896 3.3896 3.4390 3.4390 3.7143 3.7143 3.8303 3.8303 3.9384 3.9384 4.1334 4.1334 4.2281 4.2281 4.2472 4.2472 4.3269 4.3269 4.5579 4.5579 4.5882 4.5882 4.6171 4.6171 4.6957 4.6957 4.7199 4.7199 4.8200 4.8200 5.0368 5.0368 5.4616 5.4616 5.7110 5.7110 5.8874 5.8874 6.2812 6.2812 6.8910 6.8910 6.9868 6.9868 k = 0.0000 0.0188-0.0000 ( 5123 PWs) bands (ev): -13.6516 -13.6516 -13.4230 -13.4230 -12.8819 -12.8819 -12.7665 -12.7665 -12.1998 -12.1998 -11.9549 -11.9549 -11.3771 -11.3771 -11.3094 -11.3094 -0.8582 -0.8582 -0.5058 -0.5058 -0.1484 -0.1484 -0.1353 -0.1353 0.5325 0.5325 0.6096 0.6096 0.8938 0.8938 0.9099 0.9099 0.9358 0.9358 0.9554 0.9554 1.2791 1.2791 1.4810 1.4810 1.7378 1.7378 2.0809 2.0809 2.5605 2.5605 2.6772 2.6772 2.7187 2.7187 3.0102 3.0102 3.3866 3.3866 3.4424 3.4424 3.7142 3.7142 3.8388 3.8388 3.9383 3.9383 4.1355 4.1355 4.2278 4.2278 4.2533 4.2533 4.3124 4.3124 4.5594 4.5594 4.5873 4.5873 4.6201 4.6201 4.6983 4.6983 4.7344 4.7344 4.8029 4.8029 5.0374 5.0374 5.4686 5.4686 5.7066 5.7066 5.8882 5.8882 6.2732 6.2732 6.8927 6.8927 6.9875 6.9875 k = 0.0000 0.0094-0.0000 ( 5113 PWs) bands (ev): -13.6530 -13.6530 -13.4241 -13.4241 -12.8816 -12.8816 -12.7657 -12.7657 -12.1995 -12.1995 -11.9545 -11.9545 -11.3763 -11.3763 -11.3085 -11.3085 -0.8579 -0.8579 -0.5089 -0.5089 -0.1464 -0.1464 -0.1346 -0.1346 0.5500 0.5500 0.5911 0.5911 0.8942 0.8942 0.9102 0.9102 0.9361 0.9361 0.9558 0.9558 1.2813 1.2813 1.4777 1.4777 1.7407 1.7407 2.0734 2.0734 2.5596 2.5596 2.6769 2.6769 2.7204 2.7204 3.0099 3.0099 3.3848 3.3848 3.4445 3.4445 3.7141 3.7141 3.8441 3.8441 3.9383 3.9383 4.1368 4.1368 4.2277 4.2277 4.2593 4.2593 4.3012 4.3012 4.5604 4.5604 4.5867 4.5867 4.6219 4.6219 4.6992 4.6992 4.7505 4.7505 4.7861 4.7861 5.0378 5.0378 5.4729 5.4729 5.7038 5.7038 5.8889 5.8889 6.2683 6.2683 6.8938 6.8938 6.9879 6.9879 k = 0.0000 0.0000 0.0000 ( 5107 PWs) bands (ev): -13.6535 -13.6535 -13.4245 -13.4245 -12.8814 -12.8814 -12.7654 -12.7654 -12.1995 -12.1995 -11.9544 -11.9544 -11.3761 -11.3761 -11.3082 -11.3082 -0.8578 -0.8578 -0.5100 -0.5100 -0.1457 -0.1457 -0.1343 -0.1343 0.5624 0.5624 0.5784 0.5784 0.8943 0.8943 0.9104 0.9104 0.9362 0.9362 0.9560 0.9560 1.2820 1.2820 1.4766 1.4766 1.7417 1.7417 2.0708 2.0708 2.5594 2.5594 2.6768 2.6768 2.7210 2.7210 3.0098 3.0098 3.3842 3.3842 3.4452 3.4452 3.7141 3.7141 3.8459 3.8459 3.9383 3.9383 4.1372 4.1372 4.2277 4.2277 4.2622 4.2622 4.2965 4.2965 4.5607 4.5607 4.5865 4.5865 4.6225 4.6225 4.6994 4.6994 4.7634 4.7634 4.7730 4.7730 5.0380 5.0380 5.4744 5.4744 5.7029 5.7029 5.8891 5.8891 6.2667 6.2667 6.8941 6.8941 6.9880 6.9880 k = 0.0000 0.0000 0.0000 ( 5107 PWs) bands (ev): -13.6535 -13.6535 -13.4245 -13.4245 -12.8814 -12.8814 -12.7654 -12.7654 -12.1995 -12.1995 -11.9544 -11.9544 -11.3761 -11.3761 -11.3082 -11.3082 -0.8578 -0.8578 -0.5100 -0.5100 -0.1457 -0.1457 -0.1343 -0.1343 0.5624 0.5624 0.5784 0.5784 0.8943 0.8943 0.9104 0.9104 0.9362 0.9362 0.9560 0.9560 1.2820 1.2820 1.4766 1.4766 1.7417 1.7417 2.0708 2.0708 2.5594 2.5594 2.6768 2.6768 2.7210 2.7210 3.0098 3.0098 3.3842 3.3842 3.4452 3.4452 3.7141 3.7141 3.8459 3.8459 3.9383 3.9383 4.1372 4.1372 4.2277 4.2277 4.2622 4.2622 4.2965 4.2965 4.5607 4.5607 4.5865 4.5865 4.6225 4.6225 4.6994 4.6994 4.7634 4.7634 4.7730 4.7730 5.0380 5.0380 5.4744 5.4744 5.7029 5.7029 5.8891 5.8891 6.2667 6.2667 6.8941 6.8941 6.9880 6.9880 k = 0.0000 0.0000 0.0095 ( 5105 PWs) bands (ev): -13.6530 -13.6530 -13.4252 -13.4252 -12.8809 -12.8809 -12.7655 -12.7655 -12.1989 -12.1989 -11.9551 -11.9551 -11.3759 -11.3759 -11.3084 -11.3084 -0.8567 -0.8567 -0.5103 -0.5103 -0.1457 -0.1457 -0.1344 -0.1344 0.5610 0.5610 0.5765 0.5765 0.8944 0.8944 0.9105 0.9105 0.9361 0.9361 0.9559 0.9559 1.2825 1.2825 1.4754 1.4754 1.7440 1.7440 2.0757 2.0757 2.5596 2.5596 2.6764 2.6764 2.7175 2.7175 3.0122 3.0122 3.3852 3.3852 3.4412 3.4412 3.7104 3.7104 3.8510 3.8510 3.9360 3.9360 4.1382 4.1382 4.2287 4.2287 4.2630 4.2630 4.2964 4.2964 4.5627 4.5627 4.5857 4.5857 4.6216 4.6216 4.6992 4.6992 4.7624 4.7624 4.7727 4.7727 5.0372 5.0372 5.4749 5.4749 5.7023 5.7023 5.8898 5.8898 6.2646 6.2646 6.8972 6.8972 6.9886 6.9886 k = 0.0000 0.0000 0.0190 ( 5111 PWs) bands (ev): -13.6518 -13.6518 -13.4275 -13.4275 -12.8794 -12.8794 -12.7660 -12.7660 -12.1974 -12.1974 -11.9571 -11.9571 -11.3752 -11.3752 -11.3087 -11.3087 -0.8534 -0.8534 -0.5111 -0.5111 -0.1459 -0.1459 -0.1346 -0.1346 0.5568 0.5568 0.5707 0.5707 0.8947 0.8947 0.9108 0.9108 0.9358 0.9358 0.9556 0.9556 1.2841 1.2841 1.4718 1.4718 1.7509 1.7509 2.0899 2.0899 2.5602 2.5602 2.6751 2.6751 2.7073 2.7073 3.0194 3.0194 3.3880 3.3880 3.4296 3.4296 3.7003 3.7003 3.8650 3.8650 3.9292 3.9292 4.1412 4.1412 4.2319 4.2319 4.2655 4.2655 4.2963 4.2963 4.5682 4.5682 4.5832 4.5832 4.6190 4.6190 4.6985 4.6985 4.7595 4.7595 4.7717 4.7717 5.0348 5.0348 5.4763 5.4763 5.7004 5.7004 5.8919 5.8919 6.2586 6.2586 6.9064 6.9064 6.9904 6.9904 k = 0.0000 0.0000 0.0285 ( 5111 PWs) bands (ev): -13.6496 -13.6496 -13.4313 -13.4313 -12.8769 -12.8769 -12.7668 -12.7668 -12.1947 -12.1947 -11.9603 -11.9603 -11.3741 -11.3741 -11.3093 -11.3093 -0.8479 -0.8479 -0.5126 -0.5126 -0.1463 -0.1463 -0.1350 -0.1350 0.5500 0.5500 0.5615 0.5615 0.8951 0.8951 0.9113 0.9113 0.9352 0.9352 0.9551 0.9551 1.2866 1.2866 1.4663 1.4663 1.7624 1.7624 2.1130 2.1130 2.5612 2.5612 2.6726 2.6726 2.6915 2.6915 3.0306 3.0306 3.3922 3.3922 3.4115 3.4115 3.6858 3.6858 3.8847 3.8847 3.9189 3.9189 4.1458 4.1458 4.2370 4.2370 4.2695 4.2695 4.2959 4.2959 4.5757 4.5757 4.5805 4.5805 4.6145 4.6145 4.6970 4.6970 4.7552 4.7552 4.7699 4.7699 5.0310 5.0310 5.4787 5.4787 5.6974 5.6974 5.8954 5.8954 6.2491 6.2491 6.9210 6.9210 6.9935 6.9935 k = 0.0000 0.0000 0.0379 ( 5115 PWs) bands (ev): -13.6467 -13.6467 -13.4364 -13.4364 -12.8736 -12.8736 -12.7678 -12.7678 -12.1911 -12.1911 -11.9648 -11.9648 -11.3725 -11.3725 -11.3102 -11.3102 -0.8403 -0.8403 -0.5147 -0.5147 -0.1467 -0.1467 -0.1355 -0.1355 0.5410 0.5410 0.5494 0.5494 0.8957 0.8957 0.9120 0.9120 0.9345 0.9345 0.9544 0.9544 1.2899 1.2899 1.4591 1.4591 1.7783 1.7783 2.1440 2.1440 2.5627 2.5627 2.6647 2.6647 2.6754 2.6754 3.0450 3.0450 3.3840 3.3840 3.4017 3.4017 3.6680 3.6680 3.8970 3.8970 3.9167 3.9167 4.1519 4.1519 4.2439 4.2439 4.2752 4.2752 4.2956 4.2956 4.5722 4.5722 4.5899 4.5899 4.6087 4.6087 4.6946 4.6946 4.7499 4.7499 4.7673 4.7673 5.0255 5.0255 5.4820 5.4820 5.6932 5.6932 5.9001 5.9001 6.2366 6.2366 6.9401 6.9401 6.9981 6.9981 k = 0.0000 0.0000 0.0474 ( 5105 PWs) bands (ev): -13.6429 -13.6429 -13.4428 -13.4428 -12.8694 -12.8694 -12.7692 -12.7692 -12.1864 -12.1864 -11.9705 -11.9705 -11.3706 -11.3706 -11.3112 -11.3112 -0.8307 -0.8307 -0.5177 -0.5177 -0.1472 -0.1472 -0.1361 -0.1361 0.5302 0.5302 0.5350 0.5350 0.8964 0.8964 0.9129 0.9129 0.9336 0.9336 0.9536 0.9536 1.2938 1.2938 1.4510 1.4510 1.7984 1.7984 2.1818 2.1818 2.5645 2.5645 2.6415 2.6415 2.6695 2.6695 3.0621 3.0621 3.3550 3.3550 3.4095 3.4095 3.6477 3.6477 3.8822 3.8822 3.9416 3.9416 4.1589 4.1589 4.2524 4.2524 4.2819 4.2819 4.2961 4.2961 4.5648 4.5648 4.5959 4.5959 4.6091 4.6091 4.6908 4.6908 4.7443 4.7443 4.7642 4.7642 5.0186 5.0186 5.4862 5.4862 5.6880 5.6880 5.9061 5.9061 6.2218 6.2218 6.9622 6.9622 7.0051 7.0051 k = 0.0000 0.0000 0.0569 ( 5097 PWs) bands (ev): -13.6383 -13.6383 -13.4503 -13.4503 -12.8646 -12.8646 -12.7709 -12.7709 -12.1808 -12.1808 -11.9773 -11.9773 -11.3683 -11.3683 -11.3125 -11.3125 -0.8192 -0.8192 -0.5217 -0.5217 -0.1477 -0.1477 -0.1369 -0.1369 0.5180 0.5180 0.5191 0.5191 0.8973 0.8973 0.9140 0.9140 0.9326 0.9326 0.9526 0.9526 1.2982 1.2982 1.4421 1.4421 1.8223 1.8223 2.2253 2.2253 2.5667 2.5667 2.6126 2.6126 2.6654 2.6654 3.0813 3.0813 3.3208 3.3208 3.4199 3.4199 3.6252 3.6252 3.8621 3.8621 3.9713 3.9713 4.1665 4.1665 4.2624 4.2624 4.2867 4.2867 4.3001 4.3001 4.5558 4.5558 4.5866 4.5866 4.6249 4.6249 4.6849 4.6849 4.7391 4.7391 4.7607 4.7607 5.0101 5.0101 5.4913 5.4913 5.6816 5.6816 5.9133 5.9133 6.2056 6.2056 6.9839 6.9839 7.0168 7.0168 k = 0.0000 0.0000 0.0664 ( 5101 PWs) bands (ev): -13.6330 -13.6330 -13.4588 -13.4588 -12.8593 -12.8593 -12.7729 -12.7729 -12.1742 -12.1742 -11.9851 -11.9851 -11.3658 -11.3658 -11.3140 -11.3140 -0.8058 -0.8058 -0.5268 -0.5268 -0.1484 -0.1484 -0.1378 -0.1378 0.5024 0.5024 0.5048 0.5048 0.8984 0.8984 0.9152 0.9152 0.9314 0.9314 0.9514 0.9514 1.3029 1.3029 1.4329 1.4329 1.8499 1.8499 2.2734 2.2734 2.5685 2.5685 2.5813 2.5813 2.6611 2.6611 3.1022 3.1022 3.2827 3.2827 3.4322 3.4322 3.6008 3.6008 3.8397 3.8397 4.0027 4.0027 4.1742 4.1742 4.2737 4.2737 4.2874 4.2874 4.3101 4.3101 4.5453 4.5453 4.5737 4.5737 4.6437 4.6437 4.6764 4.6764 4.7350 4.7350 4.7571 4.7571 5.0000 5.0000 5.4973 5.4973 5.6742 5.6742 5.9216 5.9216 6.1882 6.1882 6.9999 6.9999 7.0378 7.0378 k = 0.0000 0.0000 0.0759 ( 5105 PWs) bands (ev): -13.6268 -13.6268 -13.4682 -13.4682 -12.8536 -12.8536 -12.7753 -12.7753 -12.1668 -12.1668 -11.9939 -11.9939 -11.3629 -11.3629 -11.3158 -11.3158 -0.7909 -0.7909 -0.5332 -0.5332 -0.1490 -0.1490 -0.1389 -0.1389 0.4858 0.4858 0.4912 0.4912 0.8996 0.8996 0.9164 0.9164 0.9302 0.9302 0.9500 0.9500 1.3079 1.3079 1.4236 1.4236 1.8807 1.8807 2.3247 2.3247 2.5456 2.5456 2.5732 2.5732 2.6563 2.6563 3.1245 3.1245 3.2411 3.2411 3.4461 3.4461 3.5747 3.5747 3.8157 3.8157 4.0350 4.0350 4.1817 4.1817 4.2860 4.2860 4.2864 4.2864 4.3237 4.3237 4.5335 4.5335 4.5584 4.5584 4.6617 4.6617 4.6673 4.6673 4.7323 4.7323 4.7535 4.7535 4.9886 4.9886 5.5041 5.5041 5.6660 5.6660 5.9309 5.9309 6.1702 6.1702 7.0109 7.0109 7.0667 7.0667 k = 0.0000 0.0000 0.0854 ( 5107 PWs) bands (ev): -13.6200 -13.6200 -13.4781 -13.4781 -12.8476 -12.8476 -12.7779 -12.7779 -12.1585 -12.1585 -12.0034 -12.0034 -11.3599 -11.3599 -11.3178 -11.3178 -0.7745 -0.7745 -0.5410 -0.5410 -0.1496 -0.1496 -0.1400 -0.1400 0.4698 0.4698 0.4776 0.4776 0.9009 0.9009 0.9176 0.9176 0.9290 0.9290 0.9485 0.9485 1.3132 1.3132 1.4143 1.4143 1.9145 1.9145 2.3771 2.3771 2.5117 2.5117 2.5764 2.5764 2.6512 2.6512 3.1482 3.1482 3.1964 3.1964 3.4618 3.4618 3.5474 3.5474 3.7906 3.7906 4.0676 4.0676 4.1889 4.1889 4.2848 4.2848 4.2996 4.2996 4.3396 4.3396 4.5203 4.5203 4.5411 4.5411 4.6504 4.6504 4.6856 4.6856 4.7311 4.7311 4.7502 4.7502 4.9757 4.9757 5.5117 5.5117 5.6570 5.6570 5.9412 5.9412 6.1520 6.1520 7.0203 7.0203 7.0994 7.0994 k = 0.0000 0.0000 0.0949 ( 5111 PWs) bands (ev): -13.6125 -13.6125 -13.4887 -13.4887 -12.8415 -12.8415 -12.7810 -12.7810 -12.1494 -12.1494 -12.0137 -12.0137 -11.3567 -11.3567 -11.3199 -11.3199 -0.7569 -0.7569 -0.5504 -0.5504 -0.1501 -0.1501 -0.1412 -0.1412 0.4552 0.4552 0.4644 0.4644 0.9023 0.9023 0.9186 0.9186 0.9281 0.9281 0.9468 0.9468 1.3186 1.3186 1.4051 1.4051 1.9507 1.9507 2.4193 2.4193 2.4882 2.4882 2.5802 2.5802 2.6459 2.6459 3.1487 3.1487 3.1730 3.1730 3.4789 3.4789 3.5190 3.5190 3.7648 3.7648 4.1000 4.1000 4.1957 4.1957 4.2833 4.2833 4.3138 4.3138 4.3569 4.3569 4.5059 4.5059 4.5223 4.5223 4.6341 4.6341 4.7053 4.7053 4.7320 4.7320 4.7479 4.7479 4.9614 4.9614 5.5200 5.5200 5.6472 5.6472 5.9523 5.9523 6.1339 6.1339 7.0296 7.0296 7.1334 7.1334 k = 0.0000 0.0000 0.1043 ( 5095 PWs) bands (ev): -13.6043 -13.6043 -13.4995 -13.4995 -12.8353 -12.8353 -12.7843 -12.7843 -12.1397 -12.1397 -12.0245 -12.0245 -11.3534 -11.3534 -11.3223 -11.3223 -0.7382 -0.7382 -0.5615 -0.5615 -0.1504 -0.1504 -0.1425 -0.1425 0.4424 0.4424 0.4522 0.4522 0.9039 0.9039 0.9190 0.9190 0.9278 0.9278 0.9451 0.9451 1.3243 1.3243 1.3962 1.3962 1.9892 1.9892 2.4104 2.4104 2.5159 2.5159 2.5845 2.5845 2.6403 2.6403 3.0985 3.0985 3.1988 3.1988 3.4890 3.4890 3.4984 3.4984 3.7386 3.7386 4.1313 4.1313 4.2020 4.2020 4.2827 4.2827 4.3287 4.3287 4.3748 4.3748 4.4904 4.4904 4.5032 4.5032 4.6160 4.6160 4.7191 4.7191 4.7362 4.7362 4.7499 4.7499 4.9459 4.9459 5.5290 5.5290 5.6370 5.6370 5.9642 5.9642 6.1161 6.1161 7.0391 7.0391 7.1417 7.1417 k = 0.0000 0.0000 0.1138 ( 5095 PWs) bands (ev): -13.5955 -13.5955 -13.5107 -13.5107 -12.8292 -12.8292 -12.7880 -12.7880 -12.1293 -12.1293 -12.0358 -12.0358 -11.3501 -11.3501 -11.3249 -11.3249 -0.7189 -0.7189 -0.5742 -0.5742 -0.1505 -0.1505 -0.1439 -0.1439 0.4319 0.4319 0.4412 0.4412 0.9055 0.9055 0.9187 0.9187 0.9284 0.9284 0.9432 0.9432 1.3301 1.3301 1.3876 1.3876 2.0294 2.0294 2.3739 2.3739 2.5709 2.5709 2.5893 2.5893 2.6348 2.6348 3.0457 3.0457 3.2256 3.2256 3.4598 3.4598 3.5179 3.5179 3.7122 3.7122 4.1601 4.1601 4.2079 4.2079 4.2839 4.2839 4.3439 4.3439 4.3907 4.3907 4.4751 4.4751 4.4846 4.4846 4.5963 4.5963 4.7239 4.7239 4.7373 4.7373 4.7646 4.7646 4.9291 4.9291 5.5386 5.5386 5.6262 5.6262 5.9767 5.9767 6.0986 6.0986 7.0488 7.0488 7.1321 7.1321 k = 0.0000 0.0000 0.1233 ( 5093 PWs) bands (ev): -13.5861 -13.5861 -13.5219 -13.5219 -12.8231 -12.8231 -12.7921 -12.7921 -12.1184 -12.1184 -12.0475 -12.0475 -11.3467 -11.3467 -11.3276 -11.3276 -0.6991 -0.6991 -0.5886 -0.5886 -0.1504 -0.1504 -0.1452 -0.1452 0.4239 0.4239 0.4318 0.4318 0.9072 0.9072 0.9176 0.9176 0.9296 0.9296 0.9412 0.9412 1.3362 1.3362 1.3793 1.3793 2.0711 2.0711 2.3325 2.3325 2.5939 2.5939 2.6236 2.6236 2.6365 2.6365 2.9908 2.9908 3.2532 3.2532 3.4298 3.4298 3.5391 3.5391 3.6859 3.6859 4.1843 4.1843 4.2131 4.2131 4.2889 4.2889 4.3588 4.3588 4.3992 4.3992 4.4642 4.4642 4.4688 4.4688 4.5755 4.5755 4.7259 4.7259 4.7358 4.7358 4.7855 4.7855 4.9111 4.9111 5.5487 5.5487 5.6151 5.6151 5.9900 5.9900 6.0815 6.0815 7.0589 7.0589 7.1220 7.1220 k = 0.0000 0.0000 0.1328 ( 5093 PWs) bands (ev): -13.5762 -13.5762 -13.5332 -13.5332 -12.8173 -12.8173 -12.7965 -12.7965 -12.1071 -12.1071 -12.0594 -12.0594 -11.3433 -11.3433 -11.3305 -11.3305 -0.6792 -0.6792 -0.6045 -0.6045 -0.1501 -0.1501 -0.1465 -0.1465 0.4186 0.4186 0.4243 0.4243 0.9090 0.9090 0.9162 0.9162 0.9312 0.9312 0.9392 0.9392 1.3426 1.3426 1.3713 1.3713 2.1139 2.1139 2.2894 2.2894 2.5992 2.5992 2.6217 2.6217 2.6936 2.6936 2.9339 2.9339 3.2815 3.2815 3.3997 3.3997 3.5614 3.5614 3.6598 3.6598 4.2018 4.2018 4.2170 4.2170 4.3002 4.3002 4.3696 4.3696 4.3963 4.3963 4.4489 4.4489 4.4728 4.4728 4.5538 4.5538 4.7273 4.7273 4.7339 4.7339 4.8076 4.8076 4.8921 4.8921 5.5592 5.5592 5.6039 5.6039 6.0038 6.0038 6.0650 6.0650 7.0693 7.0693 7.1116 7.1116 k = 0.0000 0.0000 0.1423 ( 5092 PWs) bands (ev): -13.5659 -13.5659 -13.5443 -13.5443 -12.8116 -12.8116 -12.8012 -12.8012 -12.0954 -12.0954 -12.0715 -12.0715 -11.3400 -11.3400 -11.3336 -11.3336 -0.6594 -0.6594 -0.6218 -0.6218 -0.1495 -0.1495 -0.1476 -0.1476 0.4161 0.4161 0.4191 0.4191 0.9109 0.9109 0.9145 0.9145 0.9331 0.9331 0.9372 0.9372 1.3493 1.3493 1.3636 1.3636 2.1574 2.1574 2.2456 2.2456 2.6046 2.6046 2.6161 2.6161 2.7547 2.7547 2.8753 2.8753 3.3104 3.3104 3.3696 3.3696 3.5848 3.5848 3.6342 3.6342 4.2120 4.2120 4.2187 4.2187 4.3182 4.3182 4.3614 4.3614 4.4013 4.4013 4.4321 4.4321 4.4892 4.4892 4.5317 4.5317 4.7287 4.7287 4.7321 4.7321 4.8296 4.8296 4.8720 4.8720 5.5701 5.5701 5.5925 5.5925 6.0183 6.0183 6.0489 6.0489 7.0798 7.0798 7.1011 7.1011 k = 0.0000 0.0000 0.1518 ( 5066 PWs) bands (ev): -13.5553 -13.5553 -13.5553 -13.5553 -12.8063 -12.8063 -12.8063 -12.8063 -12.0835 -12.0835 -12.0835 -12.0835 -11.3367 -11.3367 -11.3367 -11.3367 -0.6402 -0.6402 -0.6402 -0.6402 -0.1486 -0.1486 -0.1486 -0.1486 0.4163 0.4163 0.4163 0.4163 0.9127 0.9127 0.9127 0.9127 0.9352 0.9352 0.9352 0.9352 1.3563 1.3563 1.3563 1.3563 2.2015 2.2015 2.2015 2.2015 2.6103 2.6103 2.6103 2.6103 2.8155 2.8155 2.8155 2.8155 3.3399 3.3399 3.3399 3.3399 3.6092 3.6092 3.6092 3.6092 4.2172 4.2172 4.2172 4.2172 4.3403 4.3403 4.3403 4.3403 4.4159 4.4159 4.4159 4.4159 4.5098 4.5098 4.5098 4.5098 4.7304 4.7304 4.7304 4.7304 4.8512 4.8512 4.8512 4.8512 5.5813 5.5813 5.5813 5.5813 6.0334 6.0334 6.0334 6.0334 7.0905 7.0905 7.0905 7.0905 k = 0.0000 0.0000 0.1518 ( 5066 PWs) bands (ev): -13.5553 -13.5553 -13.5553 -13.5553 -12.8063 -12.8063 -12.8063 -12.8063 -12.0835 -12.0835 -12.0835 -12.0835 -11.3367 -11.3367 -11.3367 -11.3367 -0.6402 -0.6402 -0.6402 -0.6402 -0.1486 -0.1486 -0.1486 -0.1486 0.4163 0.4163 0.4163 0.4163 0.9127 0.9127 0.9127 0.9127 0.9352 0.9352 0.9352 0.9352 1.3563 1.3563 1.3563 1.3563 2.2015 2.2015 2.2015 2.2015 2.6103 2.6103 2.6103 2.6103 2.8155 2.8155 2.8155 2.8155 3.3399 3.3399 3.3399 3.3399 3.6092 3.6092 3.6092 3.6092 4.2172 4.2172 4.2172 4.2172 4.3403 4.3403 4.3403 4.3403 4.4159 4.4159 4.4159 4.4159 4.5098 4.5098 4.5098 4.5098 4.7304 4.7304 4.7304 4.7304 4.8512 4.8512 4.8512 4.8512 5.5813 5.5813 5.5813 5.5813 6.0334 6.0334 6.0334 6.0334 7.0905 7.0905 7.0905 7.0905 k = 0.0096-0.0000 0.1518 ( 5076 PWs) bands (ev): -13.5548 -13.5548 -13.5548 -13.5548 -12.8063 -12.8063 -12.8060 -12.8060 -12.0833 -12.0833 -12.0832 -12.0832 -11.3367 -11.3367 -11.3367 -11.3367 -0.6396 -0.6396 -0.6393 -0.6393 -0.1482 -0.1482 -0.1481 -0.1481 0.4167 0.4167 0.4168 0.4168 0.9107 0.9107 0.9109 0.9109 0.9344 0.9344 0.9347 0.9347 1.3582 1.3582 1.3583 1.3583 2.2014 2.2014 2.2020 2.2020 2.6062 2.6062 2.6082 2.6082 2.8154 2.8154 2.8155 2.8155 3.3386 3.3386 3.3396 3.3396 3.6046 3.6046 3.6052 3.6052 4.2192 4.2192 4.2195 4.2195 4.3390 4.3390 4.3419 4.3419 4.4145 4.4145 4.4163 4.4163 4.5094 4.5094 4.5109 4.5109 4.7299 4.7299 4.7323 4.7323 4.8517 4.8517 4.8539 4.8539 5.5805 5.5805 5.5820 5.5820 6.0336 6.0336 6.0343 6.0343 7.0886 7.0886 7.0892 7.0892 k = 0.0192-0.0000 0.1518 ( 5096 PWs) bands (ev): -13.5534 -13.5534 -13.5533 -13.5533 -12.8060 -12.8060 -12.8054 -12.8054 -12.0827 -12.0827 -12.0826 -12.0826 -11.3368 -11.3368 -11.3368 -11.3368 -0.6374 -0.6374 -0.6368 -0.6368 -0.1469 -0.1469 -0.1467 -0.1467 0.4179 0.4179 0.4183 0.4183 0.9048 0.9048 0.9052 0.9052 0.9324 0.9324 0.9333 0.9333 1.3638 1.3638 1.3640 1.3640 2.2018 2.2018 2.2030 2.2030 2.5962 2.5962 2.6001 2.6001 2.8151 2.8151 2.8152 2.8152 3.3359 3.3359 3.3379 3.3379 3.5917 3.5917 3.5929 3.5929 4.2251 4.2251 4.2256 4.2256 4.3381 4.3381 4.3436 4.3436 4.4123 4.4123 4.4160 4.4160 4.5096 4.5096 4.5127 4.5127 4.7310 4.7310 4.7357 4.7357 4.8554 4.8554 4.8596 4.8596 5.5795 5.5795 5.5825 5.5825 6.0350 6.0350 6.0363 6.0363 7.0836 7.0836 7.0847 7.0847 k = 0.0288-0.0000 0.1518 ( 5104 PWs) bands (ev): -13.5511 -13.5511 -13.5509 -13.5509 -12.8055 -12.8055 -12.8046 -12.8046 -12.0816 -12.0816 -12.0815 -12.0815 -11.3369 -11.3369 -11.3369 -11.3369 -0.6337 -0.6337 -0.6328 -0.6328 -0.1446 -0.1446 -0.1443 -0.1443 0.4201 0.4201 0.4206 0.4206 0.8954 0.8954 0.8959 0.8959 0.9297 0.9297 0.9312 0.9312 1.3728 1.3728 1.3731 1.3731 2.2025 2.2025 2.2043 2.2043 2.5805 2.5805 2.5863 2.5863 2.8145 2.8145 2.8146 2.8146 3.3316 3.3316 3.3346 3.3346 3.5714 3.5714 3.5731 3.5731 4.2341 4.2341 4.2348 4.2348 4.3376 4.3376 4.3456 4.3456 4.4098 4.4098 4.4152 4.4152 4.5104 4.5104 4.5149 4.5149 4.7339 4.7339 4.7405 4.7405 4.8622 4.8622 4.8682 4.8682 5.5784 5.5784 5.5830 5.5830 6.0374 6.0374 6.0394 6.0394 7.0756 7.0756 7.0773 7.0773 k = 0.0385-0.0000 0.1518 ( 5096 PWs) bands (ev): -13.5478 -13.5478 -13.5476 -13.5476 -12.8046 -12.8046 -12.8034 -12.8034 -12.0801 -12.0801 -12.0800 -12.0800 -11.3370 -11.3370 -11.3370 -11.3370 -0.6285 -0.6285 -0.6273 -0.6273 -0.1415 -0.1415 -0.1410 -0.1410 0.4231 0.4231 0.4239 0.4239 0.8827 0.8827 0.8832 0.8832 0.9263 0.9263 0.9285 0.9285 1.3846 1.3846 1.3850 1.3850 2.2035 2.2035 2.2060 2.2060 2.5599 2.5599 2.5674 2.5674 2.8133 2.8133 2.8135 2.8135 3.3258 3.3258 3.3296 3.3296 3.5449 3.5449 3.5469 3.5469 4.2449 4.2449 4.2457 4.2457 4.3376 4.3376 4.3478 4.3478 4.4076 4.4076 4.4147 4.4147 4.5115 4.5115 4.5174 4.5174 4.7387 4.7387 4.7468 4.7468 4.8717 4.8717 4.8793 4.8793 5.5772 5.5772 5.5833 5.5833 6.0411 6.0411 6.0437 6.0437 7.0646 7.0646 7.0671 7.0671 k = 0.0481-0.0000 0.1518 ( 5090 PWs) bands (ev): -13.5436 -13.5436 -13.5434 -13.5434 -12.8035 -12.8035 -12.8020 -12.8020 -12.0782 -12.0782 -12.0781 -12.0781 -11.3372 -11.3372 -11.3372 -11.3372 -0.6218 -0.6218 -0.6203 -0.6203 -0.1374 -0.1374 -0.1368 -0.1368 0.4269 0.4269 0.4279 0.4279 0.8674 0.8674 0.8679 0.8679 0.9223 0.9223 0.9252 0.9252 1.3985 1.3985 1.3990 1.3990 2.2046 2.2046 2.2079 2.2079 2.5349 2.5349 2.5440 2.5440 2.8111 2.8111 2.8117 2.8117 3.3183 3.3183 3.3230 3.3230 3.5132 3.5132 3.5155 3.5155 4.2556 4.2556 4.2561 4.2561 4.3384 4.3384 4.3509 4.3509 4.4064 4.4064 4.4146 4.4146 4.5127 4.5127 4.5201 4.5201 4.7455 4.7455 4.7546 4.7546 4.8836 4.8836 4.8924 4.8924 5.5759 5.5759 5.5835 5.5835 6.0458 6.0458 6.0490 6.0490 7.0508 7.0508 7.0542 7.0542 k = 0.0577-0.0000 0.1518 ( 5096 PWs) bands (ev): -13.5384 -13.5384 -13.5382 -13.5382 -12.8021 -12.8021 -12.8004 -12.8004 -12.0759 -12.0759 -12.0757 -12.0757 -11.3375 -11.3375 -11.3374 -11.3374 -0.6137 -0.6137 -0.6118 -0.6118 -0.1325 -0.1325 -0.1318 -0.1318 0.4315 0.4315 0.4327 0.4327 0.8501 0.8501 0.8506 0.8506 0.9178 0.9178 0.9213 0.9213 1.4139 1.4139 1.4144 1.4144 2.2053 2.2053 2.2096 2.2096 2.5064 2.5064 2.5171 2.5171 2.8078 2.8078 2.8089 2.8089 3.3091 3.3091 3.3145 3.3145 3.4777 3.4777 3.4802 3.4802 4.2639 4.2639 4.2639 4.2639 4.3405 4.3405 4.3556 4.3556 4.4076 4.4076 4.4159 4.4159 4.5139 4.5139 4.5228 4.5228 4.7542 4.7542 4.7638 4.7638 4.8974 4.8974 4.9072 4.9072 5.5745 5.5745 5.5836 5.5836 6.0514 6.0514 6.0553 6.0553 7.0343 7.0343 7.0387 7.0387 k = 0.0673-0.0000 0.1518 ( 5104 PWs) bands (ev): -13.5324 -13.5324 -13.5321 -13.5321 -12.8005 -12.8005 -12.7985 -12.7985 -12.0731 -12.0731 -12.0729 -12.0729 -11.3378 -11.3378 -11.3377 -11.3377 -0.6041 -0.6041 -0.6020 -0.6020 -0.1268 -0.1268 -0.1260 -0.1260 0.4367 0.4367 0.4381 0.4381 0.8313 0.8313 0.8318 0.8318 0.9127 0.9127 0.9170 0.9170 1.4302 1.4302 1.4307 1.4307 2.2053 2.2053 2.2107 2.2107 2.4754 2.4754 2.4877 2.4877 2.8031 2.8031 2.8047 2.8047 3.2980 3.2980 3.3040 3.3040 3.4396 3.4396 3.4422 3.4422 4.2669 4.2669 4.2680 4.2680 4.3437 4.3437 4.3621 4.3621 4.4126 4.4126 4.4197 4.4197 4.5149 4.5149 4.5255 4.5255 4.7646 4.7646 4.7743 4.7743 4.9128 4.9128 4.9231 4.9231 5.5729 5.5729 5.5835 5.5835 6.0581 6.0581 6.0625 6.0625 7.0155 7.0155 7.0210 7.0210 k = 0.0769-0.0000 0.1518 ( 5088 PWs) bands (ev): -13.5254 -13.5254 -13.5251 -13.5251 -12.7987 -12.7987 -12.7963 -12.7963 -12.0700 -12.0700 -12.0697 -12.0697 -11.3381 -11.3381 -11.3380 -11.3380 -0.5932 -0.5932 -0.5907 -0.5907 -0.1203 -0.1203 -0.1194 -0.1194 0.4424 0.4424 0.4440 0.4440 0.8117 0.8117 0.8122 0.8122 0.9072 0.9072 0.9122 0.9122 1.4467 1.4467 1.4473 1.4473 2.2039 2.2039 2.2105 2.2105 2.4430 2.4430 2.4571 2.4571 2.7967 2.7967 2.7990 2.7990 3.2851 3.2851 3.2917 3.2917 3.4001 3.4001 3.4028 3.4028 4.2648 4.2648 4.2673 4.2673 4.3467 4.3467 4.3688 4.3688 4.4227 4.4227 4.4280 4.4280 4.5158 4.5158 4.5283 4.5283 4.7766 4.7766 4.7859 4.7859 4.9293 4.9293 4.9400 4.9400 5.5712 5.5712 5.5833 5.5833 6.0657 6.0657 6.0707 6.0707 6.9945 6.9945 7.0013 7.0013 k = 0.0865-0.0000 0.1518 ( 5086 PWs) bands (ev): -13.5176 -13.5176 -13.5172 -13.5172 -12.7966 -12.7966 -12.7940 -12.7940 -12.0663 -12.0663 -12.0660 -12.0660 -11.3385 -11.3385 -11.3385 -11.3385 -0.5809 -0.5809 -0.5781 -0.5781 -0.1131 -0.1131 -0.1120 -0.1120 0.4484 0.4484 0.4503 0.4503 0.7917 0.7917 0.7923 0.7923 0.9013 0.9013 0.9070 0.9070 1.4631 1.4631 1.4636 1.4636 2.1999 2.1999 2.2079 2.2079 2.4111 2.4111 2.4270 2.4270 2.7886 2.7886 2.7914 2.7914 3.2702 3.2702 3.2773 3.2773 3.3602 3.3602 3.3630 3.3630 4.2584 4.2584 4.2623 4.2623 4.3481 4.3481 4.3732 4.3732 4.4378 4.4378 4.4422 4.4422 4.5164 4.5164 4.5313 4.5313 4.7899 4.7899 4.7983 4.7983 4.9465 4.9465 4.9573 4.9573 5.5693 5.5693 5.5828 5.5828 6.0740 6.0740 6.0796 6.0796 6.9717 6.9717 6.9799 6.9799 k = 0.0962-0.0000 0.1518 ( 5090 PWs) bands (ev): -13.5089 -13.5089 -13.5085 -13.5085 -12.7943 -12.7943 -12.7914 -12.7914 -12.0623 -12.0623 -12.0620 -12.0620 -11.3390 -11.3390 -11.3389 -11.3389 -0.5673 -0.5673 -0.5643 -0.5643 -0.1052 -0.1052 -0.1040 -0.1040 0.4546 0.4546 0.4566 0.4566 0.7717 0.7717 0.7724 0.7724 0.8951 0.8951 0.9015 0.9015 1.4787 1.4787 1.4792 1.4792 2.1917 2.1917 2.2009 2.2009 2.3818 2.3818 2.3993 2.3993 2.7784 2.7784 2.7817 2.7817 3.2531 3.2531 3.2606 3.2606 3.3211 3.3211 3.3240 3.3240 4.2489 4.2489 4.2542 4.2542 4.3478 4.3478 4.3746 4.3746 4.4560 4.4560 4.4616 4.4616 4.5170 4.5170 4.5351 4.5351 4.8040 4.8040 4.8113 4.8113 4.9642 4.9642 4.9747 4.9747 5.5673 5.5673 5.5822 5.5822 6.0830 6.0830 6.0892 6.0892 6.9471 6.9471 6.9568 6.9568 k = 0.1058-0.0000 0.1518 ( 5098 PWs) bands (ev): -13.4994 -13.4994 -13.4990 -13.4990 -12.7919 -12.7919 -12.7887 -12.7887 -12.0578 -12.0578 -12.0574 -12.0574 -11.3396 -11.3396 -11.3395 -11.3395 -0.5526 -0.5526 -0.5492 -0.5492 -0.0968 -0.0968 -0.0954 -0.0954 0.4605 0.4605 0.4628 0.4628 0.7524 0.7524 0.7531 0.7531 0.8886 0.8886 0.8957 0.8957 1.4932 1.4932 1.4937 1.4937 2.1776 2.1776 2.1872 2.1872 2.3580 2.3580 2.3763 2.3763 2.7662 2.7662 2.7698 2.7698 3.2335 3.2335 3.2414 3.2414 3.2840 3.2840 3.2868 3.2868 4.2372 4.2372 4.2439 4.2439 4.3460 4.3460 4.3737 4.3737 4.4749 4.4749 4.4840 4.4840 4.5179 4.5179 4.5407 4.5407 4.8188 4.8188 4.8246 4.8246 4.9821 4.9821 4.9921 4.9921 5.5651 5.5651 5.5814 5.5814 6.0925 6.0925 6.0993 6.0993 6.9212 6.9212 6.9323 6.9323 k = 0.1154-0.0000 0.1518 ( 5094 PWs) bands (ev): -13.4890 -13.4890 -13.4886 -13.4886 -12.7893 -12.7893 -12.7858 -12.7858 -12.0529 -12.0529 -12.0525 -12.0525 -11.3402 -11.3402 -11.3402 -11.3402 -0.5367 -0.5367 -0.5331 -0.5331 -0.0878 -0.0878 -0.0862 -0.0862 0.4659 0.4659 0.4682 0.4682 0.7343 0.7343 0.7350 0.7350 0.8820 0.8820 0.8899 0.8899 1.5062 1.5062 1.5065 1.5065 2.1563 2.1563 2.1652 2.1652 2.3419 2.3419 2.3598 2.3598 2.7518 2.7518 2.7558 2.7558 3.2110 3.2110 3.2187 3.2187 3.2503 3.2503 3.2528 3.2528 4.2240 4.2240 4.2320 4.2320 4.3432 4.3432 4.3713 4.3713 4.4913 4.4913 4.5043 4.5043 4.5229 4.5229 4.5503 4.5503 4.8340 4.8340 4.8381 4.8381 4.9999 4.9999 5.0090 5.0090 5.5629 5.5629 5.5805 5.5805 6.1024 6.1024 6.1098 6.1098 6.8942 6.8942 6.9069 6.9069 k = 0.1250-0.0000 0.1518 ( 5094 PWs) bands (ev): -13.4779 -13.4779 -13.4774 -13.4774 -12.7865 -12.7865 -12.7828 -12.7828 -12.0475 -12.0475 -12.0471 -12.0471 -11.3410 -11.3410 -11.3409 -11.3409 -0.5198 -0.5198 -0.5159 -0.5159 -0.0784 -0.0784 -0.0766 -0.0766 0.4700 0.4700 0.4725 0.4725 0.7179 0.7179 0.7185 0.7185 0.8754 0.8754 0.8840 0.8840 1.5171 1.5171 1.5174 1.5174 2.1281 2.1281 2.1352 2.1352 2.3333 2.3333 2.3499 2.3499 2.7356 2.7356 2.7397 2.7397 3.1855 3.1855 3.1921 3.1921 3.2210 3.2210 3.2223 3.2223 4.2097 4.2097 4.2189 4.2189 4.3396 4.3396 4.3679 4.3679 4.5023 4.5023 4.5107 4.5107 4.5427 4.5427 4.5658 4.5658 4.8491 4.8491 4.8513 4.8513 5.0174 5.0174 5.0254 5.0254 5.5605 5.5605 5.5793 5.5793 6.1126 6.1126 6.1206 6.1206 6.8662 6.8662 6.8805 6.8805 k = 0.1346-0.0000 0.1518 ( 5098 PWs) bands (ev): -13.4660 -13.4660 -13.4655 -13.4655 -12.7836 -12.7836 -12.7797 -12.7797 -12.0417 -12.0417 -12.0413 -12.0413 -11.3419 -11.3419 -11.3418 -11.3418 -0.5020 -0.5020 -0.4978 -0.4978 -0.0686 -0.0686 -0.0667 -0.0667 0.4725 0.4725 0.4749 0.4749 0.7038 0.7038 0.7042 0.7042 0.8688 0.8688 0.8783 0.8783 1.5258 1.5258 1.5259 1.5259 2.0944 2.0944 2.0994 2.0994 2.3306 2.3306 2.3454 2.3454 2.7179 2.7179 2.7220 2.7220 3.1581 3.1581 3.1633 3.1633 3.1947 3.1947 3.1947 3.1947 4.1945 4.1945 4.2048 4.2048 4.3354 4.3354 4.3638 4.3638 4.5081 4.5081 4.5109 4.5109 4.5691 4.5691 4.5866 4.5866 4.8641 4.8641 4.8643 4.8643 5.0345 5.0345 5.0411 5.0411 5.5580 5.5580 5.5780 5.5780 6.1229 6.1229 6.1315 6.1315 6.8377 6.8377 6.8535 6.8535 k = 0.1442-0.0000 0.1518 ( 5104 PWs) bands (ev): -13.4533 -13.4533 -13.4529 -13.4529 -12.7807 -12.7807 -12.7765 -12.7765 -12.0355 -12.0355 -12.0351 -12.0351 -11.3429 -11.3429 -11.3428 -11.3428 -0.4833 -0.4833 -0.4788 -0.4788 -0.0586 -0.0586 -0.0564 -0.0564 0.4725 0.4725 0.4747 0.4747 0.6926 0.6926 0.6928 0.6928 0.8626 0.8626 0.8729 0.8729 1.5318 1.5318 1.5318 1.5318 2.0572 2.0572 2.0601 2.0601 2.3316 2.3316 2.3449 2.3449 2.6994 2.6994 2.7033 2.7033 3.1303 3.1303 3.1345 3.1345 3.1684 3.1684 3.1693 3.1693 4.1786 4.1786 4.1899 4.1899 4.3307 4.3307 4.3591 4.3591 4.5099 4.5099 4.5106 4.5106 4.5966 4.5966 4.6103 4.6103 4.8766 4.8766 4.8786 4.8786 5.0511 5.0511 5.0559 5.0559 5.5554 5.5554 5.5766 5.5766 6.1330 6.1330 6.1423 6.1423 6.8087 6.8087 6.8259 6.8259 k = 0.1538-0.0000 0.1518 ( 5096 PWs) bands (ev): -13.4400 -13.4400 -13.4395 -13.4395 -12.7776 -12.7776 -12.7732 -12.7732 -12.0289 -12.0289 -12.0284 -12.0284 -11.3440 -11.3440 -11.3439 -11.3439 -0.4639 -0.4639 -0.4591 -0.4591 -0.0483 -0.0483 -0.0460 -0.0460 0.4696 0.4696 0.4714 0.4714 0.6844 0.6844 0.6847 0.6847 0.8569 0.8569 0.8680 0.8680 1.5348 1.5348 1.5349 1.5349 2.0180 2.0180 2.0191 2.0191 2.3349 2.3349 2.3469 2.3469 2.6806 2.6806 2.6843 2.6843 3.1031 3.1031 3.1066 3.1066 3.1425 3.1425 3.1438 3.1438 4.1623 4.1623 4.1744 4.1744 4.3257 4.3257 4.3541 4.3541 4.5085 4.5085 4.5113 4.5113 4.6242 4.6242 4.6353 4.6353 4.8882 4.8882 4.8924 4.8924 5.0671 5.0671 5.0699 5.0699 5.5528 5.5528 5.5750 5.5750 6.1429 6.1429 6.1528 6.1528 6.7795 6.7795 6.7981 6.7981 k = 0.1635-0.0000 0.1518 ( 5096 PWs) bands (ev): -13.4260 -13.4260 -13.4255 -13.4255 -12.7745 -12.7745 -12.7699 -12.7699 -12.0218 -12.0218 -12.0213 -12.0213 -11.3453 -11.3453 -11.3452 -11.3452 -0.4438 -0.4438 -0.4388 -0.4388 -0.0380 -0.0380 -0.0355 -0.0355 0.4634 0.4634 0.4647 0.4647 0.6791 0.6791 0.6799 0.6799 0.8521 0.8521 0.8639 0.8639 1.5347 1.5347 1.5350 1.5350 1.9776 1.9776 1.9779 1.9779 2.3396 2.3396 2.3506 2.3506 2.6626 2.6626 2.6658 2.6658 3.0767 3.0767 3.0798 3.0798 3.1162 3.1162 3.1176 3.1176 4.1456 4.1456 4.1583 4.1583 4.3203 4.3203 4.3488 4.3488 4.5069 4.5069 4.5109 4.5109 4.6516 4.6516 4.6605 4.6605 4.8989 4.8989 4.9053 4.9053 5.0824 5.0824 5.0830 5.0830 5.5502 5.5502 5.5733 5.5733 6.1522 6.1522 6.1629 6.1629 6.7504 6.7504 6.7702 6.7702 k = 0.1731-0.0000 0.1518 ( 5106 PWs) bands (ev): -13.4113 -13.4113 -13.4109 -13.4109 -12.7714 -12.7714 -12.7666 -12.7666 -12.0143 -12.0143 -12.0137 -12.0137 -11.3467 -11.3467 -11.3466 -11.3466 -0.4233 -0.4233 -0.4181 -0.4181 -0.0277 -0.0277 -0.0250 -0.0250 0.4542 0.4542 0.4549 0.4549 0.6762 0.6762 0.6776 0.6776 0.8487 0.8487 0.8610 0.8610 1.5316 1.5316 1.5322 1.5322 1.9363 1.9363 1.9379 1.9379 2.3451 2.3451 2.3553 2.3553 2.6459 2.6459 2.6487 2.6487 3.0508 3.0508 3.0536 3.0536 3.0896 3.0896 3.0910 3.0910 4.1284 4.1284 4.1417 4.1417 4.3147 4.3147 4.3433 4.3433 4.5050 4.5050 4.5097 4.5097 4.6783 4.6783 4.6854 4.6854 4.9084 4.9084 4.9172 4.9172 5.0951 5.0951 5.0971 5.0971 5.5476 5.5476 5.5716 5.5716 6.1609 6.1609 6.1723 6.1723 6.7214 6.7214 6.7422 6.7422 k = 0.1827-0.0000 0.1518 ( 5102 PWs) bands (ev): -13.3961 -13.3961 -13.3956 -13.3956 -12.7683 -12.7683 -12.7633 -12.7633 -12.0063 -12.0063 -12.0058 -12.0058 -11.3484 -11.3484 -11.3482 -11.3482 -0.4024 -0.4024 -0.3971 -0.3971 -0.0176 -0.0176 -0.0147 -0.0147 0.4424 0.4424 0.4424 0.4424 0.6747 0.6747 0.6764 0.6764 0.8471 0.8471 0.8599 0.8599 1.5257 1.5257 1.5264 1.5264 1.8959 1.8959 1.8986 1.8986 2.3511 2.3511 2.3605 2.3605 2.6315 2.6315 2.6337 2.6337 3.0250 3.0250 3.0276 3.0276 3.0628 3.0628 3.0640 3.0640 4.1110 4.1110 4.1246 4.1246 4.3090 4.3090 4.3376 4.3376 4.5030 4.5030 4.5080 4.5080 4.7043 4.7043 4.7096 4.7096 4.9168 4.9168 4.9279 4.9279 5.1063 5.1063 5.1111 5.1111 5.5450 5.5450 5.5698 5.5698 6.1687 6.1687 6.1810 6.1810 6.6929 6.6929 6.7144 6.7144 k = 0.1923-0.0000 0.1518 ( 5088 PWs) bands (ev): -13.3803 -13.3803 -13.3799 -13.3799 -12.7653 -12.7653 -12.7601 -12.7601 -11.9980 -11.9980 -11.9974 -11.9974 -11.3502 -11.3502 -11.3500 -11.3500 -0.3813 -0.3813 -0.3758 -0.3758 -0.0078 -0.0078 -0.0047 -0.0047 0.4279 0.4279 0.4287 0.4287 0.6732 0.6732 0.6750 0.6750 0.8483 0.8483 0.8611 0.8611 1.5173 1.5173 1.5181 1.5181 1.8567 1.8567 1.8605 1.8605 2.3572 2.3572 2.3660 2.3660 2.6196 2.6196 2.6215 2.6215 2.9988 2.9988 3.0011 3.0011 3.0360 3.0360 3.0371 3.0371 4.0932 4.0932 4.1071 4.1071 4.3031 4.3031 4.3317 4.3317 4.5009 4.5009 4.5059 4.5059 4.7293 4.7293 4.7329 4.7329 4.9239 4.9239 4.9372 4.9372 5.1167 5.1167 5.1245 5.1245 5.5425 5.5425 5.5680 5.5680 6.1756 6.1756 6.1886 6.1886 6.6651 6.6651 6.6869 6.6869 k = 0.2019-0.0000 0.1518 ( 5078 PWs) bands (ev): -13.3640 -13.3640 -13.3636 -13.3636 -12.7623 -12.7623 -12.7569 -12.7569 -11.9892 -11.9892 -11.9886 -11.9886 -11.3522 -11.3522 -11.3520 -11.3520 -0.3602 -0.3602 -0.3547 -0.3547 0.0015 0.0015 0.0048 0.0048 0.4121 0.4121 0.4136 0.4136 0.6703 0.6703 0.6718 0.6718 0.8528 0.8528 0.8653 0.8653 1.5068 1.5068 1.5077 1.5077 1.8193 1.8193 1.8240 1.8240 2.3634 2.3634 2.3715 2.3715 2.6108 2.6108 2.6122 2.6122 2.9716 2.9716 2.9737 2.9737 3.0095 3.0095 3.0104 3.0104 4.0751 4.0751 4.0891 4.0891 4.2971 4.2971 4.3258 4.3258 4.4988 4.4988 4.5035 4.5035 4.7533 4.7533 4.7550 4.7550 4.9296 4.9296 4.9451 4.9451 5.1262 5.1262 5.1373 5.1373 5.5402 5.5402 5.5662 5.5662 6.1813 6.1813 6.1952 6.1952 6.6379 6.6379 6.6599 6.6599 k = 0.2115-0.0000 0.1518 ( 5074 PWs) bands (ev): -13.3471 -13.3471 -13.3468 -13.3468 -12.7594 -12.7594 -12.7539 -12.7539 -11.9799 -11.9799 -11.9793 -11.9793 -11.3544 -11.3544 -11.3543 -11.3543 -0.3393 -0.3393 -0.3337 -0.3337 0.0104 0.0104 0.0138 0.0138 0.3954 0.3954 0.3977 0.3977 0.6649 0.6649 0.6658 0.6658 0.8611 0.8611 0.8728 0.8728 1.4947 1.4947 1.4956 1.4956 1.7840 1.7840 1.7896 1.7896 2.3694 2.3694 2.3769 2.3769 2.6049 2.6049 2.6061 2.6061 2.9433 2.9433 2.9450 2.9450 2.9833 2.9833 2.9843 2.9843 4.0566 4.0566 4.0705 4.0705 4.2909 4.2909 4.3198 4.3198 4.4967 4.4967 4.5009 4.5009 4.7758 4.7758 4.7760 4.7760 4.9339 4.9339 4.9513 4.9513 5.1350 5.1350 5.1494 5.1494 5.5379 5.5379 5.5646 5.5646 6.1857 6.1857 6.2005 6.2005 6.6116 6.6116 6.6334 6.6334 k = 0.2212-0.0000 0.1518 ( 5072 PWs) bands (ev): -13.3299 -13.3299 -13.3296 -13.3296 -12.7567 -12.7567 -12.7510 -12.7510 -11.9703 -11.9703 -11.9697 -11.9697 -11.3569 -11.3569 -11.3567 -11.3567 -0.3187 -0.3187 -0.3131 -0.3131 0.0185 0.0185 0.0220 0.0220 0.3786 0.3786 0.3815 0.3815 0.6563 0.6563 0.6563 0.6563 0.8731 0.8731 0.8839 0.8839 1.4817 1.4817 1.4824 1.4824 1.7512 1.7512 1.7576 1.7576 2.3751 2.3751 2.3819 2.3819 2.6018 2.6018 2.6029 2.6029 2.9137 2.9137 2.9149 2.9149 2.9574 2.9574 2.9586 2.9586 4.0376 4.0376 4.0515 4.0515 4.2847 4.2847 4.3137 4.3137 4.4946 4.4946 4.4980 4.4980 4.7951 4.7951 4.7973 4.7973 4.9367 4.9367 4.9560 4.9560 5.1431 5.1431 5.1609 5.1609 5.5359 5.5359 5.5630 5.5630 6.1889 6.1889 6.2046 6.2046 6.5863 6.5863 6.6077 6.6077 k = 0.2308-0.0000 0.1518 ( 5076 PWs) bands (ev): -13.3123 -13.3123 -13.3120 -13.3120 -12.7541 -12.7541 -12.7483 -12.7483 -11.9603 -11.9603 -11.9597 -11.9597 -11.3596 -11.3596 -11.3594 -11.3594 -0.2986 -0.2986 -0.2933 -0.2933 0.0258 0.0258 0.0293 0.0293 0.3620 0.3620 0.3656 0.3656 0.6431 0.6431 0.6440 0.6440 0.8886 0.8886 0.8983 0.8983 1.4683 1.4683 1.4688 1.4688 1.7214 1.7214 1.7286 1.7286 2.3804 2.3804 2.3864 2.3864 2.6013 2.6013 2.6025 2.6025 2.8832 2.8832 2.8840 2.8840 2.9317 2.9317 2.9332 2.9332 4.0182 4.0182 4.0318 4.0318 4.2785 4.2785 4.3076 4.3076 4.4925 4.4925 4.4949 4.4949 4.8128 4.8128 4.8172 4.8172 4.9382 4.9382 4.9590 4.9590 5.1505 5.1505 5.1718 5.1718 5.5340 5.5340 5.5616 5.5616 6.1909 6.1909 6.2074 6.2074 6.5621 6.5621 6.5829 6.5829 k = 0.2404-0.0000 0.1518 ( 5082 PWs) bands (ev): -13.2943 -13.2943 -13.2940 -13.2940 -12.7517 -12.7517 -12.7457 -12.7457 -11.9499 -11.9499 -11.9492 -11.9492 -11.3626 -11.3626 -11.3624 -11.3624 -0.2794 -0.2794 -0.2743 -0.2743 0.0321 0.0321 0.0354 0.0354 0.3460 0.3460 0.3502 0.3502 0.6264 0.6264 0.6280 0.6280 0.9070 0.9070 0.9155 0.9155 1.4552 1.4552 1.4552 1.4552 1.6951 1.6951 1.7031 1.7031 2.3850 2.3850 2.3902 2.3902 2.6029 2.6029 2.6044 2.6044 2.8524 2.8524 2.8526 2.8526 2.9060 2.9060 2.9078 2.9078 3.9983 3.9983 4.0115 4.0115 4.2723 4.2723 4.3015 4.3015 4.4904 4.4904 4.4917 4.4917 4.8289 4.8289 4.8356 4.8356 4.9383 4.9383 4.9603 4.9603 5.1574 5.1574 5.1822 5.1822 5.5324 5.5324 5.5604 5.5604 6.1916 6.1916 6.2090 6.2090 6.5392 6.5392 6.5591 6.5591 k = 0.2500-0.0000 0.1518 ( 5086 PWs) bands (ev): -13.2760 -13.2760 -13.2758 -13.2758 -12.7495 -12.7495 -12.7435 -12.7435 -11.9390 -11.9390 -11.9384 -11.9384 -11.3658 -11.3658 -11.3657 -11.3657 -0.2613 -0.2613 -0.2566 -0.2566 0.0375 0.0375 0.0404 0.0404 0.3310 0.3310 0.3358 0.3358 0.6064 0.6064 0.6086 0.6086 0.9278 0.9278 0.9353 0.9353 1.4421 1.4421 1.4427 1.4427 1.6729 1.6729 1.6815 1.6815 2.3887 2.3887 2.3930 2.3930 2.6058 2.6058 2.6078 2.6078 2.8215 2.8215 2.8217 2.8217 2.8802 2.8802 2.8824 2.8824 3.9778 3.9778 3.9905 3.9905 4.2661 4.2661 4.2955 4.2955 4.4883 4.4883 4.4884 4.4884 4.8431 4.8431 4.8524 4.8524 4.9371 4.9371 4.9599 4.9599 5.1636 5.1636 5.1919 5.1919 5.5310 5.5310 5.5594 5.5594 6.1912 6.1912 6.2093 6.2093 6.5176 6.5176 6.5365 6.5365 k = 0.2596-0.0000 0.1518 ( 5086 PWs) bands (ev): -13.2574 -13.2574 -13.2573 -13.2573 -12.7476 -12.7476 -12.7414 -12.7414 -11.9278 -11.9278 -11.9272 -11.9272 -11.3694 -11.3694 -11.3692 -11.3692 -0.2446 -0.2446 -0.2404 -0.2404 0.0418 0.0418 0.0442 0.0442 0.3172 0.3172 0.3225 0.3225 0.5834 0.5834 0.5861 0.5861 0.9505 0.9505 0.9570 0.9570 1.4299 1.4299 1.4312 1.4312 1.6551 1.6551 1.6643 1.6643 2.3912 2.3912 2.3944 2.3944 2.6090 2.6090 2.6117 2.6117 2.7917 2.7917 2.7922 2.7922 2.8544 2.8544 2.8570 2.8570 3.9566 3.9566 3.9688 3.9688 4.2599 4.2599 4.2895 4.2895 4.4850 4.4850 4.4863 4.4863 4.8554 4.8554 4.8677 4.8677 4.9350 4.9350 4.9580 4.9580 5.1694 5.1694 5.2010 5.2010 5.5299 5.5299 5.5586 5.5586 6.1899 6.1899 6.2087 6.2087 6.4974 6.4974 6.5152 6.5152 k = 0.2692-0.0000 0.1518 ( 5076 PWs) bands (ev): -13.2387 -13.2387 -13.2386 -13.2386 -12.7459 -12.7459 -12.7397 -12.7397 -11.9163 -11.9163 -11.9157 -11.9157 -11.3733 -11.3733 -11.3731 -11.3731 -0.2296 -0.2296 -0.2262 -0.2262 0.0453 0.0453 0.0467 0.0467 0.3050 0.3050 0.3105 0.3105 0.5579 0.5579 0.5607 0.5607 0.9746 0.9746 0.9803 0.9803 1.4191 1.4191 1.4211 1.4211 1.6421 1.6421 1.6518 1.6518 2.3920 2.3920 2.3942 2.3942 2.6109 2.6109 2.6147 2.6147 2.7647 2.7647 2.7654 2.7654 2.8286 2.8286 2.8316 2.8316 3.9349 3.9349 3.9464 3.9464 4.2539 4.2539 4.2838 4.2838 4.4815 4.4815 4.4843 4.4843 4.8655 4.8655 4.8813 4.8813 4.9321 4.9321 4.9546 4.9546 5.1748 5.1748 5.2095 5.2095 5.5289 5.5289 5.5580 5.5580 6.1878 6.1878 6.2072 6.2072 6.4787 6.4787 6.4952 6.4952 k = 0.2788-0.0000 0.1518 ( 5076 PWs) bands (ev): -13.2198 -13.2198 -13.2198 -13.2198 -12.7445 -12.7445 -12.7383 -12.7383 -11.9044 -11.9044 -11.9038 -11.9038 -11.3775 -11.3775 -11.3773 -11.3773 -0.2167 -0.2167 -0.2142 -0.2142 0.0481 0.0481 0.0484 0.0484 0.2942 0.2942 0.2998 0.2998 0.5302 0.5302 0.5331 0.5331 0.9998 0.9998 1.0046 1.0046 1.4098 1.4098 1.4127 1.4127 1.6341 1.6341 1.6441 1.6441 2.3906 2.3906 2.3918 2.3918 2.6091 2.6091 2.6141 2.6141 2.7427 2.7427 2.7435 2.7435 2.8033 2.8033 2.8069 2.8069 3.9124 3.9124 3.9232 3.9232 4.2481 4.2481 4.2783 4.2783 4.4778 4.4778 4.4823 4.4823 4.8731 4.8731 4.8932 4.8932 4.9289 4.9289 4.9498 4.9498 5.1797 5.1797 5.2175 5.2175 5.5281 5.5281 5.5576 5.5576 6.1851 6.1851 6.2049 6.2049 6.4614 6.4614 6.4766 6.4766 k = 0.2885-0.0000 0.1518 ( 5088 PWs) bands (ev): -13.2009 -13.2009 -13.2007 -13.2007 -12.7435 -12.7435 -12.7372 -12.7372 -11.8921 -11.8921 -11.8915 -11.8915 -11.3820 -11.3820 -11.3818 -11.3818 -0.2065 -0.2065 -0.2050 -0.2050 0.0494 0.0494 0.0505 0.0505 0.2846 0.2846 0.2903 0.2903 0.5010 0.5010 0.5038 0.5038 1.0257 1.0257 1.0298 1.0298 1.4027 1.4027 1.4063 1.4063 1.6311 1.6311 1.6412 1.6412 2.3864 2.3864 2.3865 2.3865 2.6009 2.6009 2.6072 2.6072 2.7273 2.7273 2.7283 2.7283 2.7800 2.7800 2.7841 2.7841 3.8891 3.8891 3.8991 3.8991 4.2425 4.2425 4.2731 4.2731 4.4741 4.4741 4.4803 4.4803 4.8776 4.8776 4.9032 4.9032 4.9261 4.9261 4.9438 4.9438 5.1842 5.1842 5.2249 5.2249 5.5274 5.5274 5.5573 5.5573 6.1820 6.1820 6.2022 6.2022 6.4455 6.4455 6.4593 6.4593 k = 0.2981-0.0000 0.1518 ( 5084 PWs) bands (ev): -13.1819 -13.1819 -13.1816 -13.1816 -12.7428 -12.7428 -12.7365 -12.7365 -11.8796 -11.8796 -11.8790 -11.8790 -11.3869 -11.3869 -11.3867 -11.3867 -0.1992 -0.1992 -0.1988 -0.1988 0.0504 0.0504 0.0532 0.0532 0.2758 0.2758 0.2813 0.2813 0.4711 0.4711 0.4738 0.4738 1.0520 1.0520 1.0553 1.0553 1.3981 1.3981 1.4025 1.4025 1.6330 1.6330 1.6430 1.6430 2.3778 2.3778 2.3787 2.3787 2.5858 2.5858 2.5931 2.5931 2.7161 2.7161 2.7171 2.7171 2.7627 2.7627 2.7668 2.7668 3.8650 3.8650 3.8743 3.8743 4.2373 4.2373 4.2683 4.2683 4.4702 4.4702 4.4782 4.4782 4.8787 4.8787 4.9112 4.9112 4.9242 4.9242 4.9371 4.9371 5.1885 5.1885 5.2318 5.2318 5.5267 5.5267 5.5571 5.5571 6.1787 6.1787 6.1993 6.1993 6.4310 6.4310 6.4434 6.4434 k = 0.3077-0.0000 0.1518 ( 5090 PWs) bands (ev): -13.1629 -13.1629 -13.1625 -13.1625 -12.7425 -12.7425 -12.7361 -12.7361 -11.8667 -11.8667 -11.8661 -11.8661 -11.3922 -11.3922 -11.3920 -11.3920 -0.1959 -0.1959 -0.1951 -0.1951 0.0519 0.0519 0.0565 0.0565 0.2669 0.2669 0.2720 0.2720 0.4415 0.4415 0.4440 0.4440 1.0782 1.0782 1.0808 1.0808 1.3965 1.3965 1.4015 1.4015 1.6393 1.6393 1.6491 1.6491 2.3651 2.3651 2.3668 2.3668 2.5661 2.5661 2.5738 2.5738 2.7014 2.7014 2.7015 2.7015 2.7582 2.7582 2.7610 2.7610 3.8402 3.8402 3.8486 3.8486 4.2325 4.2325 4.2640 4.2640 4.4662 4.4662 4.4761 4.4761 4.8762 4.8762 4.9159 4.9159 4.9234 4.9234 4.9309 4.9309 5.1927 5.1927 5.2384 5.2384 5.5260 5.5260 5.5568 5.5568 6.1755 6.1755 6.1962 6.1962 6.4177 6.4177 6.4287 6.4287 k = 0.3173-0.0000 0.1518 ( 5086 PWs) bands (ev): -13.1439 -13.1439 -13.1434 -13.1434 -12.7426 -12.7426 -12.7362 -12.7362 -11.8535 -11.8535 -11.8530 -11.8530 -11.3979 -11.3979 -11.3977 -11.3977 -0.1961 -0.1961 -0.1944 -0.1944 0.0544 0.0544 0.0606 0.0606 0.2566 0.2566 0.2612 0.2612 0.4138 0.4138 0.4161 0.4161 1.1042 1.1042 1.1060 1.1060 1.3982 1.3982 1.4039 1.4039 1.6498 1.6498 1.6591 1.6591 2.3479 2.3479 2.3501 2.3501 2.5444 2.5444 2.5522 2.5522 2.6799 2.6799 2.6811 2.6811 2.7655 2.7655 2.7666 2.7666 3.8146 3.8146 3.8221 3.8221 4.2282 4.2282 4.2604 4.2604 4.4620 4.4620 4.4739 4.4739 4.8709 4.8709 4.9134 4.9134 4.9231 4.9231 4.9291 4.9291 5.1969 5.1969 5.2447 5.2447 5.5250 5.5250 5.5564 5.5564 6.1724 6.1724 6.1934 6.1934 6.4056 6.4056 6.4152 6.4152 k = 0.3269-0.0000 0.1518 ( 5088 PWs) bands (ev): -13.1250 -13.1250 -13.1244 -13.1244 -12.7431 -12.7431 -12.7368 -12.7368 -11.8401 -11.8401 -11.8396 -11.8396 -11.4039 -11.4039 -11.4037 -11.4037 -0.1994 -0.1994 -0.1968 -0.1968 0.0580 0.0580 0.0657 0.0657 0.2433 0.2433 0.2472 0.2472 0.3895 0.3895 0.3918 0.3918 1.1294 1.1294 1.1307 1.1307 1.4037 1.4037 1.4100 1.4100 1.6639 1.6639 1.6727 1.6727 2.3262 2.3262 2.3286 2.3286 2.5225 2.5225 2.5300 2.5300 2.6564 2.6564 2.6583 2.6583 2.7790 2.7790 2.7791 2.7791 3.7882 3.7882 3.7948 3.7948 4.2246 4.2246 4.2574 4.2574 4.4577 4.4577 4.4715 4.4715 4.8636 4.8636 4.9050 4.9050 4.9228 4.9228 4.9307 4.9307 5.2012 5.2012 5.2508 5.2508 5.5238 5.5238 5.5558 5.5558 6.1698 6.1698 6.1908 6.1908 6.3946 6.3946 6.4027 6.4027 k = 0.3365-0.0000 0.1518 ( 5088 PWs) bands (ev): -13.1062 -13.1062 -13.1055 -13.1055 -12.7440 -12.7440 -12.7377 -12.7377 -11.8265 -11.8265 -11.8259 -11.8259 -11.4104 -11.4104 -11.4102 -11.4102 -0.2053 -0.2053 -0.2020 -0.2020 0.0624 0.0624 0.0714 0.0714 0.2258 0.2258 0.2289 0.2289 0.3701 0.3701 0.3725 0.3725 1.1539 1.1539 1.1545 1.1545 1.4132 1.4132 1.4199 1.4199 1.6812 1.6812 1.6892 1.6892 2.3004 2.3004 2.3027 2.3027 2.5007 2.5007 2.5075 2.5075 2.6330 2.6330 2.6351 2.6351 2.7951 2.7951 2.7961 2.7961 3.7610 3.7610 3.7667 3.7667 4.2217 4.2217 4.2552 4.2552 4.4531 4.4531 4.4689 4.4689 4.8551 4.8551 4.8948 4.8948 4.9218 4.9218 4.9317 4.9317 5.2059 5.2059 5.2570 5.2570 5.5221 5.5221 5.5547 5.5547 6.1678 6.1678 6.1887 6.1887 6.3845 6.3845 6.3912 6.3912 k = 0.3462-0.0000 0.1518 ( 5084 PWs) bands (ev): -13.0877 -13.0877 -13.0868 -13.0868 -12.7454 -12.7454 -12.7392 -12.7392 -11.8126 -11.8126 -11.8120 -11.8120 -11.4173 -11.4173 -11.4170 -11.4170 -0.2131 -0.2131 -0.2095 -0.2095 0.0671 0.0671 0.0770 0.0770 0.2044 0.2044 0.2065 0.2065 0.3563 0.3563 0.3588 0.3588 1.1773 1.1773 1.1775 1.1775 1.4268 1.4268 1.4338 1.4338 1.7010 1.7010 1.7083 1.7083 2.2713 2.2713 2.2732 2.2732 2.4785 2.4785 2.4845 2.4845 2.6105 2.6105 2.6127 2.6127 2.8137 2.8137 2.8154 2.8154 3.7331 3.7331 3.7379 3.7379 4.2195 4.2195 4.2539 4.2539 4.4483 4.4483 4.4662 4.4662 4.8458 4.8458 4.8838 4.8838 4.9197 4.9197 4.9312 4.9312 5.2111 5.2111 5.2634 5.2634 5.5199 5.5199 5.5531 5.5531 6.1664 6.1664 6.1872 6.1872 6.3752 6.3752 6.3805 6.3805 k = 0.3558-0.0000 0.1518 ( 5100 PWs) bands (ev): -13.0693 -13.0693 -13.0683 -13.0683 -12.7473 -12.7473 -12.7411 -12.7411 -11.7985 -11.7985 -11.7980 -11.7980 -11.4246 -11.4246 -11.4243 -11.4243 -0.2223 -0.2223 -0.2185 -0.2185 0.0704 0.0704 0.0810 0.0810 0.1812 0.1812 0.1825 0.1825 0.3471 0.3471 0.3498 0.3498 1.1996 1.1996 1.1997 1.1997 1.4444 1.4444 1.4516 1.4516 1.7229 1.7229 1.7292 1.7292 2.2398 2.2398 2.2412 2.2412 2.4554 2.4554 2.4603 2.4603 2.5894 2.5894 2.5914 2.5914 2.8339 2.8339 2.8363 2.8363 3.7044 3.7044 3.7084 3.7084 4.2183 4.2183 4.2535 4.2535 4.4431 4.4431 4.4632 4.4632 4.8361 4.8361 4.8725 4.8725 4.9165 4.9165 4.9291 4.9291 5.2169 5.2169 5.2699 5.2699 5.5170 5.5170 5.5509 5.5509 6.1657 6.1657 6.1864 6.1864 6.3665 6.3665 6.3704 6.3704 k = 0.3654-0.0000 0.1518 ( 5094 PWs) bands (ev): -13.0512 -13.0512 -13.0500 -13.0500 -12.7497 -12.7497 -12.7436 -12.7436 -11.7843 -11.7843 -11.7838 -11.7838 -11.4323 -11.4323 -11.4320 -11.4320 -0.2322 -0.2322 -0.2285 -0.2285 0.0692 0.0692 0.0794 0.0794 0.1606 0.1606 0.1620 0.1620 0.3411 0.3411 0.3439 0.3439 1.2210 1.2210 1.2214 1.2214 1.4657 1.4657 1.4729 1.4729 1.7460 1.7460 1.7512 1.7512 2.2071 2.2071 2.2077 2.2077 2.4308 2.4308 2.4347 2.4347 2.5697 2.5697 2.5715 2.5715 2.8555 2.8555 2.8584 2.8584 3.6752 3.6752 3.6783 3.6783 4.2179 4.2179 4.2541 4.2541 4.4376 4.4376 4.4599 4.4599 4.8264 4.8264 4.8610 4.8610 4.9120 4.9120 4.9253 4.9253 5.2235 5.2235 5.2770 5.2770 5.5134 5.5134 5.5480 5.5480 6.1660 6.1660 6.1865 6.1865 6.3584 6.3584 6.3610 6.3610 k = 0.3750-0.0000 0.1518 ( 5096 PWs) bands (ev): -13.0334 -13.0334 -13.0321 -13.0321 -12.7526 -12.7526 -12.7466 -12.7466 -11.7699 -11.7699 -11.7694 -11.7694 -11.4405 -11.4405 -11.4402 -11.4402 -0.2425 -0.2425 -0.2388 -0.2388 0.0585 0.0585 0.0669 0.0669 0.1486 0.1486 0.1515 0.1515 0.3370 0.3370 0.3400 0.3400 1.2421 1.2421 1.2425 1.2425 1.4902 1.4902 1.4973 1.4973 1.7697 1.7697 1.7736 1.7736 2.1741 2.1741 2.1743 2.1743 2.4045 2.4045 2.4075 2.4075 2.5512 2.5512 2.5527 2.5527 2.8781 2.8781 2.8816 2.8816 3.6454 3.6454 3.6476 3.6476 4.2186 4.2186 4.2557 4.2557 4.4318 4.4318 4.4562 4.4562 4.8170 4.8170 4.8498 4.8498 4.9064 4.9064 4.9199 4.9199 5.2309 5.2309 5.2845 5.2845 5.5090 5.5090 5.5443 5.5443 6.1671 6.1671 6.1873 6.1873 6.3507 6.3507 6.3519 6.3519 k = 0.3846-0.0000 0.1518 ( 5104 PWs) bands (ev): -13.0159 -13.0159 -13.0144 -13.0144 -12.7560 -12.7560 -12.7502 -12.7502 -11.7554 -11.7554 -11.7550 -11.7550 -11.4490 -11.4490 -11.4488 -11.4488 -0.2524 -0.2524 -0.2489 -0.2489 0.0374 0.0374 0.0434 0.0434 0.1470 0.1470 0.1519 0.1519 0.3340 0.3340 0.3370 0.3370 1.2631 1.2631 1.2636 1.2636 1.5175 1.5175 1.5244 1.5244 1.7926 1.7926 1.7950 1.7950 2.1417 2.1417 2.1428 2.1428 2.3766 2.3766 2.3788 2.3788 2.5334 2.5334 2.5347 2.5347 2.9017 2.9017 2.9056 2.9056 3.6151 3.6151 3.6164 3.6164 4.2203 4.2203 4.2584 4.2584 4.4254 4.4254 4.4522 4.4522 4.8080 4.8080 4.8388 4.8388 4.8995 4.8995 4.9131 4.9131 5.2391 5.2391 5.2925 5.2925 5.5037 5.5037 5.5398 5.5398 6.1691 6.1691 6.1890 6.1890 6.3432 6.3432 6.3433 6.3433 k = 0.3942-0.0000 0.1518 ( 5104 PWs) bands (ev): -12.9988 -12.9988 -12.9972 -12.9972 -12.7600 -12.7600 -12.7543 -12.7543 -11.7409 -11.7409 -11.7404 -11.7404 -11.4581 -11.4581 -11.4578 -11.4578 -0.2617 -0.2617 -0.2583 -0.2583 0.0102 0.0102 0.0145 0.0145 0.1522 0.1522 0.1583 0.1583 0.3314 0.3314 0.3345 0.3345 1.2845 1.2845 1.2849 1.2849 1.5471 1.5471 1.5537 1.5537 1.8132 1.8132 1.8139 1.8139 2.1122 2.1122 2.1143 2.1143 2.3472 2.3472 2.3489 2.3489 2.5160 2.5160 2.5170 2.5170 2.9261 2.9261 2.9303 2.9303 3.5843 3.5843 3.5849 3.5849 4.2231 4.2231 4.2621 4.2621 4.4187 4.4187 4.4477 4.4477 4.7996 4.7996 4.8284 4.8284 4.8917 4.8917 4.9051 4.9051 5.2481 5.2481 5.3012 5.3012 5.4976 5.4976 5.5343 5.5343 6.1720 6.1720 6.1915 6.1915 6.3348 6.3348 6.3361 6.3361 k = 0.4038-0.0000 0.1518 ( 5108 PWs) bands (ev): -12.9821 -12.9821 -12.9803 -12.9803 -12.7646 -12.7646 -12.7590 -12.7590 -11.7263 -11.7263 -11.7258 -11.7258 -11.4675 -11.4675 -11.4672 -11.4672 -0.2700 -0.2700 -0.2668 -0.2668 -0.0194 -0.0194 -0.0163 -0.0163 0.1607 0.1607 0.1673 0.1673 0.3287 0.3287 0.3320 0.3320 1.3065 1.3065 1.3067 1.3067 1.5782 1.5782 1.5845 1.5845 1.8277 1.8277 1.8290 1.8290 2.0881 2.0881 2.0914 2.0914 2.3168 2.3168 2.3181 2.3181 2.4984 2.4984 2.4992 2.4992 2.9512 2.9512 2.9558 2.9558 3.5530 3.5530 3.5532 3.5532 4.2269 4.2269 4.2669 4.2669 4.4113 4.4113 4.4426 4.4426 4.7920 4.7920 4.8187 4.8187 4.8829 4.8829 4.8959 4.8959 5.2579 5.2579 5.3104 5.3104 5.4906 5.4906 5.5280 5.5280 6.1757 6.1757 6.1948 6.1948 6.3265 6.3265 6.3290 6.3290 k = 0.4135-0.0000 0.1518 ( 5104 PWs) bands (ev): -12.9659 -12.9659 -12.9638 -12.9638 -12.7697 -12.7697 -12.7643 -12.7643 -11.7116 -11.7116 -11.7112 -11.7112 -11.4774 -11.4774 -11.4771 -11.4771 -0.2769 -0.2769 -0.2740 -0.2740 -0.0495 -0.0495 -0.0471 -0.0471 0.1708 0.1708 0.1777 0.1777 0.3257 0.3257 0.3291 0.3291 1.3293 1.3293 1.3294 1.3294 1.6105 1.6105 1.6163 1.6163 1.8337 1.8337 1.8370 1.8370 2.0726 2.0726 2.0768 2.0768 2.2857 2.2857 2.2868 2.2868 2.4803 2.4803 2.4809 2.4809 2.9770 2.9770 2.9819 2.9819 3.5209 3.5209 3.5218 3.5218 4.2317 4.2317 4.2727 4.2727 4.4035 4.4035 4.4369 4.4369 4.7855 4.7855 4.8101 4.8101 4.8734 4.8734 4.8860 4.8860 5.2685 5.2685 5.3203 5.3203 5.4827 5.4827 5.5209 5.5209 6.1803 6.1803 6.1989 6.1989 6.3183 6.3183 6.3220 6.3220 k = 0.4231-0.0000 0.1518 ( 5106 PWs) bands (ev): -12.9501 -12.9501 -12.9479 -12.9479 -12.7755 -12.7755 -12.7701 -12.7701 -11.6970 -11.6970 -11.6966 -11.6966 -11.4877 -11.4877 -11.4874 -11.4874 -0.2824 -0.2824 -0.2797 -0.2797 -0.0789 -0.0789 -0.0771 -0.0771 0.1817 0.1817 0.1887 0.1887 0.3222 0.3222 0.3258 0.3258 1.3530 1.3530 1.3531 1.3531 1.6431 1.6431 1.6484 1.6484 1.8300 1.8300 1.8348 1.8348 2.0680 2.0680 2.0723 2.0723 2.2544 2.2544 2.2556 2.2556 2.4616 2.4616 2.4619 2.4619 3.0034 3.0034 3.0085 3.0085 3.4887 3.4887 3.4902 3.4902 4.2376 4.2376 4.2794 4.2794 4.3951 4.3951 4.4306 4.4306 4.7802 4.7802 4.8026 4.8026 4.8634 4.8634 4.8755 4.8755 5.2797 5.2797 5.3308 5.3308 5.4740 5.4740 5.5129 5.5129 6.1856 6.1856 6.2037 6.2037 6.3102 6.3102 6.3150 6.3150 k = 0.4327-0.0000 0.1518 ( 5110 PWs) bands (ev): -12.9348 -12.9348 -12.9324 -12.9324 -12.7818 -12.7818 -12.7766 -12.7766 -11.6824 -11.6824 -11.6820 -11.6820 -11.4984 -11.4984 -11.4981 -11.4981 -0.2860 -0.2860 -0.2836 -0.2836 -0.1071 -0.1071 -0.1058 -0.1058 0.1930 0.1930 0.1999 0.1999 0.3181 0.3181 0.3218 0.3218 1.3778 1.3778 1.3779 1.3779 1.6749 1.6749 1.6793 1.6793 1.8177 1.8177 1.8236 1.8236 2.0735 2.0735 2.0767 2.0767 2.2237 2.2237 2.2257 2.2257 2.4420 2.4420 2.4420 2.4420 3.0305 3.0305 3.0357 3.0357 3.4564 3.4564 3.4585 3.4585 4.2444 4.2444 4.2871 4.2871 4.3861 4.3861 4.4236 4.4236 4.7761 4.7761 4.7965 4.7965 4.8530 4.8530 4.8646 4.8646 5.2914 5.2914 5.3417 5.3417 5.4645 5.4645 5.5041 5.5041 6.1915 6.1915 6.2091 6.2091 6.3020 6.3020 6.3080 6.3080 k = 0.4423-0.0000 0.1518 ( 5106 PWs) bands (ev): -12.9200 -12.9200 -12.9174 -12.9174 -12.7887 -12.7887 -12.7837 -12.7837 -11.6679 -11.6679 -11.6675 -11.6675 -11.5095 -11.5095 -11.5092 -11.5092 -0.2878 -0.2878 -0.2856 -0.2856 -0.1338 -0.1338 -0.1329 -0.1329 0.2045 0.2045 0.2112 0.2112 0.3133 0.3133 0.3172 0.3172 1.4037 1.4037 1.4040 1.4040 1.7024 1.7024 1.7053 1.7053 1.8026 1.8026 1.8096 1.8096 2.0842 2.0842 2.0848 2.0848 2.1960 2.1960 2.1996 2.1996 2.4211 2.4211 2.4213 2.4213 3.0581 3.0581 3.0635 3.0635 3.4241 3.4241 3.4268 3.4268 4.2521 4.2521 4.2956 4.2956 4.3766 4.3766 4.4160 4.4160 4.7735 4.7735 4.7919 4.7919 4.8425 4.8425 4.8536 4.8536 5.3037 5.3037 5.3531 5.3531 5.4543 5.4543 5.4946 5.4946 6.1980 6.1980 6.2150 6.2150 6.2939 6.2939 6.3009 6.3009 k = 0.4519-0.0000 0.1518 ( 5098 PWs) bands (ev): -12.9058 -12.9058 -12.9030 -12.9030 -12.7963 -12.7963 -12.7915 -12.7915 -11.6534 -11.6534 -11.6531 -11.6531 -11.5211 -11.5211 -11.5207 -11.5207 -0.2875 -0.2875 -0.2855 -0.2855 -0.1587 -0.1587 -0.1581 -0.1581 0.2159 0.2159 0.2225 0.2225 0.3077 0.3077 0.3118 0.3118 1.4309 1.4309 1.4313 1.4313 1.7149 1.7149 1.7162 1.7162 1.7979 1.7979 1.8060 1.8060 2.0873 2.0873 2.0907 2.0907 2.1777 2.1777 2.1841 2.1841 2.3990 2.3990 2.3996 2.3996 3.0862 3.0862 3.0917 3.0917 3.3919 3.3919 3.3952 3.3952 4.2607 4.2607 4.3048 4.3048 4.3666 4.3666 4.4076 4.4076 4.7723 4.7723 4.7890 4.7890 4.8321 4.8321 4.8428 4.8428 5.3163 5.3163 5.3650 5.3650 5.4435 5.4435 5.4845 5.4845 6.2050 6.2050 6.2213 6.2213 6.2857 6.2857 6.2937 6.2937 k = 0.4615-0.0000 0.1518 ( 5102 PWs) bands (ev): -12.8922 -12.8922 -12.8891 -12.8891 -12.8045 -12.8045 -12.7998 -12.7998 -11.6392 -11.6392 -11.6388 -11.6388 -11.5329 -11.5329 -11.5326 -11.5326 -0.2850 -0.2850 -0.2833 -0.2833 -0.1816 -0.1816 -0.1813 -0.1813 0.2272 0.2272 0.2336 0.2336 0.3014 0.3014 0.3057 0.3057 1.4591 1.4591 1.4597 1.4597 1.7026 1.7026 1.7037 1.7037 1.8154 1.8154 1.8232 1.8232 2.0744 2.0744 2.0803 2.0803 2.1789 2.1789 2.1866 2.1866 2.3758 2.3758 2.3769 2.3769 3.1149 3.1149 3.1204 3.1204 3.3599 3.3599 3.3636 3.3636 4.2699 4.2699 4.3146 4.3146 4.3562 4.3562 4.3985 4.3985 4.7726 4.7726 4.7877 4.7877 4.8220 4.8220 4.8324 4.8324 5.3293 5.3293 5.3770 5.3770 5.4320 5.4320 5.4737 5.4737 6.2123 6.2123 6.2280 6.2280 6.2775 6.2775 6.2865 6.2865 k = 0.4712-0.0000 0.1518 ( 5102 PWs) bands (ev): -12.8791 -12.8791 -12.8758 -12.8758 -12.8132 -12.8132 -12.8088 -12.8088 -11.6250 -11.6250 -11.6247 -11.6247 -11.5452 -11.5452 -11.5449 -11.5449 -0.2802 -0.2802 -0.2788 -0.2788 -0.2024 -0.2024 -0.2024 -0.2024 0.2382 0.2382 0.2443 0.2443 0.2943 0.2943 0.2989 0.2989 1.4885 1.4885 1.4893 1.4893 1.6767 1.6767 1.6779 1.6779 1.8452 1.8452 1.8523 1.8523 2.0489 2.0489 2.0550 2.0550 2.1963 2.1963 2.2031 2.2031 2.3516 2.3516 2.3531 2.3531 3.1440 3.1440 3.1495 3.1495 3.3281 3.3281 3.3321 3.3321 4.2798 4.2798 4.3249 4.3249 4.3454 4.3454 4.3888 4.3888 4.7744 4.7744 4.7881 4.7881 4.8123 4.8123 4.8227 4.8227 5.3423 5.3423 5.3893 5.3893 5.4200 5.4200 5.4625 5.4625 6.2200 6.2200 6.2350 6.2350 6.2692 6.2692 6.2792 6.2792 k = 0.4808-0.0000 0.1518 ( 5108 PWs) bands (ev): -12.8666 -12.8666 -12.8631 -12.8631 -12.8227 -12.8227 -12.8184 -12.8184 -11.6111 -11.6111 -11.6107 -11.6107 -11.5578 -11.5578 -11.5575 -11.5575 -0.2732 -0.2732 -0.2719 -0.2719 -0.2213 -0.2213 -0.2210 -0.2210 0.2489 0.2489 0.2547 0.2547 0.2865 0.2865 0.2913 0.2913 1.5189 1.5189 1.5198 1.5198 1.6462 1.6462 1.6475 1.6475 1.8789 1.8789 1.8855 1.8855 2.0176 2.0176 2.0236 2.0236 2.2202 2.2202 2.2258 2.2258 2.3263 2.3263 2.3284 2.3284 3.1737 3.1737 3.1790 3.1790 3.2965 3.2965 3.3009 3.3009 4.2902 4.2902 4.3343 4.3343 4.3355 4.3355 4.3787 4.3787 4.7776 4.7776 4.7902 4.7902 4.8033 4.8033 4.8137 4.8137 5.3556 5.3556 5.4017 5.4017 5.4077 5.4077 5.4508 5.4508 6.2279 6.2279 6.2422 6.2422 6.2609 6.2609 6.2718 6.2718 k = 0.4904-0.0000 0.1518 ( 5104 PWs) bands (ev): -12.8547 -12.8547 -12.8510 -12.8510 -12.8327 -12.8327 -12.8287 -12.8287 -11.5974 -11.5974 -11.5970 -11.5970 -11.5707 -11.5707 -11.5704 -11.5704 -0.2638 -0.2638 -0.2627 -0.2627 -0.2378 -0.2378 -0.2372 -0.2372 0.2591 0.2591 0.2647 0.2647 0.2780 0.2780 0.2831 0.2831 1.5502 1.5502 1.5512 1.5512 1.6143 1.6143 1.6156 1.6156 1.9138 1.9138 1.9201 1.9201 1.9839 1.9839 1.9898 1.9898 2.2465 2.2465 2.2510 2.2510 2.3001 2.3001 2.3029 2.3029 3.2038 3.2038 3.2090 3.2090 3.2652 3.2652 3.2699 3.2699 4.3010 4.3010 4.3232 4.3232 4.3464 4.3464 4.3681 4.3681 4.7823 4.7823 4.7940 4.7940 4.7953 4.7953 4.8059 4.8059 5.3688 5.3688 5.3949 5.3949 5.4142 5.4142 5.4388 5.4388 6.2360 6.2360 6.2495 6.2495 6.2525 6.2525 6.2643 6.2643 k = 0.5000-0.0000 0.1518 ( 5104 PWs) bands (ev): -12.8434 -12.8434 -12.8434 -12.8434 -12.8395 -12.8395 -12.8395 -12.8395 -11.5839 -11.5839 -11.5839 -11.5839 -11.5836 -11.5836 -11.5836 -11.5836 -0.2520 -0.2520 -0.2520 -0.2520 -0.2512 -0.2512 -0.2512 -0.2512 0.2688 0.2688 0.2688 0.2688 0.2742 0.2742 0.2742 0.2742 1.5821 1.5821 1.5821 1.5821 1.5833 1.5833 1.5833 1.5833 1.9490 1.9490 1.9490 1.9490 1.9551 1.9551 1.9551 1.9551 2.2734 2.2734 2.2734 2.2734 2.2770 2.2770 2.2770 2.2770 3.2343 3.2343 3.2343 3.2343 3.2393 3.2393 3.2393 3.2393 4.3120 4.3120 4.3120 4.3120 4.3573 4.3573 4.3573 4.3573 4.7882 4.7882 4.7882 4.7882 4.7992 4.7992 4.7992 4.7992 5.3820 5.3820 5.3820 5.3820 5.4266 5.4266 5.4266 5.4266 6.2443 6.2443 6.2443 6.2443 6.2569 6.2569 6.2569 6.2569 k = 0.5000-0.0000 0.1518 ( 5104 PWs) bands (ev): -12.8434 -12.8434 -12.8434 -12.8434 -12.8395 -12.8395 -12.8395 -12.8395 -11.5839 -11.5839 -11.5839 -11.5839 -11.5836 -11.5836 -11.5836 -11.5836 -0.2520 -0.2520 -0.2520 -0.2520 -0.2512 -0.2512 -0.2512 -0.2512 0.2688 0.2688 0.2688 0.2688 0.2742 0.2742 0.2742 0.2742 1.5821 1.5821 1.5821 1.5821 1.5833 1.5833 1.5833 1.5833 1.9490 1.9490 1.9490 1.9490 1.9551 1.9551 1.9551 1.9551 2.2734 2.2734 2.2734 2.2734 2.2770 2.2770 2.2770 2.2770 3.2343 3.2343 3.2343 3.2343 3.2393 3.2393 3.2393 3.2393 4.3120 4.3120 4.3120 4.3120 4.3573 4.3573 4.3573 4.3573 4.7882 4.7882 4.7882 4.7882 4.7992 4.7992 4.7992 4.7992 5.3820 5.3820 5.3820 5.3820 5.4266 5.4266 5.4266 5.4266 6.2443 6.2443 6.2443 6.2443 6.2569 6.2569 6.2569 6.2569 k = 0.5000 0.0094 0.1518 ( 5104 PWs) bands (ev): -12.8434 -12.8434 -12.8432 -12.8432 -12.8396 -12.8396 -12.8394 -12.8394 -11.5839 -11.5839 -11.5839 -11.5839 -11.5836 -11.5836 -11.5836 -11.5836 -0.2521 -0.2521 -0.2520 -0.2520 -0.2514 -0.2514 -0.2511 -0.2511 0.2689 0.2689 0.2690 0.2690 0.2743 0.2743 0.2743 0.2743 1.5800 1.5800 1.5801 1.5801 1.5806 1.5806 1.5819 1.5819 1.9497 1.9497 1.9501 1.9501 1.9553 1.9553 1.9566 1.9566 2.2738 2.2738 2.2745 2.2745 2.2776 2.2776 2.2779 2.2779 3.2348 3.2348 3.2352 3.2352 3.2398 3.2398 3.2401 3.2401 4.3115 4.3115 4.3127 4.3127 4.3574 4.3574 4.3574 4.3574 4.7880 4.7880 4.7884 4.7884 4.7988 4.7988 4.7997 4.7997 5.3804 5.3804 5.3827 5.3827 5.4258 5.4258 5.4265 5.4265 6.2441 6.2441 6.2445 6.2445 6.2561 6.2561 6.2577 6.2577 k = 0.5000 0.0188 0.1518 ( 5116 PWs) bands (ev): -12.8434 -12.8434 -12.8430 -12.8430 -12.8396 -12.8396 -12.8391 -12.8391 -11.5841 -11.5841 -11.5841 -11.5841 -11.5837 -11.5837 -11.5837 -11.5837 -0.2526 -0.2526 -0.2524 -0.2524 -0.2519 -0.2519 -0.2514 -0.2514 0.2693 0.2693 0.2695 0.2695 0.2747 0.2747 0.2747 0.2747 1.5739 1.5739 1.5740 1.5740 1.5742 1.5742 1.5766 1.5766 1.9520 1.9520 1.9528 1.9528 1.9573 1.9573 1.9597 1.9597 2.2756 2.2756 2.2772 2.2772 2.2798 2.2798 2.2804 2.2804 3.2366 3.2366 3.2373 3.2373 3.2417 3.2417 3.2421 3.2421 4.3111 4.3111 4.3135 4.3135 4.3576 4.3576 4.3576 4.3576 4.7878 4.7878 4.7887 4.7887 4.7983 4.7983 4.8002 4.8002 5.3779 5.3779 5.3826 5.3826 5.4241 5.4241 5.4256 5.4256 6.2440 6.2440 6.2449 6.2449 6.2554 6.2554 6.2585 6.2585 k = 0.5000 0.0281 0.1518 ( 5116 PWs) bands (ev): -12.8432 -12.8432 -12.8426 -12.8426 -12.8394 -12.8394 -12.8388 -12.8388 -11.5843 -11.5843 -11.5843 -11.5843 -11.5840 -11.5840 -11.5839 -11.5839 -0.2532 -0.2532 -0.2529 -0.2529 -0.2527 -0.2527 -0.2518 -0.2518 0.2699 0.2699 0.2702 0.2702 0.2753 0.2753 0.2754 0.2754 1.5638 1.5638 1.5642 1.5642 1.5646 1.5646 1.5676 1.5676 1.9558 1.9558 1.9569 1.9569 1.9607 1.9607 1.9641 1.9641 2.2790 2.2790 2.2813 2.2813 2.2836 2.2836 2.2844 2.2844 3.2397 3.2397 3.2409 3.2409 3.2449 3.2449 3.2455 3.2455 4.3109 4.3109 4.3146 4.3146 4.3580 4.3580 4.3581 4.3581 4.7877 4.7877 4.7891 4.7891 4.7980 4.7980 4.8008 4.8008 5.3746 5.3746 5.3817 5.3817 5.4217 5.4217 5.4239 5.4239 6.2441 6.2441 6.2453 6.2453 6.2547 6.2547 6.2594 6.2594 k = 0.5000 0.0375 0.1518 ( 5104 PWs) bands (ev): -12.8430 -12.8430 -12.8422 -12.8422 -12.8392 -12.8392 -12.8384 -12.8384 -11.5846 -11.5846 -11.5846 -11.5846 -11.5843 -11.5843 -11.5842 -11.5842 -0.2541 -0.2541 -0.2537 -0.2537 -0.2536 -0.2536 -0.2525 -0.2525 0.2707 0.2707 0.2712 0.2712 0.2761 0.2761 0.2763 0.2763 1.5505 1.5505 1.5513 1.5513 1.5517 1.5517 1.5553 1.5553 1.9606 1.9606 1.9620 1.9620 1.9652 1.9652 1.9695 1.9695 2.2837 2.2837 2.2868 2.2868 2.2888 2.2888 2.2899 2.2899 3.2442 3.2442 3.2458 3.2458 3.2494 3.2494 3.2503 3.2503 4.3110 4.3110 4.3158 4.3158 4.3586 4.3586 4.3587 4.3587 4.7877 4.7877 4.7895 4.7895 4.7976 4.7976 4.8014 4.8014 5.3706 5.3706 5.3799 5.3799 5.4185 5.4185 5.4214 5.4214 6.2442 6.2442 6.2459 6.2459 6.2542 6.2542 6.2602 6.2602 k = 0.5000 0.0469 0.1518 ( 5100 PWs) bands (ev): -12.8426 -12.8426 -12.8417 -12.8417 -12.8389 -12.8389 -12.8379 -12.8379 -11.5850 -11.5850 -11.5849 -11.5849 -11.5846 -11.5846 -11.5846 -11.5846 -0.2552 -0.2552 -0.2548 -0.2548 -0.2547 -0.2547 -0.2534 -0.2534 0.2718 0.2718 0.2723 0.2723 0.2772 0.2772 0.2774 0.2774 1.5346 1.5346 1.5357 1.5357 1.5361 1.5361 1.5402 1.5402 1.9661 1.9661 1.9677 1.9677 1.9706 1.9706 1.9755 1.9755 2.2898 2.2898 2.2935 2.2935 2.2953 2.2953 2.2966 2.2966 3.2500 3.2500 3.2520 3.2520 3.2553 3.2553 3.2563 3.2563 4.3112 4.3112 4.3172 4.3172 4.3593 4.3593 4.3595 4.3595 4.7877 4.7877 4.7900 4.7900 4.7973 4.7973 4.8021 4.8021 5.3658 5.3658 5.3774 5.3774 5.4145 5.4145 5.4181 5.4181 6.2445 6.2445 6.2465 6.2465 6.2536 6.2536 6.2611 6.2611 k = 0.5000 0.0563 0.1518 ( 5100 PWs) bands (ev): -12.8422 -12.8422 -12.8410 -12.8410 -12.8385 -12.8385 -12.8373 -12.8373 -11.5854 -11.5854 -11.5854 -11.5854 -11.5851 -11.5851 -11.5850 -11.5850 -0.2564 -0.2564 -0.2561 -0.2561 -0.2559 -0.2559 -0.2544 -0.2544 0.2730 0.2730 0.2737 0.2737 0.2784 0.2784 0.2786 0.2786 1.5165 1.5165 1.5179 1.5179 1.5183 1.5183 1.5228 1.5228 1.9719 1.9719 1.9738 1.9738 1.9763 1.9763 1.9817 1.9817 2.2969 2.2969 2.3014 2.3014 2.3030 2.3030 2.3045 2.3045 3.2572 3.2572 3.2596 3.2596 3.2625 3.2625 3.2637 3.2637 4.3116 4.3116 4.3188 4.3188 4.3602 4.3602 4.3605 4.3605 4.7878 4.7878 4.7905 4.7905 4.7971 4.7971 4.8028 4.8028 5.3602 5.3602 5.3740 5.3740 5.4097 5.4097 5.4139 5.4139 6.2448 6.2448 6.2471 6.2471 6.2531 6.2531 6.2618 6.2618 k = 0.5000 0.0656 0.1518 ( 5104 PWs) bands (ev): -12.8417 -12.8417 -12.8403 -12.8403 -12.8381 -12.8381 -12.8366 -12.8366 -11.5860 -11.5860 -11.5859 -11.5859 -11.5856 -11.5856 -11.5856 -11.5856 -0.2579 -0.2579 -0.2576 -0.2576 -0.2572 -0.2572 -0.2557 -0.2557 0.2744 0.2744 0.2751 0.2751 0.2798 0.2798 0.2800 0.2800 1.4967 1.4967 1.4983 1.4983 1.4987 1.4987 1.5036 1.5036 1.9778 1.9778 1.9798 1.9798 1.9821 1.9821 1.9879 1.9879 2.3050 2.3050 2.3101 2.3101 2.3117 2.3117 2.3133 2.3133 3.2657 3.2657 3.2685 3.2685 3.2710 3.2710 3.2724 3.2724 4.3121 4.3121 4.3205 4.3205 4.3612 4.3612 4.3616 4.3616 4.7879 4.7879 4.7911 4.7911 4.7969 4.7969 4.8036 4.8036 5.3539 5.3539 5.3697 5.3697 5.4042 5.4042 5.4090 5.4090 6.2451 6.2451 6.2477 6.2477 6.2526 6.2526 6.2626 6.2626 k = 0.5000 0.0750 0.1518 ( 5096 PWs) bands (ev): -12.8411 -12.8411 -12.8395 -12.8395 -12.8375 -12.8375 -12.8359 -12.8359 -11.5866 -11.5866 -11.5865 -11.5865 -11.5862 -11.5862 -11.5862 -11.5862 -0.2594 -0.2594 -0.2592 -0.2592 -0.2586 -0.2586 -0.2570 -0.2570 0.2759 0.2759 0.2767 0.2767 0.2812 0.2812 0.2815 0.2815 1.4757 1.4757 1.4775 1.4775 1.4777 1.4777 1.4830 1.4830 1.9836 1.9836 1.9856 1.9856 1.9879 1.9879 1.9938 1.9938 2.3138 2.3138 2.3195 2.3195 2.3211 2.3211 2.3228 2.3228 3.2756 3.2756 3.2788 3.2788 3.2809 3.2809 3.2825 3.2825 4.3129 4.3129 4.3224 4.3224 4.3624 4.3624 4.3629 4.3629 4.7881 4.7881 4.7918 4.7918 4.7967 4.7967 4.8044 4.8044 5.3469 5.3469 5.3648 5.3648 5.3979 5.3979 5.4033 5.4033 6.2456 6.2456 6.2484 6.2484 6.2522 6.2522 6.2633 6.2633 k = 0.5000 0.0844 0.1518 ( 5096 PWs) bands (ev): -12.8404 -12.8404 -12.8387 -12.8387 -12.8369 -12.8369 -12.8351 -12.8351 -11.5872 -11.5872 -11.5872 -11.5872 -11.5869 -11.5869 -11.5868 -11.5868 -0.2611 -0.2611 -0.2608 -0.2608 -0.2601 -0.2601 -0.2584 -0.2584 0.2774 0.2774 0.2783 0.2783 0.2827 0.2827 0.2831 0.2831 1.4538 1.4538 1.4556 1.4556 1.4558 1.4558 1.4614 1.4614 1.9892 1.9892 1.9912 1.9912 1.9935 1.9935 1.9995 1.9995 2.3232 2.3232 2.3295 2.3295 2.3310 2.3310 2.3327 2.3327 3.2867 3.2867 3.2903 3.2903 3.2921 3.2921 3.2938 3.2938 4.3138 4.3138 4.3244 4.3244 4.3637 4.3637 4.3643 4.3643 4.7884 4.7884 4.7925 4.7925 4.7966 4.7966 4.8053 4.8053 5.3392 5.3392 5.3590 5.3590 5.3909 5.3909 5.3969 5.3969 6.2460 6.2460 6.2491 6.2491 6.2519 6.2519 6.2639 6.2639 k = 0.5000 0.0938 0.1518 ( 5100 PWs) bands (ev): -12.8396 -12.8396 -12.8377 -12.8377 -12.8362 -12.8362 -12.8342 -12.8342 -11.5880 -11.5880 -11.5879 -11.5879 -11.5876 -11.5876 -11.5876 -11.5876 -0.2628 -0.2628 -0.2625 -0.2625 -0.2617 -0.2617 -0.2599 -0.2599 0.2789 0.2789 0.2799 0.2799 0.2842 0.2842 0.2846 0.2846 1.4312 1.4312 1.4331 1.4331 1.4332 1.4332 1.4391 1.4391 1.9945 1.9945 1.9965 1.9965 1.9988 1.9988 2.0047 2.0047 2.3328 2.3328 2.3396 2.3396 2.3412 2.3412 2.3429 2.3429 3.2991 3.2991 3.3032 3.3032 3.3046 3.3046 3.3063 3.3063 4.3149 4.3149 4.3266 4.3266 4.3651 4.3651 4.3660 4.3660 4.7887 4.7887 4.7932 4.7932 4.7965 4.7965 4.8062 4.8062 5.3309 5.3309 5.3525 5.3525 5.3833 5.3833 5.3897 5.3897 6.2465 6.2465 6.2497 6.2497 6.2515 6.2515 6.2644 6.2644 k = 0.5000 0.1032 0.1518 ( 5104 PWs) bands (ev): -12.8388 -12.8388 -12.8368 -12.8368 -12.8355 -12.8355 -12.8333 -12.8333 -11.5887 -11.5887 -11.5887 -11.5887 -11.5884 -11.5884 -11.5884 -11.5884 -0.2645 -0.2645 -0.2642 -0.2642 -0.2633 -0.2633 -0.2614 -0.2614 0.2805 0.2805 0.2816 0.2816 0.2857 0.2857 0.2861 0.2861 1.4082 1.4082 1.4101 1.4101 1.4103 1.4103 1.4163 1.4163 1.9995 1.9995 2.0014 2.0014 2.0038 2.0038 2.0096 2.0096 2.3425 2.3425 2.3498 2.3498 2.3514 2.3514 2.3531 2.3531 3.3128 3.3128 3.3173 3.3173 3.3184 3.3184 3.3201 3.3201 4.3162 4.3162 4.3290 4.3290 4.3666 4.3666 4.3677 4.3677 4.7890 4.7890 4.7941 4.7941 4.7965 4.7965 4.8071 4.8071 5.3220 5.3220 5.3454 5.3454 5.3749 5.3749 5.3818 5.3818 6.2469 6.2469 6.2503 6.2503 6.2511 6.2511 6.2648 6.2648 k = 0.5000 0.1125 0.1518 ( 5104 PWs) bands (ev): -12.8379 -12.8379 -12.8357 -12.8357 -12.8347 -12.8347 -12.8323 -12.8323 -11.5896 -11.5896 -11.5895 -11.5895 -11.5893 -11.5893 -11.5892 -11.5892 -0.2662 -0.2662 -0.2659 -0.2659 -0.2649 -0.2649 -0.2629 -0.2629 0.2819 0.2819 0.2831 0.2831 0.2871 0.2871 0.2876 0.2876 1.3851 1.3851 1.3869 1.3869 1.3873 1.3873 1.3933 1.3933 2.0042 2.0042 2.0060 2.0060 2.0085 2.0085 2.0142 2.0142 2.3520 2.3520 2.3599 2.3599 2.3616 2.3616 2.3631 2.3631 3.3276 3.3276 3.3325 3.3325 3.3333 3.3333 3.3351 3.3351 4.3177 4.3177 4.3315 4.3315 4.3682 4.3682 4.3696 4.3696 4.7894 4.7894 4.7949 4.7949 4.7965 4.7965 4.8081 4.8081 5.3126 5.3126 5.3376 5.3376 5.3660 5.3660 5.3733 5.3733 6.2474 6.2474 6.2508 6.2508 6.2509 6.2509 6.2650 6.2650 k = 0.5000 0.1219 0.1518 ( 5100 PWs) bands (ev): -12.8370 -12.8370 -12.8346 -12.8346 -12.8338 -12.8338 -12.8313 -12.8313 -11.5904 -11.5904 -11.5904 -11.5904 -11.5902 -11.5902 -11.5901 -11.5901 -0.2678 -0.2678 -0.2676 -0.2676 -0.2664 -0.2664 -0.2643 -0.2643 0.2833 0.2833 0.2845 0.2845 0.2884 0.2884 0.2889 0.2889 1.3620 1.3620 1.3638 1.3638 1.3643 1.3643 1.3703 1.3703 2.0087 2.0087 2.0103 2.0103 2.0130 2.0130 2.0186 2.0186 2.3612 2.3612 2.3696 2.3696 2.3713 2.3713 2.3727 2.3727 3.3435 3.3435 3.3488 3.3488 3.3494 3.3494 3.3511 3.3511 4.3194 4.3194 4.3342 4.3342 4.3700 4.3700 4.3717 4.3717 4.7898 4.7898 4.7958 4.7958 4.7964 4.7964 4.8091 4.8091 5.3027 5.3027 5.3292 5.3292 5.3565 5.3565 5.3643 5.3643 6.2478 6.2478 6.2505 6.2505 6.2514 6.2514 6.2652 6.2652 k = 0.5000 0.1313 0.1518 ( 5100 PWs) bands (ev): -12.8360 -12.8360 -12.8334 -12.8334 -12.8330 -12.8330 -12.8302 -12.8302 -11.5914 -11.5914 -11.5913 -11.5913 -11.5911 -11.5911 -11.5910 -11.5910 -0.2694 -0.2694 -0.2692 -0.2692 -0.2679 -0.2679 -0.2657 -0.2657 0.2845 0.2845 0.2858 0.2858 0.2895 0.2895 0.2901 0.2901 1.3391 1.3391 1.3408 1.3408 1.3416 1.3416 1.3475 1.3475 2.0130 2.0130 2.0145 2.0145 2.0173 2.0173 2.0227 2.0227 2.3700 2.3700 2.3788 2.3788 2.3806 2.3806 2.3817 2.3817 3.3605 3.3605 3.3661 3.3661 3.3664 3.3664 3.3680 3.3680 4.3212 4.3212 4.3370 4.3370 4.3718 4.3718 4.3740 4.3740 4.7903 4.7903 4.7965 4.7965 4.7968 4.7968 4.8102 4.8102 5.2924 5.2924 5.3203 5.3203 5.3465 5.3465 5.3546 5.3546 6.2482 6.2482 6.2501 6.2501 6.2517 6.2517 6.2652 6.2652 k = 0.5000 0.1407 0.1518 ( 5100 PWs) bands (ev): -12.8350 -12.8350 -12.8323 -12.8323 -12.8320 -12.8320 -12.8292 -12.8292 -11.5923 -11.5923 -11.5923 -11.5923 -11.5920 -11.5920 -11.5919 -11.5919 -0.2710 -0.2710 -0.2707 -0.2707 -0.2692 -0.2692 -0.2670 -0.2670 0.2856 0.2856 0.2869 0.2869 0.2904 0.2904 0.2911 0.2911 1.3166 1.3166 1.3181 1.3181 1.3191 1.3191 1.3250 1.3250 2.0172 2.0172 2.0185 2.0185 2.0215 2.0215 2.0266 2.0266 2.3781 2.3781 2.3874 2.3874 2.3893 2.3893 2.3901 2.3901 3.3782 3.3782 3.3842 3.3842 3.3844 3.3844 3.3858 3.3858 4.3233 4.3233 4.3400 4.3400 4.3737 4.3737 4.3764 4.3764 4.7908 4.7908 4.7966 4.7966 4.7978 4.7978 4.8113 4.8113 5.2818 5.2818 5.3109 5.3109 5.3360 5.3360 5.3444 5.3444 6.2485 6.2485 6.2498 6.2498 6.2520 6.2520 6.2650 6.2650 k = 0.5000 0.1501 0.1518 ( 5100 PWs) bands (ev): -12.8340 -12.8340 -12.8311 -12.8311 -12.8311 -12.8311 -12.8281 -12.8281 -11.5933 -11.5933 -11.5932 -11.5932 -11.5930 -11.5930 -11.5929 -11.5929 -0.2723 -0.2723 -0.2720 -0.2720 -0.2705 -0.2705 -0.2683 -0.2683 0.2864 0.2864 0.2878 0.2878 0.2912 0.2912 0.2919 0.2919 1.2945 1.2945 1.2960 1.2960 1.2972 1.2972 1.3029 1.3029 2.0214 2.0214 2.0224 2.0224 2.0255 2.0255 2.0305 2.0305 2.3856 2.3856 2.3952 2.3952 2.3973 2.3973 2.3978 2.3978 3.3967 3.3967 3.4030 3.4030 3.4030 3.4030 3.4043 3.4043 4.3256 4.3256 4.3432 4.3432 4.3757 4.3757 4.3789 4.3789 4.7913 4.7913 4.7967 4.7967 4.7989 4.7989 4.8125 4.8125 5.2708 5.2708 5.3011 5.3011 5.3250 5.3250 5.3338 5.3338 6.2486 6.2486 6.2493 6.2493 6.2522 6.2522 6.2647 6.2647 k = 0.5000 0.1594 0.1518 ( 5104 PWs) bands (ev): -12.8329 -12.8329 -12.8302 -12.8302 -12.8299 -12.8299 -12.8270 -12.8270 -11.5942 -11.5942 -11.5942 -11.5942 -11.5940 -11.5940 -11.5939 -11.5939 -0.2736 -0.2736 -0.2732 -0.2732 -0.2716 -0.2716 -0.2693 -0.2693 0.2871 0.2871 0.2885 0.2885 0.2917 0.2917 0.2924 0.2924 1.2730 1.2730 1.2744 1.2744 1.2758 1.2758 1.2814 1.2814 2.0255 2.0255 2.0263 2.0263 2.0295 2.0295 2.0344 2.0344 2.3923 2.3923 2.4024 2.4024 2.4045 2.4045 2.4046 2.4046 3.4157 3.4157 3.4223 3.4223 3.4224 3.4224 3.4234 3.4234 4.3281 4.3281 4.3465 4.3465 4.3777 4.3777 4.3815 4.3815 4.7919 4.7919 4.7968 4.7968 4.8001 4.8001 4.8137 4.8137 5.2596 5.2596 5.2910 5.2910 5.3137 5.3137 5.3229 5.3229 6.2487 6.2487 6.2488 6.2488 6.2522 6.2522 6.2642 6.2642 k = 0.5000 0.1688 0.1518 ( 5104 PWs) bands (ev): -12.8318 -12.8318 -12.8292 -12.8292 -12.8286 -12.8286 -12.8259 -12.8259 -11.5952 -11.5952 -11.5952 -11.5952 -11.5950 -11.5950 -11.5949 -11.5949 -0.2747 -0.2747 -0.2743 -0.2743 -0.2725 -0.2725 -0.2703 -0.2703 0.2875 0.2875 0.2889 0.2889 0.2920 0.2920 0.2927 0.2927 1.2523 1.2523 1.2535 1.2535 1.2552 1.2552 1.2606 1.2606 2.0296 2.0296 2.0302 2.0302 2.0335 2.0335 2.0382 2.0382 2.3983 2.3983 2.4087 2.4087 2.4105 2.4105 2.4109 2.4109 3.4352 3.4352 3.4419 3.4419 3.4421 3.4421 3.4428 3.4428 4.3308 4.3308 4.3501 4.3501 4.3798 4.3798 4.3842 4.3842 4.7925 4.7925 4.7970 4.7970 4.8013 4.8013 4.8150 4.8150 5.2483 5.2483 5.2806 5.2806 5.3021 5.3021 5.3115 5.3115 6.2484 6.2484 6.2487 6.2487 6.2521 6.2521 6.2636 6.2636 k = 0.5000 0.1782 0.1518 ( 5096 PWs) bands (ev): -12.8308 -12.8308 -12.8283 -12.8283 -12.8274 -12.8274 -12.8248 -12.8248 -11.5962 -11.5962 -11.5961 -11.5961 -11.5959 -11.5959 -11.5959 -11.5959 -0.2757 -0.2757 -0.2752 -0.2752 -0.2733 -0.2733 -0.2711 -0.2711 0.2877 0.2877 0.2892 0.2892 0.2921 0.2921 0.2928 0.2928 1.2323 1.2323 1.2334 1.2334 1.2353 1.2353 1.2405 1.2405 2.0338 2.0338 2.0341 2.0341 2.0375 2.0375 2.0420 2.0420 2.4035 2.4035 2.4143 2.4143 2.4157 2.4157 2.4165 2.4165 3.4549 3.4549 3.4619 3.4619 3.4621 3.4621 3.4624 3.4624 4.3338 4.3338 4.3538 4.3538 4.3819 4.3819 4.3871 4.3871 4.7932 4.7932 4.7972 4.7972 4.8026 4.8026 4.8162 4.8162 5.2370 5.2370 5.2701 5.2701 5.2901 5.2901 5.3000 5.3000 6.2478 6.2478 6.2486 6.2486 6.2520 6.2520 6.2628 6.2628 k = 0.5000 0.1876 0.1518 ( 5096 PWs) bands (ev): -12.8297 -12.8297 -12.8273 -12.8273 -12.8262 -12.8262 -12.8237 -12.8237 -11.5972 -11.5972 -11.5971 -11.5971 -11.5969 -11.5969 -11.5968 -11.5968 -0.2765 -0.2765 -0.2760 -0.2760 -0.2740 -0.2740 -0.2718 -0.2718 0.2877 0.2877 0.2891 0.2891 0.2919 0.2919 0.2927 0.2927 1.2131 1.2131 1.2142 1.2142 1.2163 1.2163 1.2213 1.2213 2.0380 2.0380 2.0380 2.0380 2.0414 2.0414 2.0459 2.0459 2.4080 2.4080 2.4190 2.4190 2.4200 2.4200 2.4213 2.4213 3.4746 3.4746 3.4818 3.4818 3.4820 3.4820 3.4820 3.4820 4.3369 4.3369 4.3576 4.3576 4.3840 4.3840 4.3900 4.3900 4.7938 4.7938 4.7974 4.7974 4.8040 4.8040 4.8175 4.8175 5.2256 5.2256 5.2594 5.2594 5.2780 5.2780 5.2883 5.2883 6.2473 6.2473 6.2484 6.2484 6.2517 6.2517 6.2619 6.2619 k = 0.5000 0.1969 0.1518 ( 5100 PWs) bands (ev): -12.8286 -12.8286 -12.8264 -12.8264 -12.8250 -12.8250 -12.8226 -12.8226 -11.5981 -11.5981 -11.5981 -11.5981 -11.5979 -11.5979 -11.5978 -11.5978 -0.2771 -0.2771 -0.2766 -0.2766 -0.2745 -0.2745 -0.2723 -0.2723 0.2874 0.2874 0.2889 0.2889 0.2915 0.2915 0.2922 0.2922 1.1949 1.1949 1.1959 1.1959 1.1982 1.1982 1.2030 1.2030 2.0420 2.0420 2.0422 2.0422 2.0454 2.0454 2.0498 2.0498 2.4117 2.4117 2.4230 2.4230 2.4234 2.4234 2.4253 2.4253 3.4941 3.4941 3.5014 3.5014 3.5016 3.5016 3.5017 3.5017 4.3402 4.3402 4.3616 4.3616 4.3861 4.3861 4.3930 4.3930 4.7945 4.7945 4.7977 4.7977 4.8054 4.8054 4.8189 4.8189 5.2144 5.2144 5.2487 5.2487 5.2658 5.2658 5.2765 5.2765 6.2466 6.2466 6.2481 6.2481 6.2513 6.2513 6.2609 6.2609 k = 0.5000 0.2063 0.1518 ( 5104 PWs) bands (ev): -12.8276 -12.8276 -12.8255 -12.8255 -12.8238 -12.8238 -12.8216 -12.8216 -11.5990 -11.5990 -11.5990 -11.5990 -11.5988 -11.5988 -11.5987 -11.5987 -0.2776 -0.2776 -0.2771 -0.2771 -0.2748 -0.2748 -0.2727 -0.2727 0.2870 0.2870 0.2885 0.2885 0.2909 0.2909 0.2916 0.2916 1.1777 1.1777 1.1786 1.1786 1.1811 1.1811 1.1856 1.1856 2.0460 2.0460 2.0465 2.0465 2.0494 2.0494 2.0537 2.0537 2.4147 2.4147 2.4261 2.4261 2.4263 2.4263 2.4286 2.4286 3.5133 3.5133 3.5204 3.5204 3.5210 3.5210 3.5210 3.5210 4.3438 4.3438 4.3658 4.3658 4.3881 4.3881 4.3960 4.3960 4.7953 4.7953 4.7980 4.7980 4.8069 4.8069 4.8202 4.8202 5.2034 5.2034 5.2381 5.2381 5.2534 5.2534 5.2646 5.2646 6.2460 6.2460 6.2477 6.2477 6.2508 6.2508 6.2598 6.2598 k = 0.5000 0.2157 0.1518 ( 5092 PWs) bands (ev): -12.8266 -12.8266 -12.8246 -12.8246 -12.8227 -12.8227 -12.8206 -12.8206 -11.5999 -11.5999 -11.5999 -11.5999 -11.5997 -11.5997 -11.5996 -11.5996 -0.2779 -0.2779 -0.2774 -0.2774 -0.2750 -0.2750 -0.2729 -0.2729 0.2864 0.2864 0.2879 0.2879 0.2902 0.2902 0.2908 0.2908 1.1616 1.1616 1.1624 1.1624 1.1651 1.1651 1.1693 1.1693 2.0500 2.0500 2.0508 2.0508 2.0534 2.0534 2.0576 2.0576 2.4172 2.4172 2.4281 2.4281 2.4290 2.4290 2.4312 2.4312 3.5320 3.5320 3.5388 3.5388 3.5398 3.5398 3.5399 3.5399 4.3475 4.3475 4.3701 4.3701 4.3901 4.3901 4.3990 4.3990 4.7960 4.7960 4.7984 4.7984 4.8084 4.8084 4.8216 4.8216 5.1928 5.1928 5.2278 5.2278 5.2412 5.2412 5.2530 5.2530 6.2454 6.2454 6.2473 6.2473 6.2503 6.2503 6.2586 6.2586 k = 0.5000 0.2251 0.1518 ( 5092 PWs) bands (ev): -12.8256 -12.8256 -12.8238 -12.8238 -12.8216 -12.8216 -12.8197 -12.8197 -11.6008 -11.6008 -11.6007 -11.6007 -11.6006 -11.6006 -11.6005 -11.6005 -0.2781 -0.2781 -0.2775 -0.2775 -0.2750 -0.2750 -0.2731 -0.2731 0.2857 0.2857 0.2871 0.2871 0.2893 0.2893 0.2898 0.2898 1.1466 1.1466 1.1473 1.1473 1.1502 1.1502 1.1542 1.1542 2.0540 2.0540 2.0551 2.0551 2.0572 2.0572 2.0615 2.0615 2.4191 2.4191 2.4295 2.4295 2.4310 2.4310 2.4333 2.4333 3.5500 3.5500 3.5565 3.5565 3.5579 3.5579 3.5580 3.5580 4.3514 4.3514 4.3745 4.3745 4.3920 4.3920 4.4020 4.4020 4.7967 4.7967 4.7987 4.7987 4.8101 4.8101 4.8229 4.8229 5.1826 5.1826 5.2177 5.2177 5.2290 5.2290 5.2414 5.2414 6.2447 6.2447 6.2467 6.2467 6.2497 6.2497 6.2574 6.2574 k = 0.5000 0.2345 0.1518 ( 5092 PWs) bands (ev): -12.8247 -12.8247 -12.8230 -12.8230 -12.8206 -12.8206 -12.8189 -12.8189 -11.6016 -11.6016 -11.6015 -11.6015 -11.6014 -11.6014 -11.6013 -11.6013 -0.2782 -0.2782 -0.2776 -0.2776 -0.2750 -0.2750 -0.2731 -0.2731 0.2848 0.2848 0.2862 0.2862 0.2882 0.2882 0.2887 0.2887 1.1327 1.1327 1.1333 1.1333 1.1365 1.1365 1.1401 1.1401 2.0579 2.0579 2.0593 2.0593 2.0610 2.0610 2.0652 2.0652 2.4205 2.4205 2.4303 2.4303 2.4326 2.4326 2.4347 2.4347 3.5670 3.5670 3.5732 3.5732 3.5750 3.5750 3.5752 3.5752 4.3555 4.3555 4.3790 4.3790 4.3937 4.3937 4.4049 4.4049 4.7975 4.7975 4.7991 4.7991 4.8117 4.8117 4.8242 4.8242 5.1730 5.1730 5.2081 5.2081 5.2171 5.2171 5.2303 5.2303 6.2441 6.2441 6.2461 6.2461 6.2491 6.2491 6.2561 6.2561 k = 0.5000 0.2438 0.1518 ( 5088 PWs) bands (ev): -12.8238 -12.8238 -12.8223 -12.8223 -12.8197 -12.8197 -12.8181 -12.8181 -11.6023 -11.6023 -11.6023 -11.6023 -11.6021 -11.6021 -11.6021 -11.6021 -0.2781 -0.2781 -0.2776 -0.2776 -0.2748 -0.2748 -0.2731 -0.2731 0.2839 0.2839 0.2853 0.2853 0.2871 0.2871 0.2875 0.2875 1.1201 1.1201 1.1206 1.1206 1.1240 1.1240 1.1273 1.1273 2.0617 2.0617 2.0634 2.0634 2.0647 2.0647 2.0689 2.0689 2.4215 2.4215 2.4307 2.4307 2.4337 2.4337 2.4357 2.4357 3.5830 3.5830 3.5888 3.5888 3.5910 3.5910 3.5913 3.5913 4.3597 4.3597 4.3835 4.3835 4.3953 4.3953 4.4076 4.4076 4.7982 4.7982 4.7995 4.7995 4.8135 4.8135 4.8254 4.8254 5.1641 5.1641 5.1990 5.1990 5.2055 5.2055 5.2195 5.2195 6.2434 6.2434 6.2455 6.2455 6.2485 6.2485 6.2548 6.2548 k = 0.5000 0.2532 0.1518 ( 5088 PWs) bands (ev): -12.8230 -12.8230 -12.8217 -12.8217 -12.8188 -12.8188 -12.8173 -12.8173 -11.6030 -11.6030 -11.6030 -11.6030 -11.6028 -11.6028 -11.6028 -11.6028 -0.2780 -0.2780 -0.2775 -0.2775 -0.2746 -0.2746 -0.2730 -0.2730 0.2829 0.2829 0.2843 0.2843 0.2859 0.2859 0.2862 0.2862 1.1087 1.1087 1.1091 1.1091 1.1128 1.1128 1.1157 1.1157 2.0654 2.0654 2.0673 2.0673 2.0681 2.0681 2.0723 2.0723 2.4222 2.4222 2.4306 2.4306 2.4344 2.4344 2.4363 2.4363 3.5978 3.5978 3.6031 3.6031 3.6057 3.6057 3.6061 3.6061 4.3639 4.3639 4.3880 4.3880 4.3966 4.3966 4.4101 4.4101 4.7989 4.7989 4.7999 4.7999 4.8152 4.8152 4.8264 4.8264 5.1560 5.1560 5.1906 5.1906 5.1943 5.1943 5.2092 5.2092 6.2428 6.2428 6.2448 6.2448 6.2479 6.2479 6.2535 6.2535 k = 0.5000 0.2626 0.1518 ( 5092 PWs) bands (ev): -12.8223 -12.8223 -12.8211 -12.8211 -12.8180 -12.8180 -12.8167 -12.8167 -11.6036 -11.6036 -11.6036 -11.6036 -11.6035 -11.6035 -11.6034 -11.6034 -0.2779 -0.2779 -0.2774 -0.2774 -0.2743 -0.2743 -0.2729 -0.2729 0.2820 0.2820 0.2833 0.2833 0.2847 0.2847 0.2849 0.2849 1.0985 1.0985 1.0989 1.0989 1.1028 1.1028 1.1054 1.1054 2.0688 2.0688 2.0710 2.0710 2.0713 2.0713 2.0755 2.0755 2.4226 2.4226 2.4302 2.4302 2.4349 2.4349 2.4366 2.4366 3.6113 3.6113 3.6160 3.6160 3.6191 3.6191 3.6195 3.6195 4.3681 4.3681 4.3924 4.3924 4.3975 4.3975 4.4123 4.4123 4.7995 4.7995 4.8003 4.8003 4.8170 4.8170 4.8274 4.8274 5.1489 5.1489 5.1830 5.1830 5.1837 5.1837 5.1997 5.1997 6.2423 6.2423 6.2441 6.2441 6.2474 6.2474 6.2523 6.2523 k = 0.5000 0.2720 0.1518 ( 5084 PWs) bands (ev): -12.8216 -12.8216 -12.8206 -12.8206 -12.8172 -12.8172 -12.8161 -12.8161 -11.6041 -11.6041 -11.6041 -11.6041 -11.6040 -11.6040 -11.6040 -11.6040 -0.2776 -0.2776 -0.2772 -0.2772 -0.2740 -0.2740 -0.2727 -0.2727 0.2811 0.2811 0.2824 0.2824 0.2836 0.2836 0.2837 0.2837 1.0897 1.0897 1.0901 1.0901 1.0941 1.0941 1.0963 1.0963 2.0720 2.0720 2.0742 2.0742 2.0745 2.0745 2.0784 2.0784 2.4229 2.4229 2.4295 2.4295 2.4351 2.4351 2.4367 2.4367 3.6232 3.6232 3.6274 3.6274 3.6310 3.6310 3.6314 3.6314 4.3723 4.3723 4.3966 4.3966 4.3982 4.3982 4.4142 4.4142 4.8001 4.8001 4.8007 4.8007 4.8188 4.8188 4.8282 4.8282 5.1428 5.1428 5.1737 5.1737 5.1762 5.1762 5.1909 5.1909 6.2418 6.2418 6.2435 6.2435 6.2469 6.2469 6.2511 6.2511 k = 0.5000 0.2814 0.1518 ( 5092 PWs) bands (ev): -12.8210 -12.8210 -12.8202 -12.8202 -12.8166 -12.8166 -12.8157 -12.8157 -11.6046 -11.6046 -11.6046 -11.6046 -11.6045 -11.6045 -11.6045 -11.6045 -0.2774 -0.2774 -0.2770 -0.2770 -0.2736 -0.2736 -0.2725 -0.2725 0.2803 0.2803 0.2815 0.2815 0.2825 0.2825 0.2826 0.2826 1.0822 1.0822 1.0825 1.0825 1.0867 1.0867 1.0886 1.0886 2.0748 2.0748 2.0767 2.0767 2.0776 2.0776 2.0809 2.0809 2.4231 2.4231 2.4287 2.4287 2.4352 2.4352 2.4365 2.4365 3.6336 3.6336 3.6372 3.6372 3.6412 3.6412 3.6416 3.6416 4.3764 4.3764 4.3984 4.3984 4.4006 4.4006 4.4156 4.4156 4.8007 4.8007 4.8011 4.8011 4.8205 4.8205 4.8287 4.8287 5.1379 5.1379 5.1644 5.1644 5.1705 5.1705 5.1829 5.1829 6.2414 6.2414 6.2428 6.2428 6.2465 6.2465 6.2500 6.2500 k = 0.5000 0.2907 0.1518 ( 5084 PWs) bands (ev): -12.8205 -12.8205 -12.8199 -12.8199 -12.8160 -12.8160 -12.8153 -12.8153 -11.6050 -11.6050 -11.6050 -11.6050 -11.6049 -11.6049 -11.6049 -11.6049 -0.2772 -0.2772 -0.2768 -0.2768 -0.2733 -0.2733 -0.2724 -0.2724 0.2797 0.2797 0.2808 0.2808 0.2814 0.2814 0.2816 0.2816 1.0761 1.0761 1.0763 1.0763 1.0808 1.0808 1.0823 1.0823 2.0772 2.0772 2.0788 2.0788 2.0803 2.0803 2.0830 2.0830 2.4233 2.4233 2.4279 2.4279 2.4352 2.4352 2.4363 2.4363 3.6423 3.6423 3.6452 3.6452 3.6497 3.6497 3.6501 3.6501 4.3803 4.3803 4.3983 4.3983 4.4044 4.4044 4.4166 4.4166 4.8011 4.8011 4.8014 4.8014 4.8222 4.8222 4.8291 4.8291 5.1344 5.1344 5.1561 5.1561 5.1659 5.1659 5.1760 5.1760 6.2411 6.2411 6.2423 6.2423 6.2462 6.2462 6.2490 6.2490 k = 0.5000 0.3001 0.1518 ( 5084 PWs) bands (ev): -12.8201 -12.8201 -12.8196 -12.8196 -12.8156 -12.8156 -12.8150 -12.8150 -11.6053 -11.6053 -11.6053 -11.6053 -11.6052 -11.6052 -11.6052 -11.6052 -0.2770 -0.2770 -0.2767 -0.2767 -0.2730 -0.2730 -0.2723 -0.2723 0.2792 0.2792 0.2802 0.2802 0.2805 0.2805 0.2808 0.2808 1.0713 1.0713 1.0714 1.0714 1.0761 1.0761 1.0772 1.0772 2.0792 2.0792 2.0805 2.0805 2.0825 2.0825 2.0846 2.0846 2.4235 2.4235 2.4270 2.4270 2.4352 2.4352 2.4360 2.4360 3.6492 3.6492 3.6514 3.6514 3.6564 3.6564 3.6568 3.6568 4.3840 4.3840 4.3977 4.3977 4.4078 4.4078 4.4171 4.4171 4.8015 4.8015 4.8017 4.8017 4.8238 4.8238 4.8291 4.8291 5.1322 5.1322 5.1489 5.1489 5.1626 5.1626 5.1702 5.1702 6.2408 6.2408 6.2418 6.2418 6.2460 6.2460 6.2481 6.2481 k = 0.5000 0.3095 0.1518 ( 5084 PWs) bands (ev): -12.8198 -12.8198 -12.8195 -12.8195 -12.8152 -12.8152 -12.8149 -12.8149 -11.6055 -11.6055 -11.6055 -11.6055 -11.6055 -11.6055 -11.6054 -11.6054 -0.2768 -0.2768 -0.2766 -0.2766 -0.2727 -0.2727 -0.2723 -0.2723 0.2788 0.2788 0.2797 0.2797 0.2798 0.2798 0.2802 0.2802 1.0679 1.0679 1.0680 1.0680 1.0728 1.0728 1.0736 1.0736 2.0808 2.0808 2.0816 2.0816 2.0843 2.0843 2.0856 2.0856 2.4238 2.4238 2.4262 2.4262 2.4352 2.4352 2.4357 2.4357 3.6543 3.6543 3.6558 3.6558 3.6613 3.6613 3.6615 3.6615 4.3873 4.3873 4.3966 4.3966 4.4107 4.4107 4.4170 4.4170 4.8018 4.8018 4.8019 4.8019 4.8252 4.8252 4.8289 4.8289 5.1315 5.1315 5.1427 5.1427 5.1605 5.1605 5.1657 5.1657 6.2407 6.2407 6.2413 6.2413 6.2460 6.2460 6.2474 6.2474 k = 0.5000 0.3189 0.1518 ( 5088 PWs) bands (ev): -12.8196 -12.8196 -12.8194 -12.8194 -12.8150 -12.8150 -12.8148 -12.8148 -11.6056 -11.6056 -11.6056 -11.6056 -11.6056 -11.6056 -11.6056 -11.6056 -0.2767 -0.2767 -0.2766 -0.2766 -0.2725 -0.2725 -0.2723 -0.2723 0.2787 0.2787 0.2792 0.2792 0.2796 0.2796 0.2798 0.2798 1.0658 1.0658 1.0659 1.0659 1.0710 1.0710 1.0713 1.0713 2.0818 2.0818 2.0822 2.0822 2.0855 2.0855 2.0862 2.0862 2.4242 2.4242 2.4254 2.4254 2.4352 2.4352 2.4355 2.4355 3.6575 3.6575 3.6583 3.6583 3.6643 3.6643 3.6644 3.6644 4.3903 4.3903 4.3950 4.3950 4.4131 4.4131 4.4163 4.4163 4.8020 4.8020 4.8020 4.8020 4.8265 4.8265 4.8283 4.8283 5.1321 5.1321 5.1378 5.1378 5.1598 5.1598 5.1624 5.1624 6.2407 6.2407 6.2410 6.2410 6.2461 6.2461 6.2468 6.2468 k = 0.5000 0.3282 0.1518 ( 5088 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6057 -11.6057 -11.6057 -11.6057 -11.6056 -11.6056 -11.6056 -11.6056 -0.2766 -0.2766 -0.2766 -0.2766 -0.2724 -0.2724 -0.2724 -0.2724 0.2788 0.2788 0.2788 0.2788 0.2796 0.2796 0.2796 0.2796 1.0651 1.0651 1.0651 1.0651 1.0704 1.0704 1.0704 1.0704 2.0822 2.0822 2.0822 2.0822 2.0861 2.0861 2.0861 2.0861 2.4247 2.4247 2.4247 2.4247 2.4353 2.4353 2.4353 2.4353 3.6588 3.6588 3.6588 3.6588 3.6653 3.6653 3.6653 3.6653 4.3928 4.3928 4.3928 4.3928 4.4150 4.4150 4.4150 4.4150 4.8021 4.8021 4.8021 4.8021 4.8276 4.8276 4.8276 4.8276 5.1343 5.1343 5.1343 5.1343 5.1604 5.1604 5.1604 5.1604 6.2408 6.2408 6.2408 6.2408 6.2464 6.2464 6.2464 6.2464 k = 0.5000 0.3282 0.1518 ( 5088 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6057 -11.6057 -11.6057 -11.6057 -11.6056 -11.6056 -11.6056 -11.6056 -0.2766 -0.2766 -0.2766 -0.2766 -0.2724 -0.2724 -0.2724 -0.2724 0.2788 0.2788 0.2788 0.2788 0.2796 0.2796 0.2796 0.2796 1.0651 1.0651 1.0651 1.0651 1.0704 1.0704 1.0704 1.0704 2.0822 2.0822 2.0822 2.0822 2.0861 2.0861 2.0861 2.0861 2.4247 2.4247 2.4247 2.4247 2.4353 2.4353 2.4353 2.4353 3.6588 3.6588 3.6588 3.6588 3.6653 3.6653 3.6653 3.6653 4.3928 4.3928 4.3928 4.3928 4.4150 4.4150 4.4150 4.4150 4.8021 4.8021 4.8021 4.8021 4.8276 4.8276 4.8276 4.8276 5.1343 5.1343 5.1343 5.1343 5.1604 5.1604 5.1604 5.1604 6.2408 6.2408 6.2408 6.2408 6.2464 6.2464 6.2464 6.2464 k = 0.4904 0.3282 0.1518 ( 5088 PWs) bands (ev): -12.8198 -12.8198 -12.8198 -12.8198 -12.8151 -12.8151 -12.8151 -12.8151 -11.6178 -11.6178 -11.6178 -11.6178 -11.5939 -11.5939 -11.5939 -11.5939 -0.2807 -0.2807 -0.2807 -0.2807 -0.2668 -0.2668 -0.2668 -0.2668 0.2723 0.2723 0.2723 0.2723 0.2855 0.2855 0.2855 0.2855 1.0486 1.0486 1.0486 1.0486 1.0878 1.0878 1.0878 1.0878 2.0759 2.0759 2.0759 2.0759 2.0930 2.0930 2.0930 2.0930 2.4040 2.4040 2.4040 2.4040 2.4568 2.4568 2.4568 2.4568 3.6348 3.6348 3.6348 3.6348 3.6873 3.6873 3.6873 3.6873 4.3871 4.3871 4.3871 4.3871 4.4215 4.4215 4.4215 4.4215 4.8027 4.8027 4.8027 4.8027 4.8281 4.8281 4.8281 4.8281 5.1344 5.1344 5.1344 5.1344 5.1607 5.1607 5.1607 5.1607 6.2391 6.2391 6.2391 6.2391 6.2476 6.2476 6.2476 6.2476 k = 0.4808 0.3282 0.1518 ( 5084 PWs) bands (ev): -12.8206 -12.8206 -12.8206 -12.8206 -12.8159 -12.8159 -12.8159 -12.8159 -11.6302 -11.6302 -11.6302 -11.6302 -11.5827 -11.5827 -11.5827 -11.5827 -0.2849 -0.2849 -0.2849 -0.2849 -0.2583 -0.2583 -0.2583 -0.2583 0.2649 0.2649 0.2649 0.2649 0.2912 0.2912 0.2912 0.2912 1.0308 1.0308 1.0308 1.0308 1.1083 1.1083 1.1083 1.1083 2.0688 2.0688 2.0688 2.0688 2.1018 2.1018 2.1018 2.1018 2.3799 2.3799 2.3799 2.3799 2.4833 2.4833 2.4833 2.4833 3.6060 3.6060 3.6060 3.6060 3.7101 3.7101 3.7101 3.7101 4.3770 4.3770 4.3770 4.3770 4.4337 4.4337 4.4337 4.4337 4.8045 4.8045 4.8045 4.8045 4.8298 4.8298 4.8298 4.8298 5.1347 5.1347 5.1347 5.1347 5.1615 5.1615 5.1615 5.1615 6.2358 6.2358 6.2358 6.2358 6.2498 6.2498 6.2498 6.2498 k = 0.4712 0.3282 0.1518 ( 5080 PWs) bands (ev): -12.8221 -12.8221 -12.8221 -12.8221 -12.8172 -12.8172 -12.8172 -12.8172 -11.6431 -11.6431 -11.6431 -11.6431 -11.5718 -11.5718 -11.5718 -11.5718 -0.2879 -0.2879 -0.2879 -0.2879 -0.2482 -0.2482 -0.2482 -0.2482 0.2572 0.2572 0.2572 0.2572 0.2961 0.2961 0.2961 0.2961 1.0141 1.0141 1.0141 1.0141 1.1294 1.1294 1.1294 1.1294 2.0626 2.0626 2.0626 2.0626 2.1107 2.1107 2.1107 2.1107 2.3573 2.3573 2.3573 2.3573 2.5103 2.5103 2.5103 2.5103 3.5755 3.5755 3.5755 3.5755 3.7305 3.7305 3.7305 3.7305 4.3671 4.3671 4.3671 4.3671 4.4471 4.4471 4.4471 4.4471 4.8075 4.8075 4.8075 4.8075 4.8326 4.8326 4.8326 4.8326 5.1351 5.1351 5.1351 5.1351 5.1629 5.1629 5.1629 5.1629 6.2318 6.2318 6.2318 6.2318 6.2518 6.2518 6.2518 6.2518 k = 0.4615 0.3282 0.1518 ( 5092 PWs) bands (ev): -12.8242 -12.8242 -12.8242 -12.8242 -12.8190 -12.8190 -12.8190 -12.8190 -11.6562 -11.6562 -11.6562 -11.6562 -11.5615 -11.5615 -11.5615 -11.5615 -0.2895 -0.2895 -0.2895 -0.2895 -0.2368 -0.2368 -0.2368 -0.2368 0.2492 0.2492 0.2492 0.2492 0.3003 0.3003 0.3003 0.3003 0.9988 0.9988 0.9988 0.9988 1.1508 1.1508 1.1508 1.1508 2.0572 2.0572 2.0572 2.0572 2.1190 2.1190 2.1190 2.1190 2.3371 2.3371 2.3371 2.3371 2.5372 2.5372 2.5372 2.5372 3.5436 3.5436 3.5436 3.5436 3.7485 3.7485 3.7485 3.7485 4.3581 4.3581 4.3581 4.3581 4.4608 4.4608 4.4608 4.4608 4.8116 4.8116 4.8116 4.8116 4.8364 4.8364 4.8364 4.8364 5.1357 5.1357 5.1357 5.1357 5.1649 5.1649 5.1649 5.1649 6.2274 6.2274 6.2274 6.2274 6.2534 6.2534 6.2534 6.2534 k = 0.4519 0.3282 0.1518 ( 5080 PWs) bands (ev): -12.8269 -12.8269 -12.8269 -12.8269 -12.8213 -12.8213 -12.8213 -12.8213 -11.6697 -11.6697 -11.6697 -11.6697 -11.5516 -11.5516 -11.5516 -11.5516 -0.2899 -0.2899 -0.2899 -0.2899 -0.2242 -0.2242 -0.2242 -0.2242 0.2410 0.2410 0.2410 0.2410 0.3037 0.3037 0.3037 0.3037 0.9851 0.9851 0.9851 0.9851 1.1723 1.1723 1.1723 1.1723 2.0530 2.0530 2.0530 2.0530 2.1259 2.1259 2.1259 2.1259 2.3203 2.3203 2.3203 2.3203 2.5641 2.5641 2.5641 2.5641 3.5105 3.5105 3.5105 3.5105 3.7641 3.7641 3.7641 3.7641 4.3505 4.3505 4.3505 4.3505 4.4744 4.4744 4.4744 4.4744 4.8167 4.8167 4.8167 4.8167 4.8414 4.8414 4.8414 4.8414 5.1365 5.1365 5.1365 5.1365 5.1676 5.1676 5.1676 5.1676 6.2229 6.2229 6.2229 6.2229 6.2548 6.2548 6.2548 6.2548 k = 0.4423 0.3282 0.1518 ( 5076 PWs) bands (ev): -12.8301 -12.8301 -12.8301 -12.8301 -12.8240 -12.8240 -12.8240 -12.8240 -11.6834 -11.6834 -11.6834 -11.6834 -11.5422 -11.5422 -11.5422 -11.5422 -0.2891 -0.2891 -0.2891 -0.2891 -0.2104 -0.2104 -0.2104 -0.2104 0.2328 0.2328 0.2328 0.2328 0.3063 0.3063 0.3063 0.3063 0.9730 0.9730 0.9730 0.9730 1.1936 1.1936 1.1936 1.1936 2.0498 2.0498 2.0498 2.0498 2.1303 2.1303 2.1303 2.1303 2.3082 2.3082 2.3082 2.3082 2.5907 2.5907 2.5907 2.5907 3.4765 3.4765 3.4765 3.4765 3.7771 3.7771 3.7771 3.7771 4.3443 4.3443 4.3443 4.3443 4.4875 4.4875 4.4875 4.4875 4.8226 4.8226 4.8226 4.8226 4.8474 4.8474 4.8474 4.8474 5.1373 5.1373 5.1373 5.1373 5.1709 5.1709 5.1709 5.1709 6.2181 6.2181 6.2181 6.2181 6.2558 6.2558 6.2558 6.2558 k = 0.4327 0.3282 0.1518 ( 5080 PWs) bands (ev): -12.8340 -12.8340 -12.8340 -12.8340 -12.8273 -12.8273 -12.8273 -12.8273 -11.6972 -11.6972 -11.6972 -11.6972 -11.5334 -11.5334 -11.5334 -11.5334 -0.2873 -0.2873 -0.2873 -0.2873 -0.1957 -0.1957 -0.1957 -0.1957 0.2248 0.2248 0.2248 0.2248 0.3081 0.3081 0.3081 0.3081 0.9627 0.9627 0.9627 0.9627 1.2146 1.2146 1.2146 1.2146 2.0477 2.0477 2.0477 2.0477 2.1312 2.1312 2.1312 2.1312 2.3019 2.3019 2.3019 2.3019 2.6169 2.6169 2.6169 2.6169 3.4417 3.4417 3.4417 3.4417 3.7877 3.7877 3.7877 3.7877 4.3397 4.3397 4.3397 4.3397 4.5000 4.5000 4.5000 4.5000 4.8292 4.8292 4.8292 4.8292 4.8544 4.8544 4.8544 4.8544 5.1381 5.1381 5.1381 5.1381 5.1750 5.1750 5.1750 5.1750 6.2133 6.2133 6.2133 6.2133 6.2565 6.2565 6.2565 6.2565 k = 0.4231 0.3282 0.1518 ( 5084 PWs) bands (ev): -12.8384 -12.8384 -12.8384 -12.8384 -12.8310 -12.8310 -12.8310 -12.8310 -11.7113 -11.7113 -11.7113 -11.7113 -11.5250 -11.5250 -11.5250 -11.5250 -0.2846 -0.2846 -0.2846 -0.2846 -0.1802 -0.1802 -0.1802 -0.1802 0.2170 0.2170 0.2170 0.2170 0.3092 0.3092 0.3092 0.3092 0.9544 0.9544 0.9544 0.9544 1.2350 1.2350 1.2350 1.2350 2.0467 2.0467 2.0467 2.0467 2.1281 2.1281 2.1281 2.1281 2.3021 2.3021 2.3021 2.3021 2.6424 2.6424 2.6424 2.6424 3.4063 3.4063 3.4063 3.4063 3.7961 3.7961 3.7961 3.7961 4.3366 4.3366 4.3366 4.3366 4.5117 4.5117 4.5117 4.5117 4.8362 4.8362 4.8362 4.8362 4.8623 4.8623 4.8623 4.8623 5.1391 5.1391 5.1391 5.1391 5.1799 5.1799 5.1799 5.1799 6.2086 6.2086 6.2086 6.2086 6.2569 6.2569 6.2569 6.2569 k = 0.4135 0.3282 0.1518 ( 5088 PWs) bands (ev): -12.8434 -12.8434 -12.8434 -12.8434 -12.8351 -12.8351 -12.8351 -12.8351 -11.7255 -11.7255 -11.7255 -11.7255 -11.5172 -11.5172 -11.5172 -11.5172 -0.2813 -0.2813 -0.2813 -0.2813 -0.1641 -0.1641 -0.1641 -0.1641 0.2097 0.2097 0.2097 0.2097 0.3096 0.3096 0.3096 0.3096 0.9481 0.9481 0.9481 0.9481 1.2545 1.2545 1.2545 1.2545 2.0468 2.0468 2.0468 2.0468 2.1216 2.1216 2.1216 2.1216 2.3086 2.3086 2.3086 2.3086 2.6673 2.6673 2.6673 2.6673 3.3707 3.3707 3.3707 3.3707 3.8024 3.8024 3.8024 3.8024 4.3349 4.3349 4.3349 4.3349 4.5224 4.5224 4.5224 4.5224 4.8434 4.8434 4.8434 4.8434 4.8710 4.8710 4.8710 4.8710 5.1400 5.1400 5.1400 5.1400 5.1856 5.1856 5.1856 5.1856 6.2040 6.2040 6.2040 6.2040 6.2572 6.2572 6.2572 6.2572 k = 0.4038 0.3282 0.1518 ( 5076 PWs) bands (ev): -12.8490 -12.8490 -12.8490 -12.8490 -12.8397 -12.8397 -12.8397 -12.8397 -11.7398 -11.7398 -11.7398 -11.7398 -11.5099 -11.5099 -11.5099 -11.5099 -0.2774 -0.2774 -0.2774 -0.2774 -0.1477 -0.1477 -0.1477 -0.1477 0.2030 0.2030 0.2030 0.2030 0.3094 0.3094 0.3094 0.3094 0.9441 0.9441 0.9441 0.9441 1.2728 1.2728 1.2728 1.2728 2.0479 2.0479 2.0479 2.0479 2.1130 2.1130 2.1130 2.1130 2.3203 2.3203 2.3203 2.3203 2.6915 2.6915 2.6915 2.6915 3.3348 3.3348 3.3348 3.3348 3.8069 3.8069 3.8069 3.8069 4.3345 4.3345 4.3345 4.3345 4.5323 4.5323 4.5323 4.5323 4.8506 4.8506 4.8506 4.8506 4.8803 4.8803 4.8803 4.8803 5.1410 5.1410 5.1410 5.1410 5.1923 5.1923 5.1923 5.1923 6.1998 6.1998 6.1998 6.1998 6.2575 6.2575 6.2575 6.2575 k = 0.3942 0.3282 0.1518 ( 5084 PWs) bands (ev): -12.8551 -12.8551 -12.8551 -12.8551 -12.8446 -12.8446 -12.8446 -12.8446 -11.7542 -11.7542 -11.7542 -11.7542 -11.5031 -11.5031 -11.5031 -11.5031 -0.2733 -0.2733 -0.2733 -0.2733 -0.1314 -0.1314 -0.1314 -0.1314 0.1973 0.1973 0.1973 0.1973 0.3088 0.3088 0.3088 0.3088 0.9425 0.9425 0.9425 0.9425 1.2898 1.2898 1.2898 1.2898 2.0499 2.0499 2.0499 2.0499 2.1036 2.1036 2.1036 2.1036 2.3360 2.3360 2.3360 2.3360 2.7148 2.7148 2.7148 2.7148 3.2991 3.2991 3.2991 3.2991 3.8100 3.8100 3.8100 3.8100 4.3351 4.3351 4.3351 4.3351 4.5411 4.5411 4.5411 4.5411 4.8575 4.8575 4.8575 4.8575 4.8900 4.8900 4.8900 4.8900 5.1420 5.1420 5.1420 5.1420 5.1998 5.1998 5.1998 5.1998 6.1961 6.1961 6.1961 6.1961 6.2577 6.2577 6.2577 6.2577 k = 0.3846 0.3282 0.1518 ( 5088 PWs) bands (ev): -12.8617 -12.8617 -12.8617 -12.8617 -12.8500 -12.8500 -12.8500 -12.8500 -11.7686 -11.7686 -11.7686 -11.7686 -11.4968 -11.4968 -11.4968 -11.4968 -0.2693 -0.2693 -0.2693 -0.2693 -0.1153 -0.1153 -0.1153 -0.1153 0.1927 0.1927 0.1927 0.1927 0.3079 0.3079 0.3079 0.3079 0.9433 0.9433 0.9433 0.9433 1.3050 1.3050 1.3050 1.3050 2.0528 2.0528 2.0528 2.0528 2.0946 2.0946 2.0946 2.0946 2.3549 2.3549 2.3549 2.3549 2.7370 2.7370 2.7370 2.7370 3.2636 3.2636 3.2636 3.2636 3.8119 3.8119 3.8119 3.8119 4.3366 4.3366 4.3366 4.3366 4.5490 4.5490 4.5490 4.5490 4.8641 4.8641 4.8641 4.8641 4.8998 4.8998 4.8998 4.8998 5.1429 5.1429 5.1429 5.1429 5.2083 5.2083 5.2083 5.2083 6.1929 6.1929 6.1929 6.1929 6.2581 6.2581 6.2581 6.2581 k = 0.3750 0.3282 0.1518 ( 5104 PWs) bands (ev): -12.8689 -12.8689 -12.8689 -12.8689 -12.8557 -12.8557 -12.8557 -12.8557 -11.7830 -11.7830 -11.7830 -11.7830 -11.4911 -11.4911 -11.4911 -11.4911 -0.2655 -0.2655 -0.2655 -0.2655 -0.1001 -0.1001 -0.1001 -0.1001 0.1896 0.1896 0.1896 0.1896 0.3069 0.3069 0.3069 0.3069 0.9466 0.9466 0.9466 0.9466 1.3183 1.3183 1.3183 1.3183 2.0564 2.0564 2.0564 2.0564 2.0870 2.0870 2.0870 2.0870 2.3761 2.3761 2.3761 2.3761 2.7582 2.7582 2.7582 2.7582 3.2286 3.2286 3.2286 3.2286 3.8129 3.8129 3.8129 3.8129 4.3387 4.3387 4.3387 4.3387 4.5559 4.5559 4.5559 4.5559 4.8700 4.8700 4.8700 4.8700 4.9095 4.9095 4.9095 4.9095 5.1439 5.1439 5.1439 5.1439 5.2177 5.2177 5.2177 5.2177 6.1905 6.1905 6.1905 6.1905 6.2587 6.2587 6.2587 6.2587 k = 0.3654 0.3282 0.1518 ( 5100 PWs) bands (ev): -12.8766 -12.8766 -12.8766 -12.8766 -12.8618 -12.8618 -12.8618 -12.8618 -11.7973 -11.7973 -11.7973 -11.7973 -11.4858 -11.4858 -11.4858 -11.4858 -0.2622 -0.2622 -0.2622 -0.2622 -0.0860 -0.0860 -0.0860 -0.0860 0.1883 0.1883 0.1883 0.1883 0.3061 0.3061 0.3061 0.3061 0.9526 0.9526 0.9526 0.9526 1.3294 1.3294 1.3294 1.3294 2.0605 2.0605 2.0605 2.0605 2.0817 2.0817 2.0817 2.0817 2.3992 2.3992 2.3992 2.3992 2.7783 2.7783 2.7783 2.7783 3.1943 3.1943 3.1943 3.1943 3.8135 3.8135 3.8135 3.8135 4.3413 4.3413 4.3413 4.3413 4.5618 4.5618 4.5618 4.5618 4.8753 4.8753 4.8753 4.8753 4.9188 4.9188 4.9188 4.9188 5.1449 5.1449 5.1449 5.1449 5.2280 5.2280 5.2280 5.2280 6.1891 6.1891 6.1891 6.1891 6.2597 6.2597 6.2597 6.2597 k = 0.3558 0.3282 0.1518 ( 5100 PWs) bands (ev): -12.8847 -12.8847 -12.8847 -12.8847 -12.8681 -12.8681 -12.8681 -12.8681 -11.8115 -11.8115 -11.8115 -11.8115 -11.4811 -11.4811 -11.4811 -11.4811 -0.2598 -0.2598 -0.2598 -0.2598 -0.0736 -0.0736 -0.0736 -0.0736 0.1891 0.1891 0.1891 0.1891 0.3057 0.3057 0.3057 0.3057 0.9614 0.9614 0.9614 0.9614 1.3382 1.3382 1.3382 1.3382 2.0647 2.0647 2.0647 2.0647 2.0793 2.0793 2.0793 2.0793 2.4238 2.4238 2.4238 2.4238 2.7971 2.7971 2.7971 2.7971 3.1611 3.1611 3.1611 3.1611 3.8137 3.8137 3.8137 3.8137 4.3443 4.3443 4.3443 4.3443 4.5669 4.5669 4.5669 4.5669 4.8796 4.8796 4.8796 4.8796 4.9274 4.9274 4.9274 4.9274 5.1459 5.1459 5.1459 5.1459 5.2392 5.2392 5.2392 5.2392 6.1887 6.1887 6.1887 6.1887 6.2612 6.2612 6.2612 6.2612 k = 0.3462 0.3282 0.1518 ( 5100 PWs) bands (ev): -12.8933 -12.8933 -12.8933 -12.8933 -12.8748 -12.8748 -12.8748 -12.8748 -11.8256 -11.8256 -11.8256 -11.8256 -11.4768 -11.4768 -11.4768 -11.4768 -0.2586 -0.2586 -0.2586 -0.2586 -0.0633 -0.0633 -0.0633 -0.0633 0.1924 0.1924 0.1924 0.1924 0.3059 0.3059 0.3059 0.3059 0.9729 0.9729 0.9729 0.9729 1.3445 1.3445 1.3445 1.3445 2.0685 2.0685 2.0685 2.0685 2.0806 2.0806 2.0806 2.0806 2.4495 2.4495 2.4495 2.4495 2.8147 2.8147 2.8147 2.8147 3.1290 3.1290 3.1290 3.1290 3.8139 3.8139 3.8139 3.8139 4.3474 4.3474 4.3474 4.3474 4.5711 4.5711 4.5711 4.5711 4.8828 4.8828 4.8828 4.8828 4.9352 4.9352 4.9352 4.9352 5.1468 5.1468 5.1468 5.1468 5.2512 5.2512 5.2512 5.2512 6.1896 6.1896 6.1896 6.1896 6.2632 6.2632 6.2632 6.2632 k = 0.3365 0.3282 0.1518 ( 5100 PWs) bands (ev): -12.9023 -12.9023 -12.9023 -12.9023 -12.8817 -12.8817 -12.8817 -12.8817 -11.8396 -11.8396 -11.8396 -11.8396 -11.4730 -11.4730 -11.4730 -11.4730 -0.2587 -0.2587 -0.2587 -0.2587 -0.0554 -0.0554 -0.0554 -0.0554 0.1982 0.1982 0.1982 0.1982 0.3069 0.3069 0.3069 0.3069 0.9872 0.9872 0.9872 0.9872 1.3483 1.3483 1.3483 1.3483 2.0727 2.0727 2.0727 2.0727 2.0850 2.0850 2.0850 2.0850 2.4759 2.4759 2.4759 2.4759 2.8308 2.8308 2.8308 2.8308 3.0985 3.0985 3.0985 3.0985 3.8142 3.8142 3.8142 3.8142 4.3506 4.3506 4.3506 4.3506 4.5745 4.5745 4.5745 4.5745 4.8848 4.8848 4.8848 4.8848 4.9421 4.9421 4.9421 4.9421 5.1478 5.1478 5.1478 5.1478 5.2639 5.2639 5.2639 5.2639 6.1917 6.1917 6.1917 6.1917 6.2661 6.2661 6.2661 6.2661 k = 0.3269 0.3282 0.1518 ( 5092 PWs) bands (ev): -12.9118 -12.9118 -12.9118 -12.9118 -12.8889 -12.8889 -12.8889 -12.8889 -11.8534 -11.8534 -11.8534 -11.8534 -11.4696 -11.4696 -11.4696 -11.4696 -0.2605 -0.2605 -0.2605 -0.2605 -0.0499 -0.0499 -0.0499 -0.0499 0.2067 0.2067 0.2067 0.2067 0.3090 0.3090 0.3090 0.3090 1.0043 1.0043 1.0043 1.0043 1.3496 1.3496 1.3496 1.3496 2.0782 2.0782 2.0782 2.0782 2.0912 2.0912 2.0912 2.0912 2.5029 2.5029 2.5029 2.5029 2.8455 2.8455 2.8455 2.8455 3.0699 3.0699 3.0699 3.0699 3.8149 3.8149 3.8149 3.8149 4.3538 4.3538 4.3538 4.3538 4.5771 4.5771 4.5771 4.5771 4.8856 4.8856 4.8856 4.8856 4.9478 4.9478 4.9478 4.9478 5.1487 5.1487 5.1487 5.1487 5.2772 5.2772 5.2772 5.2772 6.1954 6.1954 6.1954 6.1954 6.2699 6.2699 6.2699 6.2699 k = 0.3173 0.3282 0.1518 ( 5084 PWs) bands (ev): -12.9216 -12.9216 -12.9216 -12.9216 -12.8963 -12.8963 -12.8963 -12.8963 -11.8669 -11.8669 -11.8669 -11.8669 -11.4667 -11.4667 -11.4667 -11.4667 -0.2640 -0.2640 -0.2640 -0.2640 -0.0469 -0.0469 -0.0469 -0.0469 0.2176 0.2176 0.2176 0.2176 0.3125 0.3125 0.3125 0.3125 1.0242 1.0242 1.0242 1.0242 1.3484 1.3484 1.3484 1.3484 2.0857 2.0857 2.0857 2.0857 2.0988 2.0988 2.0988 2.0988 2.5300 2.5300 2.5300 2.5300 2.8587 2.8587 2.8587 2.8587 3.0436 3.0436 3.0436 3.0436 3.8160 3.8160 3.8160 3.8160 4.3568 4.3568 4.3568 4.3568 4.5790 4.5790 4.5790 4.5790 4.8850 4.8850 4.8850 4.8850 4.9524 4.9524 4.9524 4.9524 5.1496 5.1496 5.1496 5.1496 5.2909 5.2909 5.2909 5.2909 6.2005 6.2005 6.2005 6.2005 6.2747 6.2747 6.2747 6.2747 k = 0.3077 0.3282 0.1518 ( 5076 PWs) bands (ev): -12.9317 -12.9317 -12.9317 -12.9317 -12.9039 -12.9039 -12.9039 -12.9039 -11.8802 -11.8802 -11.8802 -11.8802 -11.4642 -11.4642 -11.4642 -11.4642 -0.2694 -0.2694 -0.2694 -0.2694 -0.0462 -0.0462 -0.0462 -0.0462 0.2307 0.2307 0.2307 0.2307 0.3174 0.3174 0.3174 0.3174 1.0466 1.0466 1.0466 1.0466 1.3448 1.3448 1.3448 1.3448 2.0947 2.0947 2.0947 2.0947 2.1078 2.1078 2.1078 2.1078 2.5569 2.5569 2.5569 2.5569 2.8704 2.8704 2.8704 2.8704 3.0201 3.0201 3.0201 3.0201 3.8177 3.8177 3.8177 3.8177 4.3597 4.3597 4.3597 4.3597 4.5801 4.5801 4.5801 4.5801 4.8829 4.8829 4.8829 4.8829 4.9558 4.9558 4.9558 4.9558 5.1504 5.1504 5.1504 5.1504 5.3049 5.3049 5.3049 5.3049 6.2072 6.2072 6.2072 6.2072 6.2807 6.2807 6.2807 6.2807 k = 0.2981 0.3282 0.1518 ( 5072 PWs) bands (ev): -12.9421 -12.9421 -12.9421 -12.9421 -12.9116 -12.9116 -12.9116 -12.9116 -11.8933 -11.8933 -11.8933 -11.8933 -11.4620 -11.4620 -11.4620 -11.4620 -0.2767 -0.2767 -0.2767 -0.2767 -0.0475 -0.0475 -0.0475 -0.0475 0.2456 0.2456 0.2456 0.2456 0.3239 0.3239 0.3239 0.3239 1.0715 1.0715 1.0715 1.0715 1.3392 1.3392 1.3392 1.3392 2.1042 2.1042 2.1042 2.1042 2.1186 2.1186 2.1186 2.1186 2.5832 2.5832 2.5832 2.5832 2.8803 2.8803 2.8803 2.8803 3.0000 3.0000 3.0000 3.0000 3.8200 3.8200 3.8200 3.8200 4.3623 4.3623 4.3623 4.3623 4.5806 4.5806 4.5806 4.5806 4.8794 4.8794 4.8794 4.8794 4.9579 4.9579 4.9579 4.9579 5.1509 5.1509 5.1509 5.1509 5.3191 5.3191 5.3191 5.3191 6.2155 6.2155 6.2155 6.2155 6.2879 6.2879 6.2879 6.2879 k = 0.2885 0.3282 0.1518 ( 5072 PWs) bands (ev): -12.9528 -12.9528 -12.9528 -12.9528 -12.9195 -12.9195 -12.9195 -12.9195 -11.9060 -11.9060 -11.9060 -11.9060 -11.4603 -11.4603 -11.4603 -11.4603 -0.2859 -0.2859 -0.2859 -0.2859 -0.0504 -0.0504 -0.0504 -0.0504 0.2618 0.2618 0.2618 0.2618 0.3320 0.3320 0.3320 0.3320 1.0988 1.0988 1.0988 1.0988 1.3317 1.3317 1.3317 1.3317 2.1135 2.1135 2.1135 2.1135 2.1317 2.1317 2.1317 2.1317 2.6085 2.6085 2.6085 2.6085 2.8885 2.8885 2.8885 2.8885 2.9840 2.9840 2.9840 2.9840 3.8231 3.8231 3.8231 3.8231 4.3647 4.3647 4.3647 4.3647 4.5803 4.5803 4.5803 4.5803 4.8745 4.8745 4.8745 4.8745 4.9588 4.9588 4.9588 4.9588 5.1513 5.1513 5.1513 5.1513 5.3332 5.3332 5.3332 5.3332 6.2253 6.2253 6.2253 6.2253 6.2966 6.2966 6.2966 6.2966 k = 0.2788 0.3282 0.1518 ( 5072 PWs) bands (ev): -12.9637 -12.9637 -12.9637 -12.9637 -12.9275 -12.9275 -12.9275 -12.9275 -11.9184 -11.9184 -11.9184 -11.9184 -11.4589 -11.4589 -11.4589 -11.4589 -0.2969 -0.2969 -0.2969 -0.2969 -0.0547 -0.0547 -0.0547 -0.0547 0.2791 0.2791 0.2791 0.2791 0.3418 0.3418 0.3418 0.3418 1.1282 1.1282 1.1282 1.1282 1.3225 1.3225 1.3225 1.3225 2.1224 2.1224 2.1224 2.1224 2.1465 2.1465 2.1465 2.1465 2.6324 2.6324 2.6324 2.6324 2.8950 2.8950 2.8950 2.8950 2.9726 2.9726 2.9726 2.9726 3.8270 3.8270 3.8270 3.8270 4.3667 4.3667 4.3667 4.3667 4.5793 4.5793 4.5793 4.5793 4.8682 4.8682 4.8682 4.8682 4.9586 4.9586 4.9586 4.9586 5.1514 5.1514 5.1514 5.1514 5.3471 5.3471 5.3471 5.3471 6.2366 6.2366 6.2366 6.2366 6.3068 6.3068 6.3068 6.3068 k = 0.2692 0.3282 0.1518 ( 5080 PWs) bands (ev): -12.9748 -12.9748 -12.9748 -12.9748 -12.9355 -12.9355 -12.9355 -12.9355 -11.9305 -11.9305 -11.9305 -11.9305 -11.4578 -11.4578 -11.4578 -11.4578 -0.3096 -0.3096 -0.3096 -0.3096 -0.0601 -0.0601 -0.0601 -0.0601 0.2972 0.2972 0.2972 0.2972 0.3532 0.3532 0.3532 0.3532 1.1595 1.1595 1.1595 1.1595 1.3119 1.3119 1.3119 1.3119 2.1312 2.1312 2.1312 2.1312 2.1622 2.1622 2.1622 2.1622 2.6546 2.6546 2.6546 2.6546 2.8996 2.8996 2.8996 2.8996 2.9665 2.9665 2.9665 2.9665 3.8318 3.8318 3.8318 3.8318 4.3684 4.3684 4.3684 4.3684 4.5776 4.5776 4.5776 4.5776 4.8605 4.8605 4.8605 4.8605 4.9571 4.9571 4.9571 4.9571 5.1513 5.1513 5.1513 5.1513 5.3607 5.3607 5.3607 5.3607 6.2494 6.2494 6.2494 6.2494 6.3185 6.3185 6.3185 6.3185 k = 0.2596 0.3282 0.1518 ( 5076 PWs) bands (ev): -12.9860 -12.9860 -12.9860 -12.9860 -12.9437 -12.9437 -12.9437 -12.9437 -11.9423 -11.9423 -11.9423 -11.9423 -11.4570 -11.4570 -11.4570 -11.4570 -0.3239 -0.3239 -0.3239 -0.3239 -0.0665 -0.0665 -0.0665 -0.0665 0.3157 0.3157 0.3157 0.3157 0.3662 0.3662 0.3662 0.3662 1.1923 1.1923 1.1923 1.1923 1.3000 1.3000 1.3000 1.3000 2.1401 2.1401 2.1401 2.1401 2.1778 2.1778 2.1778 2.1778 2.6754 2.6754 2.6754 2.6754 2.9024 2.9024 2.9024 2.9024 2.9662 2.9662 2.9662 2.9662 3.8374 3.8374 3.8374 3.8374 4.3699 4.3699 4.3699 4.3699 4.5753 4.5753 4.5753 4.5753 4.8516 4.8516 4.8516 4.8516 4.9545 4.9545 4.9545 4.9545 5.1508 5.1508 5.1508 5.1508 5.3739 5.3739 5.3739 5.3739 6.2634 6.2634 6.2634 6.2634 6.3318 6.3318 6.3318 6.3318 k = 0.2500 0.3282 0.1518 ( 5064 PWs) bands (ev): -12.9973 -12.9973 -12.9973 -12.9973 -12.9518 -12.9518 -12.9518 -12.9518 -11.9536 -11.9536 -11.9536 -11.9536 -11.4565 -11.4565 -11.4565 -11.4565 -0.3394 -0.3394 -0.3394 -0.3394 -0.0735 -0.0735 -0.0735 -0.0735 0.3346 0.3346 0.3346 0.3346 0.3808 0.3808 0.3808 0.3808 1.2263 1.2263 1.2263 1.2263 1.2873 1.2873 1.2873 1.2873 2.1493 2.1493 2.1493 2.1493 2.1923 2.1923 2.1923 2.1923 2.6951 2.6951 2.6951 2.6951 2.9032 2.9032 2.9032 2.9032 2.9716 2.9716 2.9716 2.9716 3.8438 3.8438 3.8438 3.8438 4.3710 4.3710 4.3710 4.3710 4.5723 4.5723 4.5723 4.5723 4.8417 4.8417 4.8417 4.8417 4.9507 4.9507 4.9507 4.9507 5.1499 5.1499 5.1499 5.1499 5.3866 5.3866 5.3866 5.3866 6.2787 6.2787 6.2787 6.2787 6.3468 6.3468 6.3468 6.3468 k = 0.2404 0.3282 0.1518 ( 5072 PWs) bands (ev): -13.0087 -13.0087 -13.0087 -13.0087 -12.9599 -12.9599 -12.9599 -12.9599 -11.9646 -11.9646 -11.9646 -11.9646 -11.4562 -11.4562 -11.4562 -11.4562 -0.3561 -0.3561 -0.3561 -0.3561 -0.0812 -0.0812 -0.0812 -0.0812 0.3537 0.3537 0.3537 0.3537 0.3968 0.3968 0.3968 0.3968 1.2603 1.2603 1.2603 1.2603 1.2746 1.2746 1.2746 1.2746 2.1590 2.1590 2.1590 2.1590 2.2048 2.2048 2.2048 2.2048 2.7147 2.7147 2.7147 2.7147 2.9021 2.9021 2.9021 2.9021 2.9824 2.9824 2.9824 2.9824 3.8511 3.8511 3.8511 3.8511 4.3718 4.3718 4.3718 4.3718 4.5686 4.5686 4.5686 4.5686 4.8307 4.8307 4.8307 4.8307 4.9458 4.9458 4.9458 4.9458 5.1486 5.1486 5.1486 5.1486 5.3986 5.3986 5.3986 5.3986 6.2948 6.2948 6.2948 6.2948 6.3633 6.3633 6.3633 6.3633 k = 0.2308 0.3282 0.1518 ( 5076 PWs) bands (ev): -13.0201 -13.0201 -13.0201 -13.0201 -12.9680 -12.9680 -12.9680 -12.9680 -11.9752 -11.9752 -11.9752 -11.9752 -11.4562 -11.4562 -11.4562 -11.4562 -0.3737 -0.3737 -0.3737 -0.3737 -0.0893 -0.0893 -0.0893 -0.0893 0.3729 0.3729 0.3729 0.3729 0.4141 0.4141 0.4141 0.4141 1.2584 1.2584 1.2584 1.2584 1.2975 1.2975 1.2975 1.2975 2.1694 2.1694 2.1694 2.1694 2.2147 2.2147 2.2147 2.2147 2.7353 2.7353 2.7353 2.7353 2.8990 2.8990 2.8990 2.8990 2.9980 2.9980 2.9980 2.9980 3.8592 3.8592 3.8592 3.8592 4.3723 4.3723 4.3723 4.3723 4.5643 4.5643 4.5643 4.5643 4.8189 4.8189 4.8189 4.8189 4.9398 4.9398 4.9398 4.9398 5.1469 5.1469 5.1469 5.1469 5.4100 5.4100 5.4100 5.4100 6.3117 6.3117 6.3117 6.3117 6.3815 6.3815 6.3815 6.3815 k = 0.2212 0.3282 0.1518 ( 5076 PWs) bands (ev): -13.0314 -13.0314 -13.0314 -13.0314 -12.9760 -12.9760 -12.9760 -12.9760 -11.9854 -11.9854 -11.9854 -11.9854 -11.4564 -11.4564 -11.4564 -11.4564 -0.3919 -0.3919 -0.3919 -0.3919 -0.0979 -0.0979 -0.0979 -0.0979 0.3922 0.3922 0.3922 0.3922 0.4327 0.4327 0.4327 0.4327 1.2436 1.2436 1.2436 1.2436 1.3328 1.3328 1.3328 1.3328 2.1808 2.1808 2.1808 2.1808 2.2213 2.2213 2.2213 2.2213 2.7579 2.7579 2.7579 2.7579 2.8939 2.8939 2.8939 2.8939 3.0173 3.0173 3.0173 3.0173 3.8680 3.8680 3.8680 3.8680 4.3725 4.3725 4.3725 4.3725 4.5593 4.5593 4.5593 4.5593 4.8063 4.8063 4.8063 4.8063 4.9327 4.9327 4.9327 4.9327 5.1447 5.1447 5.1447 5.1447 5.4207 5.4207 5.4207 5.4207 6.3291 6.3291 6.3291 6.3291 6.4012 6.4012 6.4012 6.4012 k = 0.2115 0.3282 0.1518 ( 5080 PWs) bands (ev): -13.0427 -13.0427 -13.0427 -13.0427 -12.9840 -12.9840 -12.9840 -12.9840 -11.9952 -11.9952 -11.9952 -11.9952 -11.4568 -11.4568 -11.4568 -11.4568 -0.4107 -0.4107 -0.4107 -0.4107 -0.1067 -0.1067 -0.1067 -0.1067 0.4115 0.4115 0.4115 0.4115 0.4524 0.4524 0.4524 0.4524 1.2282 1.2282 1.2282 1.2282 1.3678 1.3678 1.3678 1.3678 2.1932 2.1932 2.1932 2.1932 2.2244 2.2244 2.2244 2.2244 2.7833 2.7833 2.7833 2.7833 2.8870 2.8870 2.8870 2.8870 3.0396 3.0396 3.0396 3.0396 3.8774 3.8774 3.8774 3.8774 4.3724 4.3724 4.3724 4.3724 4.5538 4.5538 4.5538 4.5538 4.7932 4.7932 4.7932 4.7932 4.9246 4.9246 4.9246 4.9246 5.1420 5.1420 5.1420 5.1420 5.4306 5.4306 5.4306 5.4306 6.3466 6.3466 6.3466 6.3466 6.4224 6.4224 6.4224 6.4224 k = 0.2019 0.3282 0.1518 ( 5072 PWs) bands (ev): -13.0538 -13.0538 -13.0538 -13.0538 -12.9918 -12.9918 -12.9918 -12.9918 -12.0046 -12.0046 -12.0046 -12.0046 -11.4573 -11.4573 -11.4573 -11.4573 -0.4298 -0.4298 -0.4298 -0.4298 -0.1158 -0.1158 -0.1158 -0.1158 0.4308 0.4308 0.4308 0.4308 0.4732 0.4732 0.4732 0.4732 1.2124 1.2124 1.2124 1.2124 1.4020 1.4020 1.4020 1.4020 2.2068 2.2068 2.2068 2.2068 2.2244 2.2244 2.2244 2.2244 2.8116 2.8116 2.8116 2.8116 2.8785 2.8785 2.8785 2.8785 3.0643 3.0643 3.0643 3.0643 3.8873 3.8873 3.8873 3.8873 4.3721 4.3721 4.3721 4.3721 4.5477 4.5477 4.5477 4.5477 4.7797 4.7797 4.7797 4.7797 4.9154 4.9154 4.9154 4.9154 5.1387 5.1387 5.1387 5.1387 5.4399 5.4399 5.4399 5.4399 6.3641 6.3641 6.3641 6.3641 6.4450 6.4450 6.4450 6.4450 k = 0.1923 0.3282 0.1518 ( 5068 PWs) bands (ev): -13.0647 -13.0647 -13.0647 -13.0647 -12.9994 -12.9994 -12.9994 -12.9994 -12.0136 -12.0136 -12.0136 -12.0136 -11.4580 -11.4580 -11.4580 -11.4580 -0.4490 -0.4490 -0.4490 -0.4490 -0.1250 -0.1250 -0.1250 -0.1250 0.4502 0.4502 0.4502 0.4502 0.4949 0.4949 0.4949 0.4949 1.1963 1.1963 1.1963 1.1963 1.4348 1.4348 1.4348 1.4348 2.2176 2.2176 2.2176 2.2176 2.2258 2.2258 2.2258 2.2258 2.8417 2.8417 2.8417 2.8417 2.8694 2.8694 2.8694 2.8694 3.0908 3.0908 3.0908 3.0908 3.8975 3.8975 3.8975 3.8975 4.3715 4.3715 4.3715 4.3715 4.5412 4.5412 4.5412 4.5412 4.7661 4.7661 4.7661 4.7661 4.9051 4.9051 4.9051 4.9051 5.1349 5.1349 5.1349 5.1349 5.4484 5.4484 5.4484 5.4484 6.3811 6.3811 6.3811 6.3811 6.4689 6.4689 6.4689 6.4689 k = 0.1827 0.3282 0.1518 ( 5076 PWs) bands (ev): -13.0754 -13.0754 -13.0754 -13.0754 -13.0069 -13.0069 -13.0069 -13.0069 -12.0221 -12.0221 -12.0221 -12.0221 -11.4588 -11.4588 -11.4588 -11.4588 -0.4681 -0.4681 -0.4681 -0.4681 -0.1343 -0.1343 -0.1343 -0.1343 0.4697 0.4697 0.4697 0.4697 0.5174 0.5174 0.5174 0.5174 1.1799 1.1799 1.1799 1.1799 1.4657 1.4657 1.4657 1.4657 2.2132 2.2132 2.2132 2.2132 2.2415 2.2415 2.2415 2.2415 2.8523 2.8523 2.8523 2.8523 2.8806 2.8806 2.8806 2.8806 3.1189 3.1189 3.1189 3.1189 3.9078 3.9078 3.9078 3.9078 4.3708 4.3708 4.3708 4.3708 4.5341 4.5341 4.5341 4.5341 4.7524 4.7524 4.7524 4.7524 4.8936 4.8936 4.8936 4.8936 5.1305 5.1305 5.1305 5.1305 5.4562 5.4562 5.4562 5.4562 6.3974 6.3974 6.3974 6.3974 6.4939 6.4939 6.4939 6.4939 k = 0.1731 0.3282 0.1518 ( 5064 PWs) bands (ev): -13.0859 -13.0859 -13.0859 -13.0859 -13.0141 -13.0141 -13.0141 -13.0141 -12.0302 -12.0302 -12.0302 -12.0302 -11.4597 -11.4597 -11.4597 -11.4597 -0.4871 -0.4871 -0.4871 -0.4871 -0.1436 -0.1436 -0.1436 -0.1436 0.4892 0.4892 0.4892 0.4892 0.5406 0.5406 0.5406 0.5406 1.1634 1.1634 1.1634 1.1634 1.4943 1.4943 1.4943 1.4943 2.2049 2.2049 2.2049 2.2049 2.2611 2.2611 2.2611 2.2611 2.8403 2.8403 2.8403 2.8403 2.9149 2.9149 2.9149 2.9149 3.1485 3.1485 3.1485 3.1485 3.9179 3.9179 3.9179 3.9179 4.3701 4.3701 4.3701 4.3701 4.5268 4.5268 4.5268 4.5268 4.7390 4.7390 4.7390 4.7390 4.8811 4.8811 4.8811 4.8811 5.1255 5.1255 5.1255 5.1255 5.4633 5.4633 5.4633 5.4633 6.4128 6.4128 6.4128 6.4128 6.5200 6.5200 6.5200 6.5200 k = 0.1635 0.3282 0.1518 ( 5060 PWs) bands (ev): -13.0960 -13.0960 -13.0960 -13.0960 -13.0212 -13.0212 -13.0212 -13.0212 -12.0378 -12.0378 -12.0378 -12.0378 -11.4606 -11.4606 -11.4606 -11.4606 -0.5057 -0.5057 -0.5057 -0.5057 -0.1528 -0.1528 -0.1528 -0.1528 0.5087 0.5087 0.5087 0.5087 0.5644 0.5644 0.5644 0.5644 1.1467 1.1467 1.1467 1.1467 1.5202 1.5202 1.5202 1.5202 2.1947 2.1947 2.1947 2.1947 2.2830 2.2830 2.2830 2.2830 2.8258 2.8258 2.8258 2.8258 2.9512 2.9512 2.9512 2.9512 3.1797 3.1797 3.1797 3.1797 3.9276 3.9276 3.9276 3.9276 4.3692 4.3692 4.3692 4.3692 4.5193 4.5193 4.5193 4.5193 4.7260 4.7260 4.7260 4.7260 4.8674 4.8674 4.8674 4.8674 5.1199 5.1199 5.1199 5.1199 5.4697 5.4697 5.4697 5.4697 6.4270 6.4270 6.4270 6.4270 6.5470 6.5470 6.5470 6.5470 k = 0.1538 0.3282 0.1518 ( 5056 PWs) bands (ev): -13.1058 -13.1058 -13.1058 -13.1058 -13.0279 -13.0279 -13.0279 -13.0279 -12.0451 -12.0451 -12.0451 -12.0451 -11.4617 -11.4617 -11.4617 -11.4617 -0.5239 -0.5239 -0.5239 -0.5239 -0.1620 -0.1620 -0.1620 -0.1620 0.5283 0.5283 0.5283 0.5283 0.5887 0.5887 0.5887 0.5887 1.1299 1.1299 1.1299 1.1299 1.5431 1.5431 1.5431 1.5431 2.1832 2.1832 2.1832 2.1832 2.3073 2.3073 2.3073 2.3073 2.8102 2.8102 2.8102 2.8102 2.9875 2.9875 2.9875 2.9875 3.2127 3.2127 3.2127 3.2127 3.9365 3.9365 3.9365 3.9365 4.3685 4.3685 4.3685 4.3685 4.5116 4.5116 4.5116 4.5116 4.7135 4.7135 4.7135 4.7135 4.8526 4.8526 4.8526 4.8526 5.1136 5.1136 5.1136 5.1136 5.4754 5.4754 5.4754 5.4754 6.4399 6.4399 6.4399 6.4399 6.5746 6.5746 6.5746 6.5746 k = 0.1442 0.3282 0.1518 ( 5064 PWs) bands (ev): -13.1153 -13.1153 -13.1153 -13.1153 -13.0344 -13.0344 -13.0344 -13.0344 -12.0519 -12.0519 -12.0519 -12.0519 -11.4627 -11.4627 -11.4627 -11.4627 -0.5415 -0.5415 -0.5415 -0.5415 -0.1710 -0.1710 -0.1710 -0.1710 0.5480 0.5480 0.5480 0.5480 0.6133 0.6133 0.6133 0.6133 1.1130 1.1130 1.1130 1.1130 1.5630 1.5630 1.5630 1.5630 2.1709 2.1709 2.1709 2.1709 2.3337 2.3337 2.3337 2.3337 2.7939 2.7939 2.7939 2.7939 3.0227 3.0227 3.0227 3.0227 3.2476 3.2476 3.2476 3.2476 3.9444 3.9444 3.9444 3.9444 4.3679 4.3679 4.3679 4.3679 4.5039 4.5039 4.5039 4.5039 4.7019 4.7019 4.7019 4.7019 4.8367 4.8367 4.8367 4.8367 5.1067 5.1067 5.1067 5.1067 5.4806 5.4806 5.4806 5.4806 6.4513 6.4513 6.4513 6.4513 6.6028 6.6028 6.6028 6.6028 k = 0.1346 0.3282 0.1518 ( 5060 PWs) bands (ev): -13.1243 -13.1243 -13.1243 -13.1243 -13.0406 -13.0406 -13.0406 -13.0406 -12.0582 -12.0582 -12.0582 -12.0582 -11.4638 -11.4638 -11.4638 -11.4638 -0.5585 -0.5585 -0.5585 -0.5585 -0.1797 -0.1797 -0.1797 -0.1797 0.5677 0.5677 0.5677 0.5677 0.6380 0.6380 0.6380 0.6380 1.0960 1.0960 1.0960 1.0960 1.5797 1.5797 1.5797 1.5797 2.1581 2.1581 2.1581 2.1581 2.3621 2.3621 2.3621 2.3621 2.7771 2.7771 2.7771 2.7771 3.0561 3.0561 3.0561 3.0561 3.2848 3.2848 3.2848 3.2848 3.9509 3.9509 3.9509 3.9509 4.3678 4.3678 4.3678 4.3678 4.4962 4.4962 4.4962 4.4962 4.6911 4.6911 4.6911 4.6911 4.8198 4.8198 4.8198 4.8198 5.0993 5.0993 5.0993 5.0993 5.4852 5.4852 5.4852 5.4852 6.4613 6.4613 6.4613 6.4613 6.6313 6.6313 6.6313 6.6313 k = 0.1250 0.3282 0.1518 ( 5068 PWs) bands (ev): -13.1328 -13.1328 -13.1328 -13.1328 -13.0465 -13.0465 -13.0465 -13.0465 -12.0642 -12.0642 -12.0642 -12.0642 -11.4649 -11.4649 -11.4649 -11.4649 -0.5746 -0.5746 -0.5746 -0.5746 -0.1882 -0.1882 -0.1882 -0.1882 0.5875 0.5875 0.5875 0.5875 0.6627 0.6627 0.6627 0.6627 1.0789 1.0789 1.0789 1.0789 1.5932 1.5932 1.5932 1.5932 2.1451 2.1451 2.1451 2.1451 2.3919 2.3919 2.3919 2.3919 2.7603 2.7603 2.7603 2.7603 3.0868 3.0868 3.0868 3.0868 3.3240 3.3240 3.3240 3.3240 3.9558 3.9558 3.9558 3.9558 4.3680 4.3680 4.3680 4.3680 4.4888 4.4888 4.4888 4.4888 4.6814 4.6814 4.6814 4.6814 4.8018 4.8018 4.8018 4.8018 5.0912 5.0912 5.0912 5.0912 5.4893 5.4893 5.4893 5.4893 6.4699 6.4699 6.4699 6.4699 6.6599 6.6599 6.6599 6.6599 k = 0.1154 0.3282 0.1518 ( 5072 PWs) bands (ev): -13.1408 -13.1408 -13.1408 -13.1408 -13.0520 -13.0520 -13.0520 -13.0520 -12.0696 -12.0696 -12.0696 -12.0696 -11.4659 -11.4659 -11.4659 -11.4659 -0.5899 -0.5899 -0.5899 -0.5899 -0.1963 -0.1963 -0.1963 -0.1963 0.6074 0.6074 0.6074 0.6074 0.6871 0.6871 0.6871 0.6871 1.0617 1.0617 1.0617 1.0617 1.6038 1.6038 1.6038 1.6038 2.1323 2.1323 2.1323 2.1323 2.4227 2.4227 2.4227 2.4227 2.7439 2.7439 2.7439 2.7439 3.1146 3.1146 3.1146 3.1146 3.3651 3.3651 3.3651 3.3651 3.9587 3.9587 3.9587 3.9587 4.3688 4.3688 4.3688 4.3688 4.4818 4.4818 4.4818 4.4818 4.6728 4.6728 4.6728 4.6728 4.7828 4.7828 4.7828 4.7828 5.0828 5.0828 5.0828 5.0828 5.4929 5.4929 5.4929 5.4929 6.4772 6.4772 6.4772 6.4772 6.6885 6.6885 6.6885 6.6885 k = 0.1058 0.3282 0.1518 ( 5080 PWs) bands (ev): -13.1484 -13.1484 -13.1484 -13.1484 -13.0572 -13.0572 -13.0572 -13.0572 -12.0747 -12.0747 -12.0747 -12.0747 -11.4670 -11.4670 -11.4670 -11.4670 -0.6042 -0.6042 -0.6042 -0.6042 -0.2039 -0.2039 -0.2039 -0.2039 0.6273 0.6273 0.6273 0.6273 0.7111 0.7111 0.7111 0.7111 1.0445 1.0445 1.0445 1.0445 1.6117 1.6117 1.6117 1.6117 2.1197 2.1197 2.1197 2.1197 2.4537 2.4537 2.4537 2.4537 2.7282 2.7282 2.7282 2.7282 3.1395 3.1395 3.1395 3.1395 3.4075 3.4075 3.4075 3.4075 3.9596 3.9596 3.9596 3.9596 4.3703 4.3703 4.3703 4.3703 4.4753 4.4753 4.4753 4.4753 4.6653 4.6653 4.6653 4.6653 4.7631 4.7631 4.7631 4.7631 5.0739 5.0739 5.0739 5.0739 5.4960 5.4960 5.4960 5.4960 6.4832 6.4832 6.4832 6.4832 6.7169 6.7169 6.7169 6.7169 k = 0.0962 0.3282 0.1518 ( 5084 PWs) bands (ev): -13.1553 -13.1553 -13.1553 -13.1553 -13.0619 -13.0619 -13.0619 -13.0619 -12.0793 -12.0793 -12.0793 -12.0793 -11.4680 -11.4680 -11.4680 -11.4680 -0.6175 -0.6175 -0.6175 -0.6175 -0.2111 -0.2111 -0.2111 -0.2111 0.6472 0.6472 0.6472 0.6472 0.7345 0.7345 0.7345 0.7345 1.0272 1.0272 1.0272 1.0272 1.6172 1.6172 1.6172 1.6172 2.1077 2.1077 2.1077 2.1077 2.4841 2.4841 2.4841 2.4841 2.7139 2.7139 2.7139 2.7139 3.1614 3.1614 3.1614 3.1614 3.4505 3.4505 3.4505 3.4505 3.9586 3.9586 3.9586 3.9586 4.3724 4.3724 4.3724 4.3724 4.4695 4.4695 4.4695 4.4695 4.6589 4.6589 4.6589 4.6589 4.7428 4.7428 4.7428 4.7428 5.0647 5.0647 5.0647 5.0647 5.4988 5.4988 5.4988 5.4988 6.4882 6.4882 6.4882 6.4882 6.7447 6.7447 6.7447 6.7447 k = 0.0865 0.3282 0.1518 ( 5084 PWs) bands (ev): -13.1617 -13.1617 -13.1617 -13.1617 -13.0663 -13.0663 -13.0663 -13.0663 -12.0834 -12.0834 -12.0834 -12.0834 -11.4689 -11.4689 -11.4689 -11.4689 -0.6297 -0.6297 -0.6297 -0.6297 -0.2178 -0.2178 -0.2178 -0.2178 0.6671 0.6671 0.6671 0.6671 0.7570 0.7570 0.7570 0.7570 1.0098 1.0098 1.0098 1.0098 1.6206 1.6206 1.6206 1.6206 2.0964 2.0964 2.0964 2.0964 2.5127 2.5127 2.5127 2.5127 2.7018 2.7018 2.7018 2.7018 3.1807 3.1807 3.1807 3.1807 3.4933 3.4933 3.4933 3.4933 3.9556 3.9556 3.9556 3.9556 4.3751 4.3751 4.3751 4.3751 4.4645 4.4645 4.4645 4.4645 4.6533 4.6533 4.6533 4.6533 4.7224 4.7224 4.7224 4.7224 5.0554 5.0554 5.0554 5.0554 5.5011 5.5011 5.5011 5.5011 6.4923 6.4923 6.4923 6.4923 6.7720 6.7720 6.7720 6.7720 k = 0.0769 0.3282 0.1518 ( 5076 PWs) bands (ev): -13.1675 -13.1675 -13.1675 -13.1675 -13.0702 -13.0702 -13.0702 -13.0702 -12.0872 -12.0872 -12.0872 -12.0872 -11.4698 -11.4698 -11.4698 -11.4698 -0.6408 -0.6408 -0.6408 -0.6408 -0.2239 -0.2239 -0.2239 -0.2239 0.6869 0.6869 0.6869 0.6869 0.7783 0.7783 0.7783 0.7783 0.9923 0.9923 0.9923 0.9923 1.6223 1.6223 1.6223 1.6223 2.0859 2.0859 2.0859 2.0859 2.5380 2.5380 2.5380 2.5380 2.6930 2.6930 2.6930 2.6930 3.1974 3.1974 3.1974 3.1974 3.5352 3.5352 3.5352 3.5352 3.9510 3.9510 3.9510 3.9510 4.3783 4.3783 4.3783 4.3783 4.4604 4.4604 4.4604 4.4604 4.6480 4.6480 4.6480 4.6480 4.7025 4.7025 4.7025 4.7025 5.0461 5.0461 5.0461 5.0461 5.5032 5.5032 5.5032 5.5032 6.4955 6.4955 6.4955 6.4955 6.7984 6.7984 6.7984 6.7984 k = 0.0673 0.3282 0.1518 ( 5080 PWs) bands (ev): -13.1727 -13.1727 -13.1727 -13.1727 -13.0737 -13.0737 -13.0737 -13.0737 -12.0904 -12.0904 -12.0904 -12.0904 -11.4706 -11.4706 -11.4706 -11.4706 -0.6506 -0.6506 -0.6506 -0.6506 -0.2293 -0.2293 -0.2293 -0.2293 0.7067 0.7067 0.7067 0.7067 0.7981 0.7981 0.7981 0.7981 0.9747 0.9747 0.9747 0.9747 1.6225 1.6225 1.6225 1.6225 2.0763 2.0763 2.0763 2.0763 2.5581 2.5581 2.5581 2.5581 2.6891 2.6891 2.6891 2.6891 3.2118 3.2118 3.2118 3.2118 3.5751 3.5751 3.5751 3.5751 3.9452 3.9452 3.9452 3.9452 4.3818 4.3818 4.3818 4.3818 4.4572 4.4572 4.4572 4.4572 4.6419 4.6419 4.6419 4.6419 4.6845 4.6845 4.6845 4.6845 5.0371 5.0371 5.0371 5.0371 5.5049 5.5049 5.5049 5.5049 6.4980 6.4980 6.4980 6.4980 6.8238 6.8238 6.8238 6.8238 k = 0.0577 0.3282 0.1518 ( 5088 PWs) bands (ev): -13.1772 -13.1772 -13.1772 -13.1772 -13.0768 -13.0768 -13.0768 -13.0768 -12.0933 -12.0933 -12.0933 -12.0933 -11.4713 -11.4713 -11.4713 -11.4713 -0.6593 -0.6593 -0.6593 -0.6593 -0.2342 -0.2342 -0.2342 -0.2342 0.7264 0.7264 0.7264 0.7264 0.8162 0.8162 0.8162 0.8162 0.9571 0.9571 0.9571 0.9571 1.6218 1.6218 1.6218 1.6218 2.0678 2.0678 2.0678 2.0678 2.5712 2.5712 2.5712 2.5712 2.6911 2.6911 2.6911 2.6911 3.2240 3.2240 3.2240 3.2240 3.6123 3.6123 3.6123 3.6123 3.9387 3.9387 3.9387 3.9387 4.3854 4.3854 4.3854 4.3854 4.4550 4.4550 4.4550 4.4550 4.6326 4.6326 4.6326 4.6326 4.6711 4.6711 4.6711 4.6711 5.0284 5.0284 5.0284 5.0284 5.5063 5.5063 5.5063 5.5063 6.5000 6.5000 6.5000 6.5000 6.8479 6.8479 6.8479 6.8479 k = 0.0481 0.3282 0.1518 ( 5088 PWs) bands (ev): -13.1810 -13.1810 -13.1810 -13.1810 -13.0794 -13.0794 -13.0794 -13.0794 -12.0957 -12.0957 -12.0957 -12.0957 -11.4719 -11.4719 -11.4719 -11.4719 -0.6667 -0.6667 -0.6667 -0.6667 -0.2384 -0.2384 -0.2384 -0.2384 0.7458 0.7458 0.7458 0.7458 0.8321 0.8321 0.8321 0.8321 0.9394 0.9394 0.9394 0.9394 1.6204 1.6204 1.6204 1.6204 2.0605 2.0605 2.0605 2.0605 2.5775 2.5775 2.5775 2.5775 2.6987 2.6987 2.6987 2.6987 3.2342 3.2342 3.2342 3.2342 3.6458 3.6458 3.6458 3.6458 3.9319 3.9319 3.9319 3.9319 4.3892 4.3892 4.3892 4.3892 4.4537 4.4537 4.4537 4.4537 4.6190 4.6190 4.6190 4.6190 4.6637 4.6637 4.6637 4.6637 5.0205 5.0205 5.0205 5.0205 5.5074 5.5074 5.5074 5.5074 6.5015 6.5015 6.5015 6.5015 6.8706 6.8706 6.8706 6.8706 k = 0.0385 0.3282 0.1518 ( 5080 PWs) bands (ev): -13.1842 -13.1842 -13.1842 -13.1842 -13.0816 -13.0816 -13.0816 -13.0816 -12.0977 -12.0977 -12.0977 -12.0977 -11.4724 -11.4724 -11.4724 -11.4724 -0.6728 -0.6728 -0.6728 -0.6728 -0.2418 -0.2418 -0.2418 -0.2418 0.7651 0.7651 0.7651 0.7651 0.8457 0.8457 0.8457 0.8457 0.9217 0.9217 0.9217 0.9217 1.6188 1.6188 1.6188 1.6188 2.0544 2.0544 2.0544 2.0544 2.5788 2.5788 2.5788 2.5788 2.7095 2.7095 2.7095 2.7095 3.2425 3.2425 3.2425 3.2425 3.6748 3.6748 3.6748 3.6748 3.9255 3.9255 3.9255 3.9255 4.3928 4.3928 4.3928 4.3928 4.4531 4.4531 4.4531 4.4531 4.6034 4.6034 4.6034 4.6034 4.6605 4.6605 4.6605 4.6605 5.0135 5.0135 5.0135 5.0135 5.5083 5.5083 5.5083 5.5083 6.5026 6.5026 6.5026 6.5026 6.8915 6.8915 6.8915 6.8915 k = 0.0288 0.3282 0.1518 ( 5060 PWs) bands (ev): -13.1867 -13.1867 -13.1867 -13.1867 -13.0833 -13.0833 -13.0833 -13.0833 -12.0992 -12.0992 -12.0992 -12.0992 -11.4728 -11.4728 -11.4728 -11.4728 -0.6775 -0.6775 -0.6775 -0.6775 -0.2445 -0.2445 -0.2445 -0.2445 0.7839 0.7839 0.7839 0.7839 0.8567 0.8567 0.8567 0.8567 0.9041 0.9041 0.9041 0.9041 1.6171 1.6171 1.6171 1.6171 2.0496 2.0496 2.0496 2.0496 2.5777 2.5777 2.5777 2.5777 2.7205 2.7205 2.7205 2.7205 3.2488 3.2488 3.2488 3.2488 3.6985 3.6985 3.6985 3.6985 3.9199 3.9199 3.9199 3.9199 4.3962 4.3962 4.3962 4.3962 4.4532 4.4532 4.4532 4.4532 4.5886 4.5886 4.5886 4.5886 4.6593 4.6593 4.6593 4.6593 5.0077 5.0077 5.0077 5.0077 5.5090 5.5090 5.5090 5.5090 6.5034 6.5034 6.5034 6.5034 6.9101 6.9101 6.9101 6.9101 k = 0.0192 0.3282 0.1518 ( 5072 PWs) bands (ev): -13.1884 -13.1884 -13.1884 -13.1884 -13.0845 -13.0845 -13.0845 -13.0845 -12.1003 -12.1003 -12.1003 -12.1003 -11.4731 -11.4731 -11.4731 -11.4731 -0.6809 -0.6809 -0.6809 -0.6809 -0.2464 -0.2464 -0.2464 -0.2464 0.8019 0.8019 0.8019 0.8019 0.8646 0.8646 0.8646 0.8646 0.8870 0.8870 0.8870 0.8870 1.6157 1.6157 1.6157 1.6157 2.0461 2.0461 2.0461 2.0461 2.5760 2.5760 2.5760 2.5760 2.7296 2.7296 2.7296 2.7296 3.2533 3.2533 3.2533 3.2533 3.7160 3.7160 3.7160 3.7160 3.9156 3.9156 3.9156 3.9156 4.3990 4.3990 4.3990 4.3990 4.4535 4.4535 4.4535 4.4535 4.5764 4.5764 4.5764 4.5764 4.6590 4.6590 4.6590 4.6590 5.0033 5.0033 5.0033 5.0033 5.5095 5.5095 5.5095 5.5095 6.5039 6.5039 6.5039 6.5039 6.9254 6.9254 6.9254 6.9254 k = 0.0096 0.3282 0.1518 ( 5076 PWs) bands (ev): -13.1895 -13.1895 -13.1895 -13.1895 -13.0852 -13.0852 -13.0852 -13.0852 -12.1009 -12.1009 -12.1009 -12.1009 -11.4733 -11.4733 -11.4733 -11.4733 -0.6830 -0.6830 -0.6830 -0.6830 -0.2476 -0.2476 -0.2476 -0.2476 0.8178 0.8178 0.8178 0.8178 0.8690 0.8690 0.8690 0.8690 0.8721 0.8721 0.8721 0.8721 1.6148 1.6148 1.6148 1.6148 2.0439 2.0439 2.0439 2.0439 2.5747 2.5747 2.5747 2.5747 2.7355 2.7355 2.7355 2.7355 3.2560 3.2560 3.2560 3.2560 3.7268 3.7268 3.7268 3.7268 3.9129 3.9129 3.9129 3.9129 4.4010 4.4010 4.4010 4.4010 4.4539 4.4539 4.4539 4.4539 4.5684 4.5684 4.5684 4.5684 4.6590 4.6590 4.6590 4.6590 5.0006 5.0006 5.0006 5.0006 5.5098 5.5098 5.5098 5.5098 6.5042 6.5042 6.5042 6.5042 6.9360 6.9360 6.9360 6.9360 k = 0.0000 0.3282 0.1518 ( 5072 PWs) bands (ev): -13.1899 -13.1899 -13.1899 -13.1899 -13.0854 -13.0854 -13.0854 -13.0854 -12.1012 -12.1012 -12.1012 -12.1012 -11.4733 -11.4733 -11.4733 -11.4733 -0.6836 -0.6836 -0.6836 -0.6836 -0.2480 -0.2480 -0.2480 -0.2480 0.8257 0.8257 0.8257 0.8257 0.8637 0.8637 0.8637 0.8637 0.8713 0.8713 0.8713 0.8713 1.6144 1.6144 1.6144 1.6144 2.0432 2.0432 2.0432 2.0432 2.5742 2.5742 2.5742 2.5742 2.7376 2.7376 2.7376 2.7376 3.2568 3.2568 3.2568 3.2568 3.7304 3.7304 3.7304 3.7304 3.9119 3.9119 3.9119 3.9119 4.4017 4.4017 4.4017 4.4017 4.4540 4.4540 4.4540 4.4540 4.5656 4.5656 4.5656 4.5656 4.6591 4.6591 4.6591 4.6591 4.9997 4.9997 4.9997 4.9997 5.5099 5.5099 5.5099 5.5099 6.5043 6.5043 6.5043 6.5043 6.9399 6.9399 6.9399 6.9399 k = 0.0000 0.3282 0.1518 ( 5072 PWs) bands (ev): -13.1899 -13.1899 -13.1899 -13.1899 -13.0854 -13.0854 -13.0854 -13.0854 -12.1012 -12.1012 -12.1012 -12.1012 -11.4733 -11.4733 -11.4733 -11.4733 -0.6836 -0.6836 -0.6836 -0.6836 -0.2480 -0.2480 -0.2480 -0.2480 0.8257 0.8257 0.8257 0.8257 0.8637 0.8637 0.8637 0.8637 0.8713 0.8713 0.8713 0.8713 1.6144 1.6144 1.6144 1.6144 2.0432 2.0432 2.0432 2.0432 2.5742 2.5742 2.5742 2.5742 2.7376 2.7376 2.7376 2.7376 3.2568 3.2568 3.2568 3.2568 3.7304 3.7304 3.7304 3.7304 3.9119 3.9119 3.9119 3.9119 4.4017 4.4017 4.4017 4.4017 4.4540 4.4540 4.4540 4.4540 4.5656 4.5656 4.5656 4.5656 4.6591 4.6591 4.6591 4.6591 4.9997 4.9997 4.9997 4.9997 5.5099 5.5099 5.5099 5.5099 6.5043 6.5043 6.5043 6.5043 6.9399 6.9399 6.9399 6.9399 k = 0.0000 0.3189 0.1518 ( 5062 PWs) bands (ev): -13.1929 -13.1929 -13.1929 -13.1929 -13.0826 -13.0826 -13.0826 -13.0826 -12.1012 -12.1012 -12.1012 -12.1012 -11.4730 -11.4730 -11.4730 -11.4730 -0.6834 -0.6834 -0.6834 -0.6834 -0.2479 -0.2479 -0.2479 -0.2479 0.8248 0.8248 0.8248 0.8248 0.8638 0.8638 0.8638 0.8638 0.8715 0.8715 0.8715 0.8715 1.6115 1.6115 1.6115 1.6115 2.0464 2.0464 2.0464 2.0464 2.5751 2.5751 2.5751 2.5751 2.7373 2.7373 2.7373 2.7373 3.2562 3.2562 3.2562 3.2562 3.7302 3.7302 3.7302 3.7302 3.9122 3.9122 3.9122 3.9122 4.4010 4.4010 4.4010 4.4010 4.4551 4.4551 4.4551 4.4551 4.5647 4.5647 4.5647 4.5647 4.6601 4.6601 4.6601 4.6601 4.9987 4.9987 4.9987 4.9987 5.5105 5.5105 5.5105 5.5105 6.5025 6.5025 6.5025 6.5025 6.9415 6.9415 6.9415 6.9415 k = 0.0000 0.3095 0.1518 ( 5078 PWs) bands (ev): -13.2011 -13.2011 -13.2011 -13.2011 -13.0748 -13.0748 -13.0748 -13.0748 -12.1012 -12.1012 -12.1012 -12.1012 -11.4722 -11.4722 -11.4722 -11.4722 -0.6827 -0.6827 -0.6827 -0.6827 -0.2477 -0.2477 -0.2477 -0.2477 0.8222 0.8222 0.8222 0.8222 0.8641 0.8641 0.8641 0.8641 0.8718 0.8718 0.8718 0.8718 1.6031 1.6031 1.6031 1.6031 2.0555 2.0555 2.0555 2.0555 2.5780 2.5780 2.5780 2.5780 2.7366 2.7366 2.7366 2.7366 3.2543 3.2543 3.2543 3.2543 3.7294 3.7294 3.7294 3.7294 3.9129 3.9129 3.9129 3.9129 4.3991 4.3991 4.3991 4.3991 4.4579 4.4579 4.4579 4.4579 4.5620 4.5620 4.5620 4.5620 4.6630 4.6630 4.6630 4.6630 4.9956 4.9956 4.9956 4.9956 5.5123 5.5123 5.5123 5.5123 6.4971 6.4971 6.4971 6.4971 6.9460 6.9460 6.9460 6.9460 k = 0.0000 0.3001 0.1518 ( 5078 PWs) bands (ev): -13.2127 -13.2127 -13.2127 -13.2127 -13.0638 -13.0638 -13.0638 -13.0638 -12.1013 -12.1013 -12.1013 -12.1013 -11.4707 -11.4707 -11.4707 -11.4707 -0.6814 -0.6814 -0.6814 -0.6814 -0.2474 -0.2474 -0.2474 -0.2474 0.8177 0.8177 0.8177 0.8177 0.8646 0.8646 0.8646 0.8646 0.8723 0.8723 0.8723 0.8723 1.5902 1.5902 1.5902 1.5902 2.0696 2.0696 2.0696 2.0696 2.5828 2.5828 2.5828 2.5828 2.7353 2.7353 2.7353 2.7353 3.2513 3.2513 3.2513 3.2513 3.7283 3.7283 3.7283 3.7283 3.9142 3.9142 3.9142 3.9142 4.3963 4.3963 4.3963 4.3963 4.4623 4.4623 4.4623 4.4623 4.5580 4.5580 4.5580 4.5580 4.6675 4.6675 4.6675 4.6675 4.9905 4.9905 4.9905 4.9905 5.5153 5.5153 5.5153 5.5153 6.4884 6.4884 6.4884 6.4884 6.9534 6.9534 6.9534 6.9534 k = 0.0000 0.2907 0.1518 ( 5074 PWs) bands (ev): -13.2265 -13.2265 -13.2265 -13.2265 -13.0510 -13.0510 -13.0510 -13.0510 -12.1013 -12.1013 -12.1013 -12.1013 -11.4688 -11.4688 -11.4688 -11.4688 -0.6797 -0.6797 -0.6797 -0.6797 -0.2469 -0.2469 -0.2469 -0.2469 0.8115 0.8115 0.8115 0.8115 0.8653 0.8653 0.8653 0.8653 0.8731 0.8731 0.8731 0.8731 1.5740 1.5740 1.5740 1.5740 2.0872 2.0872 2.0872 2.0872 2.5896 2.5896 2.5896 2.5896 2.7336 2.7336 2.7336 2.7336 3.2471 3.2471 3.2471 3.2471 3.7267 3.7267 3.7267 3.7267 3.9160 3.9160 3.9160 3.9160 4.3929 4.3929 4.3929 4.3929 4.4679 4.4679 4.4679 4.4679 4.5529 4.5529 4.5529 4.5529 4.6732 4.6732 4.6732 4.6732 4.9837 4.9837 4.9837 4.9837 5.5193 5.5193 5.5193 5.5193 6.4768 6.4768 6.4768 6.4768 6.9632 6.9632 6.9632 6.9632 k = 0.0000 0.2814 0.1518 ( 5068 PWs) bands (ev): -13.2416 -13.2416 -13.2416 -13.2416 -13.0372 -13.0372 -13.0372 -13.0372 -12.1014 -12.1014 -12.1014 -12.1014 -11.4662 -11.4662 -11.4662 -11.4662 -0.6776 -0.6776 -0.6776 -0.6776 -0.2463 -0.2463 -0.2463 -0.2463 0.8035 0.8035 0.8035 0.8035 0.8662 0.8662 0.8662 0.8662 0.8741 0.8741 0.8741 0.8741 1.5556 1.5556 1.5556 1.5556 2.1071 2.1071 2.1071 2.1071 2.5985 2.5985 2.5985 2.5985 2.7313 2.7313 2.7313 2.7313 3.2420 3.2420 3.2420 3.2420 3.7246 3.7246 3.7246 3.7246 3.9183 3.9183 3.9183 3.9183 4.3893 4.3893 4.3893 4.3893 4.4744 4.4744 4.4744 4.4744 4.5471 4.5471 4.5471 4.5471 4.6798 4.6798 4.6798 4.6798 4.9751 4.9751 4.9751 4.9751 5.5241 5.5241 5.5241 5.5241 6.4627 6.4627 6.4627 6.4627 6.9749 6.9749 6.9749 6.9749 k = 0.0000 0.2720 0.1518 ( 5072 PWs) bands (ev): -13.2573 -13.2573 -13.2573 -13.2573 -13.0230 -13.0230 -13.0230 -13.0230 -12.1015 -12.1015 -12.1015 -12.1015 -11.4632 -11.4632 -11.4632 -11.4632 -0.6751 -0.6751 -0.6751 -0.6751 -0.2456 -0.2456 -0.2456 -0.2456 0.7939 0.7939 0.7939 0.7939 0.8673 0.8673 0.8673 0.8673 0.8753 0.8753 0.8753 0.8753 1.5362 1.5362 1.5362 1.5362 2.1281 2.1281 2.1281 2.1281 2.6094 2.6094 2.6094 2.6094 2.7286 2.7286 2.7286 2.7286 3.2360 3.2360 3.2360 3.2360 3.7221 3.7221 3.7221 3.7221 3.9212 3.9212 3.9212 3.9212 4.3854 4.3854 4.3854 4.3854 4.4813 4.4813 4.4813 4.4813 4.5410 4.5410 4.5410 4.5410 4.6870 4.6870 4.6870 4.6870 4.9650 4.9650 4.9650 4.9650 5.5297 5.5297 5.5297 5.5297 6.4465 6.4465 6.4465 6.4465 6.9882 6.9882 6.9882 6.9882 k = 0.0000 0.2626 0.1518 ( 5080 PWs) bands (ev): -13.2734 -13.2734 -13.2734 -13.2734 -13.0087 -13.0087 -13.0087 -13.0087 -12.1015 -12.1015 -12.1015 -12.1015 -11.4597 -11.4597 -11.4597 -11.4597 -0.6723 -0.6723 -0.6723 -0.6723 -0.2447 -0.2447 -0.2447 -0.2447 0.7825 0.7825 0.7825 0.7825 0.8685 0.8685 0.8685 0.8685 0.8767 0.8767 0.8767 0.8767 1.5165 1.5165 1.5165 1.5165 2.1490 2.1490 2.1490 2.1490 2.6222 2.6222 2.6222 2.6222 2.7255 2.7255 2.7255 2.7255 3.2294 3.2294 3.2294 3.2294 3.7192 3.7192 3.7192 3.7192 3.9246 3.9246 3.9246 3.9246 4.3816 4.3816 4.3816 4.3816 4.4886 4.4886 4.4886 4.4886 4.5348 4.5348 4.5348 4.5348 4.6946 4.6946 4.6946 4.6946 4.9536 4.9536 4.9536 4.9536 5.5357 5.5357 5.5357 5.5357 6.4287 6.4287 6.4287 6.4287 7.0025 7.0025 7.0025 7.0025 k = 0.0000 0.2532 0.1518 ( 5084 PWs) bands (ev): -13.2897 -13.2897 -13.2897 -13.2897 -12.9945 -12.9945 -12.9945 -12.9945 -12.1015 -12.1015 -12.1015 -12.1015 -11.4557 -11.4557 -11.4557 -11.4557 -0.6691 -0.6691 -0.6691 -0.6691 -0.2437 -0.2437 -0.2437 -0.2437 0.7697 0.7697 0.7697 0.7697 0.8699 0.8699 0.8699 0.8699 0.8783 0.8783 0.8783 0.8783 1.4972 1.4972 1.4972 1.4972 2.1692 2.1692 2.1692 2.1692 2.6370 2.6370 2.6370 2.6370 2.7219 2.7219 2.7219 2.7219 3.2224 3.2224 3.2224 3.2224 3.7159 3.7159 3.7159 3.7159 3.9287 3.9287 3.9287 3.9287 4.3777 4.3777 4.3777 4.3777 4.4955 4.4955 4.4955 4.4955 4.5292 4.5292 4.5292 4.5292 4.7025 4.7025 4.7025 4.7025 4.9410 4.9410 4.9410 4.9410 5.5420 5.5420 5.5420 5.5420 6.4095 6.4095 6.4095 6.4095 7.0173 7.0173 7.0173 7.0173 k = 0.0000 0.2438 0.1518 ( 5080 PWs) bands (ev): -13.3060 -13.3060 -13.3060 -13.3060 -12.9805 -12.9805 -12.9805 -12.9805 -12.1015 -12.1015 -12.1015 -12.1015 -11.4514 -11.4514 -11.4514 -11.4514 -0.6657 -0.6657 -0.6657 -0.6657 -0.2424 -0.2424 -0.2424 -0.2424 0.7554 0.7554 0.7554 0.7554 0.8715 0.8715 0.8715 0.8715 0.8801 0.8801 0.8801 0.8801 1.4787 1.4787 1.4787 1.4787 2.1880 2.1880 2.1880 2.1880 2.6534 2.6534 2.6534 2.6534 2.7180 2.7180 2.7180 2.7180 3.2153 3.2153 3.2153 3.2153 3.7122 3.7122 3.7122 3.7122 3.9335 3.9335 3.9335 3.9335 4.3739 4.3739 4.3739 4.3739 4.5010 4.5010 4.5010 4.5010 4.5255 4.5255 4.5255 4.5255 4.7106 4.7106 4.7106 4.7106 4.9275 4.9275 4.9275 4.9275 5.5486 5.5486 5.5486 5.5486 6.3894 6.3894 6.3894 6.3894 7.0315 7.0315 7.0315 7.0315 k = 0.0000 0.2345 0.1518 ( 5080 PWs) bands (ev): -13.3222 -13.3222 -13.3222 -13.3222 -12.9669 -12.9669 -12.9669 -12.9669 -12.1014 -12.1014 -12.1014 -12.1014 -11.4466 -11.4466 -11.4466 -11.4466 -0.6622 -0.6622 -0.6622 -0.6622 -0.2410 -0.2410 -0.2410 -0.2410 0.7398 0.7398 0.7398 0.7398 0.8732 0.8732 0.8732 0.8732 0.8822 0.8822 0.8822 0.8822 1.4614 1.4614 1.4614 1.4614 2.2049 2.2049 2.2049 2.2049 2.6712 2.6712 2.6712 2.6712 2.7138 2.7138 2.7138 2.7138 3.2083 3.2083 3.2083 3.2083 3.7082 3.7082 3.7082 3.7082 3.9389 3.9389 3.9389 3.9389 4.3702 4.3702 4.3702 4.3702 4.5022 4.5022 4.5022 4.5022 4.5263 4.5263 4.5263 4.5263 4.7187 4.7187 4.7187 4.7187 4.9133 4.9133 4.9133 4.9133 5.5551 5.5551 5.5551 5.5551 6.3686 6.3686 6.3686 6.3686 7.0429 7.0429 7.0429 7.0429 k = 0.0000 0.2251 0.1518 ( 5082 PWs) bands (ev): -13.3382 -13.3382 -13.3382 -13.3382 -12.9537 -12.9537 -12.9537 -12.9537 -12.1013 -12.1013 -12.1013 -12.1013 -11.4416 -11.4416 -11.4416 -11.4416 -0.6585 -0.6585 -0.6585 -0.6585 -0.2393 -0.2393 -0.2393 -0.2393 0.7231 0.7231 0.7231 0.7231 0.8750 0.8750 0.8750 0.8750 0.8844 0.8844 0.8844 0.8844 1.4455 1.4455 1.4455 1.4455 2.2198 2.2198 2.2198 2.2198 2.6898 2.6898 2.6898 2.6898 2.7093 2.7093 2.7093 2.7093 3.2018 3.2018 3.2018 3.2018 3.7039 3.7039 3.7039 3.7039 3.9451 3.9451 3.9451 3.9451 4.3666 4.3666 4.3666 4.3666 4.4989 4.4989 4.4989 4.4989 4.5318 4.5318 4.5318 4.5318 4.7267 4.7267 4.7267 4.7267 4.8985 4.8985 4.8985 4.8985 5.5613 5.5613 5.5613 5.5613 6.3475 6.3475 6.3475 6.3475 7.0497 7.0497 7.0497 7.0497 k = 0.0000 0.2157 0.1518 ( 5082 PWs) bands (ev): -13.3539 -13.3539 -13.3539 -13.3539 -12.9409 -12.9409 -12.9409 -12.9409 -12.1010 -12.1010 -12.1010 -12.1010 -11.4362 -11.4362 -11.4362 -11.4362 -0.6548 -0.6548 -0.6548 -0.6548 -0.2374 -0.2374 -0.2374 -0.2374 0.7054 0.7054 0.7054 0.7054 0.8769 0.8769 0.8769 0.8769 0.8867 0.8867 0.8867 0.8867 1.4311 1.4311 1.4311 1.4311 2.2326 2.2326 2.2326 2.2326 2.7037 2.7037 2.7037 2.7037 2.7096 2.7096 2.7096 2.7096 3.1961 3.1961 3.1961 3.1961 3.6993 3.6993 3.6993 3.6993 3.9521 3.9521 3.9521 3.9521 4.3630 4.3630 4.3630 4.3630 4.4937 4.4937 4.4937 4.4937 4.5396 4.5396 4.5396 4.5396 4.7346 4.7346 4.7346 4.7346 4.8833 4.8833 4.8833 4.8833 5.5673 5.5673 5.5673 5.5673 6.3261 6.3261 6.3261 6.3261 7.0540 7.0540 7.0540 7.0540 k = 0.0000 0.2063 0.1518 ( 5090 PWs) bands (ev): -13.3694 -13.3694 -13.3694 -13.3694 -12.9287 -12.9287 -12.9287 -12.9287 -12.1007 -12.1007 -12.1007 -12.1007 -11.4306 -11.4306 -11.4306 -11.4306 -0.6512 -0.6512 -0.6512 -0.6512 -0.2352 -0.2352 -0.2352 -0.2352 0.6871 0.6871 0.6871 0.6871 0.8789 0.8789 0.8789 0.8789 0.8892 0.8892 0.8892 0.8892 1.4182 1.4182 1.4182 1.4182 2.2431 2.2431 2.2431 2.2431 2.6990 2.6990 2.6990 2.6990 2.7281 2.7281 2.7281 2.7281 3.1917 3.1917 3.1917 3.1917 3.6944 3.6944 3.6944 3.6944 3.9600 3.9600 3.9600 3.9600 4.3594 4.3594 4.3594 4.3594 4.4878 4.4878 4.4878 4.4878 4.5482 4.5482 4.5482 4.5482 4.7422 4.7422 4.7422 4.7422 4.8679 4.8679 4.8679 4.8679 5.5729 5.5729 5.5729 5.5729 6.3046 6.3046 6.3046 6.3046 7.0573 7.0573 7.0573 7.0573 k = 0.0000 0.1969 0.1518 ( 5094 PWs) bands (ev): -13.3844 -13.3844 -13.3844 -13.3844 -12.9171 -12.9171 -12.9171 -12.9171 -12.1002 -12.1002 -12.1002 -12.1002 -11.4248 -11.4248 -11.4248 -11.4248 -0.6476 -0.6476 -0.6476 -0.6476 -0.2327 -0.2327 -0.2327 -0.2327 0.6682 0.6682 0.6682 0.6682 0.8809 0.8809 0.8809 0.8809 0.8918 0.8918 0.8918 0.8918 1.4067 1.4067 1.4067 1.4067 2.2516 2.2516 2.2516 2.2516 2.6937 2.6937 2.6937 2.6937 2.7462 2.7462 2.7462 2.7462 3.1888 3.1888 3.1888 3.1888 3.6894 3.6894 3.6894 3.6894 3.9687 3.9687 3.9687 3.9687 4.3559 4.3559 4.3559 4.3559 4.4818 4.4818 4.4818 4.4818 4.5571 4.5571 4.5571 4.5571 4.7495 4.7495 4.7495 4.7495 4.8527 4.8527 4.8527 4.8527 5.5779 5.5779 5.5779 5.5779 6.2834 6.2834 6.2834 6.2834 7.0602 7.0602 7.0602 7.0602 k = 0.0000 0.1876 0.1518 ( 5106 PWs) bands (ev): -13.3990 -13.3990 -13.3990 -13.3990 -12.9060 -12.9060 -12.9060 -12.9060 -12.0997 -12.0997 -12.0997 -12.0997 -11.4188 -11.4188 -11.4188 -11.4188 -0.6443 -0.6443 -0.6443 -0.6443 -0.2298 -0.2298 -0.2298 -0.2298 0.6491 0.6491 0.6491 0.6491 0.8830 0.8830 0.8830 0.8830 0.8945 0.8945 0.8945 0.8945 1.3967 1.3967 1.3967 1.3967 2.2580 2.2580 2.2580 2.2580 2.6883 2.6883 2.6883 2.6883 2.7629 2.7629 2.7629 2.7629 3.1878 3.1878 3.1878 3.1878 3.6841 3.6841 3.6841 3.6841 3.9783 3.9783 3.9783 3.9783 4.3525 4.3525 4.3525 4.3525 4.4759 4.4759 4.4759 4.4759 4.5660 4.5660 4.5660 4.5660 4.7561 4.7561 4.7561 4.7561 4.8378 4.8378 4.8378 4.8378 5.5823 5.5823 5.5823 5.5823 6.2625 6.2625 6.2625 6.2625 7.0628 7.0628 7.0628 7.0628 k = 0.0000 0.1782 0.1518 ( 5112 PWs) bands (ev): -13.4132 -13.4132 -13.4132 -13.4132 -12.8955 -12.8955 -12.8955 -12.8955 -12.0991 -12.0991 -12.0991 -12.0991 -11.4128 -11.4128 -11.4128 -11.4128 -0.6413 -0.6413 -0.6413 -0.6413 -0.2267 -0.2267 -0.2267 -0.2267 0.6299 0.6299 0.6299 0.6299 0.8851 0.8851 0.8851 0.8851 0.8973 0.8973 0.8973 0.8973 1.3882 1.3882 1.3882 1.3882 2.2626 2.2626 2.2626 2.2626 2.6827 2.6827 2.6827 2.6827 2.7778 2.7778 2.7778 2.7778 3.1890 3.1890 3.1890 3.1890 3.6787 3.6787 3.6787 3.6787 3.9889 3.9889 3.9889 3.9889 4.3491 4.3491 4.3491 4.3491 4.4701 4.4701 4.4701 4.4701 4.5747 4.5747 4.5747 4.5747 4.7616 4.7616 4.7616 4.7616 4.8240 4.8240 4.8240 4.8240 5.5861 5.5861 5.5861 5.5861 6.2421 6.2421 6.2421 6.2421 7.0653 7.0653 7.0653 7.0653 k = 0.0000 0.1688 0.1518 ( 5110 PWs) bands (ev): -13.4269 -13.4269 -13.4269 -13.4269 -12.8857 -12.8857 -12.8857 -12.8857 -12.0983 -12.0983 -12.0983 -12.0983 -11.4067 -11.4067 -11.4067 -11.4067 -0.6386 -0.6386 -0.6386 -0.6386 -0.2231 -0.2231 -0.2231 -0.2231 0.6109 0.6109 0.6109 0.6109 0.8873 0.8873 0.8873 0.8873 0.9001 0.9001 0.9001 0.9001 1.3808 1.3808 1.3808 1.3808 2.2654 2.2654 2.2654 2.2654 2.6770 2.6770 2.6770 2.6770 2.7905 2.7905 2.7905 2.7905 3.1925 3.1925 3.1925 3.1925 3.6733 3.6733 3.6733 3.6733 4.0005 4.0005 4.0005 4.0005 4.3459 4.3459 4.3459 4.3459 4.4645 4.4645 4.4645 4.4645 4.5830 4.5830 4.5830 4.5830 4.7651 4.7651 4.7651 4.7651 4.8123 4.8123 4.8123 4.8123 5.5892 5.5892 5.5892 5.5892 6.2222 6.2222 6.2222 6.2222 7.0678 7.0678 7.0678 7.0678 k = 0.0000 0.1594 0.1518 ( 5110 PWs) bands (ev): -13.4400 -13.4400 -13.4400 -13.4400 -12.8765 -12.8765 -12.8765 -12.8765 -12.0975 -12.0975 -12.0975 -12.0975 -11.4006 -11.4006 -11.4006 -11.4006 -0.6363 -0.6363 -0.6363 -0.6363 -0.2192 -0.2192 -0.2192 -0.2192 0.5921 0.5921 0.5921 0.5921 0.8895 0.8895 0.8895 0.8895 0.9030 0.9030 0.9030 0.9030 1.3747 1.3747 1.3747 1.3747 2.2666 2.2666 2.2666 2.2666 2.6713 2.6713 2.6713 2.6713 2.8007 2.8007 2.8007 2.8007 3.1983 3.1983 3.1983 3.1983 3.6679 3.6679 3.6679 3.6679 4.0129 4.0129 4.0129 4.0129 4.3426 4.3426 4.3426 4.3426 4.4592 4.4592 4.4592 4.4592 4.5907 4.5907 4.5907 4.5907 4.7644 4.7644 4.7644 4.7644 4.8050 4.8050 4.8050 4.8050 5.5916 5.5916 5.5916 5.5916 6.2030 6.2030 6.2030 6.2030 7.0701 7.0701 7.0701 7.0701 k = 0.0000 0.1501 0.1518 ( 5110 PWs) bands (ev): -13.4525 -13.4525 -13.4525 -13.4525 -12.8679 -12.8679 -12.8679 -12.8679 -12.0966 -12.0966 -12.0966 -12.0966 -11.3945 -11.3945 -11.3945 -11.3945 -0.6344 -0.6344 -0.6344 -0.6344 -0.2149 -0.2149 -0.2149 -0.2149 0.5738 0.5738 0.5738 0.5738 0.8916 0.8916 0.8916 0.8916 0.9059 0.9059 0.9059 0.9059 1.3696 1.3696 1.3696 1.3696 2.2663 2.2663 2.2663 2.2663 2.6656 2.6656 2.6656 2.6656 2.8087 2.8087 2.8087 2.8087 3.2061 3.2061 3.2061 3.2061 3.6624 3.6624 3.6624 3.6624 4.0263 4.0263 4.0263 4.0263 4.3394 4.3394 4.3394 4.3394 4.4542 4.4542 4.4542 4.4542 4.5975 4.5975 4.5975 4.5975 4.7585 4.7585 4.7585 4.7585 4.8035 4.8035 4.8035 4.8035 5.5933 5.5933 5.5933 5.5933 6.1847 6.1847 6.1847 6.1847 7.0724 7.0724 7.0724 7.0724 k = 0.0000 0.1407 0.1518 ( 5108 PWs) bands (ev): -13.4644 -13.4644 -13.4644 -13.4644 -12.8599 -12.8599 -12.8599 -12.8599 -12.0956 -12.0956 -12.0956 -12.0956 -11.3885 -11.3885 -11.3885 -11.3885 -0.6330 -0.6330 -0.6330 -0.6330 -0.2103 -0.2103 -0.2103 -0.2103 0.5562 0.5562 0.5562 0.5562 0.8938 0.8938 0.8938 0.8938 0.9088 0.9088 0.9088 0.9088 1.3655 1.3655 1.3655 1.3655 2.2647 2.2647 2.2647 2.2647 2.6600 2.6600 2.6600 2.6600 2.8144 2.8144 2.8144 2.8144 3.2157 3.2157 3.2157 3.2157 3.6570 3.6570 3.6570 3.6570 4.0405 4.0405 4.0405 4.0405 4.3364 4.3364 4.3364 4.3364 4.4494 4.4494 4.4494 4.4494 4.6031 4.6031 4.6031 4.6031 4.7494 4.7494 4.7494 4.7494 4.8059 4.8059 4.8059 4.8059 5.5943 5.5943 5.5943 5.5943 6.1672 6.1672 6.1672 6.1672 7.0745 7.0745 7.0745 7.0745 k = 0.0000 0.1313 0.1518 ( 5108 PWs) bands (ev): -13.4757 -13.4757 -13.4757 -13.4757 -12.8525 -12.8525 -12.8525 -12.8525 -12.0945 -12.0945 -12.0945 -12.0945 -11.3827 -11.3827 -11.3827 -11.3827 -0.6320 -0.6320 -0.6320 -0.6320 -0.2054 -0.2054 -0.2054 -0.2054 0.5393 0.5393 0.5393 0.5393 0.8959 0.8959 0.8959 0.8959 0.9117 0.9117 0.9117 0.9117 1.3622 1.3622 1.3622 1.3622 2.2619 2.2619 2.2619 2.2619 2.6545 2.6545 2.6545 2.6545 2.8182 2.8182 2.8182 2.8182 3.2267 3.2267 3.2267 3.2267 3.6517 3.6517 3.6517 3.6517 4.0554 4.0554 4.0554 4.0554 4.3335 4.3335 4.3335 4.3335 4.4450 4.4450 4.4450 4.4450 4.6070 4.6070 4.6070 4.6070 4.7397 4.7397 4.7397 4.7397 4.8100 4.8100 4.8100 4.8100 5.5947 5.5947 5.5947 5.5947 6.1506 6.1506 6.1506 6.1506 7.0765 7.0765 7.0765 7.0765 k = 0.0000 0.1219 0.1518 ( 5104 PWs) bands (ev): -13.4863 -13.4863 -13.4863 -13.4863 -12.8458 -12.8458 -12.8458 -12.8458 -12.0934 -12.0934 -12.0934 -12.0934 -11.3771 -11.3771 -11.3771 -11.3771 -0.6314 -0.6314 -0.6314 -0.6314 -0.2002 -0.2002 -0.2002 -0.2002 0.5232 0.5232 0.5232 0.5232 0.8979 0.8979 0.8979 0.8979 0.9145 0.9145 0.9145 0.9145 1.3596 1.3596 1.3596 1.3596 2.2581 2.2581 2.2581 2.2581 2.6491 2.6491 2.6491 2.6491 2.8205 2.8205 2.8205 2.8205 3.2385 3.2385 3.2385 3.2385 3.6466 3.6466 3.6466 3.6466 4.0710 4.0710 4.0710 4.0710 4.3309 4.3309 4.3309 4.3309 4.4408 4.4408 4.4408 4.4408 4.6087 4.6087 4.6087 4.6087 4.7310 4.7310 4.7310 4.7310 4.8146 4.8146 4.8146 4.8146 5.5946 5.5946 5.5946 5.5946 6.1350 6.1350 6.1350 6.1350 7.0784 7.0784 7.0784 7.0784 k = 0.0000 0.1125 0.1518 ( 5100 PWs) bands (ev): -13.4963 -13.4963 -13.4963 -13.4963 -12.8396 -12.8396 -12.8396 -12.8396 -12.0923 -12.0923 -12.0923 -12.0923 -11.3716 -11.3716 -11.3716 -11.3716 -0.6313 -0.6313 -0.6313 -0.6313 -0.1948 -0.1948 -0.1948 -0.1948 0.5080 0.5080 0.5080 0.5080 0.8999 0.8999 0.8999 0.8999 0.9172 0.9172 0.9172 0.9172 1.3577 1.3577 1.3577 1.3577 2.2535 2.2535 2.2535 2.2535 2.6440 2.6440 2.6440 2.6440 2.8216 2.8216 2.8216 2.8216 3.2508 3.2508 3.2508 3.2508 3.6417 3.6417 3.6417 3.6417 4.0870 4.0870 4.0870 4.0870 4.3285 4.3285 4.3285 4.3285 4.4370 4.4370 4.4370 4.4370 4.6078 4.6078 4.6078 4.6078 4.7243 4.7243 4.7243 4.7243 4.8194 4.8194 4.8194 4.8194 5.5940 5.5940 5.5940 5.5940 6.1204 6.1204 6.1204 6.1204 7.0802 7.0802 7.0802 7.0802 k = 0.0000 0.1032 0.1518 ( 5096 PWs) bands (ev): -13.5055 -13.5055 -13.5055 -13.5055 -12.8340 -12.8340 -12.8340 -12.8340 -12.0912 -12.0912 -12.0912 -12.0912 -11.3665 -11.3665 -11.3665 -11.3665 -0.6316 -0.6316 -0.6316 -0.6316 -0.1892 -0.1892 -0.1892 -0.1892 0.4939 0.4939 0.4939 0.4939 0.9017 0.9017 0.9017 0.9017 0.9198 0.9198 0.9198 0.9198 1.3564 1.3564 1.3564 1.3564 2.2482 2.2482 2.2482 2.2482 2.6391 2.6391 2.6391 2.6391 2.8219 2.8219 2.8219 2.8219 3.2631 3.2631 3.2631 3.2631 3.6369 3.6369 3.6369 3.6369 4.1034 4.1034 4.1034 4.1034 4.3265 4.3265 4.3265 4.3265 4.4334 4.4334 4.4334 4.4334 4.6040 4.6040 4.6040 4.6040 4.7198 4.7198 4.7198 4.7198 4.8241 4.8241 4.8241 4.8241 5.5930 5.5930 5.5930 5.5930 6.1069 6.1069 6.1069 6.1069 7.0818 7.0818 7.0818 7.0818 k = 0.0000 0.0938 0.1518 ( 5092 PWs) bands (ev): -13.5140 -13.5140 -13.5140 -13.5140 -12.8290 -12.8290 -12.8290 -12.8290 -12.0901 -12.0901 -12.0901 -12.0901 -11.3617 -11.3617 -11.3617 -11.3617 -0.6321 -0.6321 -0.6321 -0.6321 -0.1837 -0.1837 -0.1837 -0.1837 0.4808 0.4808 0.4808 0.4808 0.9035 0.9035 0.9035 0.9035 0.9222 0.9222 0.9222 0.9222 1.3555 1.3555 1.3555 1.3555 2.2425 2.2425 2.2425 2.2425 2.6344 2.6344 2.6344 2.6344 2.8216 2.8216 2.8216 2.8216 3.2751 3.2751 3.2751 3.2751 3.6324 3.6324 3.6324 3.6324 4.1197 4.1197 4.1197 4.1197 4.3250 4.3250 4.3250 4.3250 4.4302 4.4302 4.4302 4.4302 4.5976 4.5976 4.5976 4.5976 4.7177 4.7177 4.7177 4.7177 4.8286 4.8286 4.8286 4.8286 5.5918 5.5918 5.5918 5.5918 6.0944 6.0944 6.0944 6.0944 7.0833 7.0833 7.0833 7.0833 k = 0.0000 0.0844 0.1518 ( 5098 PWs) bands (ev): -13.5217 -13.5217 -13.5217 -13.5217 -12.8245 -12.8245 -12.8245 -12.8245 -12.0890 -12.0890 -12.0890 -12.0890 -11.3572 -11.3572 -11.3572 -11.3572 -0.6329 -0.6329 -0.6329 -0.6329 -0.1781 -0.1781 -0.1781 -0.1781 0.4688 0.4688 0.4688 0.4688 0.9051 0.9051 0.9051 0.9051 0.9245 0.9245 0.9245 0.9245 1.3550 1.3550 1.3550 1.3550 2.2365 2.2365 2.2365 2.2365 2.6301 2.6301 2.6301 2.6301 2.8209 2.8209 2.8209 2.8209 3.2865 3.2865 3.2865 3.2865 3.6283 3.6283 3.6283 3.6283 4.1358 4.1358 4.1358 4.1358 4.3239 4.3239 4.3239 4.3239 4.4273 4.4273 4.4273 4.4273 4.5888 4.5888 4.5888 4.5888 4.7174 4.7174 4.7174 4.7174 4.8327 4.8327 4.8327 4.8327 5.5903 5.5903 5.5903 5.5903 6.0831 6.0831 6.0831 6.0831 7.0846 7.0846 7.0846 7.0846 k = 0.0000 0.0750 0.1518 ( 5096 PWs) bands (ev): -13.5287 -13.5287 -13.5287 -13.5287 -12.8206 -12.8206 -12.8206 -12.8206 -12.0879 -12.0879 -12.0879 -12.0879 -11.3530 -11.3530 -11.3530 -11.3530 -0.6339 -0.6339 -0.6339 -0.6339 -0.1728 -0.1728 -0.1728 -0.1728 0.4580 0.4580 0.4580 0.4580 0.9067 0.9067 0.9067 0.9067 0.9266 0.9266 0.9266 0.9266 1.3548 1.3548 1.3548 1.3548 2.2305 2.2305 2.2305 2.2305 2.6261 2.6261 2.6261 2.6261 2.8201 2.8201 2.8201 2.8201 3.2971 3.2971 3.2971 3.2971 3.6244 3.6244 3.6244 3.6244 4.1514 4.1514 4.1514 4.1514 4.3236 4.3236 4.3236 4.3236 4.4247 4.4247 4.4247 4.4247 4.5785 4.5785 4.5785 4.5785 4.7185 4.7185 4.7185 4.7185 4.8364 4.8364 4.8364 4.8364 5.5888 5.5888 5.5888 5.5888 6.0728 6.0728 6.0728 6.0728 7.0859 7.0859 7.0859 7.0859 k = 0.0000 0.0656 0.1518 ( 5092 PWs) bands (ev): -13.5349 -13.5349 -13.5349 -13.5349 -12.8172 -12.8172 -12.8172 -12.8172 -12.0870 -12.0870 -12.0870 -12.0870 -11.3493 -11.3493 -11.3493 -11.3493 -0.6350 -0.6350 -0.6350 -0.6350 -0.1677 -0.1677 -0.1677 -0.1677 0.4484 0.4484 0.4484 0.4484 0.9080 0.9080 0.9080 0.9080 0.9285 0.9285 0.9285 0.9285 1.3548 1.3548 1.3548 1.3548 2.2246 2.2246 2.2246 2.2246 2.6226 2.6226 2.6226 2.6226 2.8192 2.8192 2.8192 2.8192 3.3068 3.3068 3.3068 3.3068 3.6210 3.6210 3.6210 3.6210 4.1660 4.1660 4.1660 4.1660 4.3240 4.3240 4.3240 4.3240 4.4225 4.4225 4.4225 4.4225 4.5673 4.5673 4.5673 4.5673 4.7203 4.7203 4.7203 4.7203 4.8398 4.8398 4.8398 4.8398 5.5873 5.5873 5.5873 5.5873 6.0637 6.0637 6.0637 6.0637 7.0869 7.0869 7.0869 7.0869 k = 0.0000 0.0563 0.1518 ( 5104 PWs) bands (ev): -13.5402 -13.5402 -13.5402 -13.5402 -12.8142 -12.8142 -12.8142 -12.8142 -12.0861 -12.0861 -12.0861 -12.0861 -11.3461 -11.3461 -11.3461 -11.3461 -0.6362 -0.6362 -0.6362 -0.6362 -0.1631 -0.1631 -0.1631 -0.1631 0.4400 0.4400 0.4400 0.4400 0.9092 0.9092 0.9092 0.9092 0.9302 0.9302 0.9302 0.9302 1.3550 1.3550 1.3550 1.3550 2.2191 2.2191 2.2191 2.2191 2.6194 2.6194 2.6194 2.6194 2.8183 2.8183 2.8183 2.8183 3.3153 3.3153 3.3153 3.3153 3.6179 3.6179 3.6179 3.6179 4.1792 4.1792 4.1792 4.1792 4.3254 4.3254 4.3254 4.3254 4.4205 4.4205 4.4205 4.4205 4.5556 4.5556 4.5556 4.5556 4.7223 4.7223 4.7223 4.7223 4.8427 4.8427 4.8427 4.8427 5.5858 5.5858 5.5858 5.5858 6.0557 6.0557 6.0557 6.0557 7.0878 7.0878 7.0878 7.0878 k = 0.0000 0.0469 0.1518 ( 5088 PWs) bands (ev): -13.5448 -13.5448 -13.5448 -13.5448 -12.8118 -12.8118 -12.8118 -12.8118 -12.0853 -12.0853 -12.0853 -12.0853 -11.3433 -11.3433 -11.3433 -11.3433 -0.6372 -0.6372 -0.6372 -0.6372 -0.1589 -0.1589 -0.1589 -0.1589 0.4328 0.4328 0.4328 0.4328 0.9103 0.9103 0.9103 0.9103 0.9317 0.9317 0.9317 0.9317 1.3553 1.3553 1.3553 1.3553 2.2141 2.2141 2.2141 2.2141 2.6167 2.6167 2.6167 2.6167 2.8174 2.8174 2.8174 2.8174 3.3227 3.3227 3.3227 3.3227 3.6153 3.6153 3.6153 3.6153 4.1908 4.1908 4.1908 4.1908 4.3276 4.3276 4.3276 4.3276 4.4190 4.4190 4.4190 4.4190 4.5442 4.5442 4.5442 4.5442 4.7245 4.7245 4.7245 4.7245 4.8453 4.8453 4.8453 4.8453 5.5845 5.5845 5.5845 5.5845 6.0489 6.0489 6.0489 6.0489 7.0886 7.0886 7.0886 7.0886 k = 0.0000 0.0375 0.1518 ( 5096 PWs) bands (ev): -13.5486 -13.5486 -13.5486 -13.5486 -12.8098 -12.8098 -12.8098 -12.8098 -12.0847 -12.0847 -12.0847 -12.0847 -11.3409 -11.3409 -11.3409 -11.3409 -0.6382 -0.6382 -0.6382 -0.6382 -0.1554 -0.1554 -0.1554 -0.1554 0.4269 0.4269 0.4269 0.4269 0.9111 0.9111 0.9111 0.9111 0.9329 0.9329 0.9329 0.9329 1.3556 1.3556 1.3556 1.3556 2.2097 2.2097 2.2097 2.2097 2.6144 2.6144 2.6144 2.6144 2.8167 2.8167 2.8167 2.8167 3.3288 3.3288 3.3288 3.3288 3.6131 3.6131 3.6131 3.6131 4.2004 4.2004 4.2004 4.2004 4.3306 4.3306 4.3306 4.3306 4.4177 4.4177 4.4177 4.4177 4.5334 4.5334 4.5334 4.5334 4.7264 4.7264 4.7264 4.7264 4.8474 4.8474 4.8474 4.8474 5.5834 5.5834 5.5834 5.5834 6.0434 6.0434 6.0434 6.0434 7.0893 7.0893 7.0893 7.0893 k = 0.0000 0.0281 0.1518 ( 5092 PWs) bands (ev): -13.5515 -13.5515 -13.5515 -13.5515 -12.8082 -12.8082 -12.8082 -12.8082 -12.0842 -12.0842 -12.0842 -12.0842 -11.3391 -11.3391 -11.3391 -11.3391 -0.6391 -0.6391 -0.6391 -0.6391 -0.1525 -0.1525 -0.1525 -0.1525 0.4223 0.4223 0.4223 0.4223 0.9118 0.9118 0.9118 0.9118 0.9338 0.9338 0.9338 0.9338 1.3558 1.3558 1.3558 1.3558 2.2062 2.2062 2.2062 2.2062 2.6126 2.6126 2.6126 2.6126 2.8162 2.8162 2.8162 2.8162 3.3336 3.3336 3.3336 3.3336 3.6113 3.6113 3.6113 3.6113 4.2079 4.2079 4.2079 4.2079 4.3340 4.3340 4.3340 4.3340 4.4168 4.4168 4.4168 4.4168 4.5239 4.5239 4.5239 4.5239 4.7281 4.7281 4.7281 4.7281 4.8490 4.8490 4.8490 4.8490 5.5825 5.5825 5.5825 5.5825 6.0390 6.0390 6.0390 6.0390 7.0898 7.0898 7.0898 7.0898 k = 0.0000 0.0188 0.1518 ( 5086 PWs) bands (ev): -13.5536 -13.5536 -13.5536 -13.5536 -12.8071 -12.8071 -12.8071 -12.8071 -12.0838 -12.0838 -12.0838 -12.0838 -11.3378 -11.3378 -11.3378 -11.3378 -0.6397 -0.6397 -0.6397 -0.6397 -0.1504 -0.1504 -0.1504 -0.1504 0.4189 0.4189 0.4189 0.4189 0.9123 0.9123 0.9123 0.9123 0.9345 0.9345 0.9345 0.9345 1.3561 1.3561 1.3561 1.3561 2.2036 2.2036 2.2036 2.2036 2.6113 2.6113 2.6113 2.6113 2.8158 2.8158 2.8158 2.8158 3.3371 3.3371 3.3371 3.3371 3.6101 3.6101 3.6101 3.6101 4.2131 4.2131 4.2131 4.2131 4.3372 4.3372 4.3372 4.3372 4.4163 4.4163 4.4163 4.4163 4.5165 4.5165 4.5165 4.5165 4.7293 4.7293 4.7293 4.7293 4.8502 4.8502 4.8502 4.8502 5.5818 5.5818 5.5818 5.5818 6.0359 6.0359 6.0359 6.0359 7.0902 7.0902 7.0902 7.0902 k = 0.0000 0.0094 0.1518 ( 5084 PWs) bands (ev): -13.5548 -13.5548 -13.5548 -13.5548 -12.8065 -12.8065 -12.8065 -12.8065 -12.0835 -12.0835 -12.0835 -12.0835 -11.3370 -11.3370 -11.3370 -11.3370 -0.6401 -0.6401 -0.6401 -0.6401 -0.1491 -0.1491 -0.1491 -0.1491 0.4170 0.4170 0.4170 0.4170 0.9126 0.9126 0.9126 0.9126 0.9350 0.9350 0.9350 0.9350 1.3562 1.3562 1.3562 1.3562 2.2020 2.2020 2.2020 2.2020 2.6106 2.6106 2.6106 2.6106 2.8155 2.8155 2.8155 2.8155 3.3392 3.3392 3.3392 3.3392 3.6094 3.6094 3.6094 3.6094 4.2162 4.2162 4.2162 4.2162 4.3394 4.3394 4.3394 4.3394 4.4160 4.4160 4.4160 4.4160 4.5115 4.5115 4.5115 4.5115 4.7300 4.7300 4.7300 4.7300 4.8509 4.8509 4.8509 4.8509 5.5814 5.5814 5.5814 5.5814 6.0340 6.0340 6.0340 6.0340 7.0904 7.0904 7.0904 7.0904 k = 0.0000 0.0000 0.1518 ( 5066 PWs) bands (ev): -13.5553 -13.5553 -13.5553 -13.5553 -12.8063 -12.8063 -12.8063 -12.8063 -12.0835 -12.0835 -12.0835 -12.0835 -11.3367 -11.3367 -11.3367 -11.3367 -0.6402 -0.6402 -0.6402 -0.6402 -0.1486 -0.1486 -0.1486 -0.1486 0.4163 0.4163 0.4163 0.4163 0.9127 0.9127 0.9127 0.9127 0.9352 0.9352 0.9352 0.9352 1.3563 1.3563 1.3563 1.3563 2.2015 2.2015 2.2015 2.2015 2.6103 2.6103 2.6103 2.6103 2.8155 2.8155 2.8155 2.8155 3.3399 3.3399 3.3399 3.3399 3.6092 3.6092 3.6092 3.6092 4.2172 4.2172 4.2172 4.2172 4.3403 4.3403 4.3403 4.3403 4.4159 4.4159 4.4159 4.4159 4.5098 4.5098 4.5098 4.5098 4.7304 4.7304 4.7304 4.7304 4.8512 4.8512 4.8512 4.8512 5.5813 5.5813 5.5813 5.5813 6.0334 6.0334 6.0334 6.0334 7.0905 7.0905 7.0905 7.0905 k = 0.0000 0.3282-0.0000 ( 5078 PWs) bands (ev): -13.1959 -13.1959 -13.1959 -13.1959 -13.0781 -13.0781 -13.0781 -13.0781 -12.1037 -12.1037 -12.1037 -12.1037 -11.4722 -11.4722 -11.4722 -11.4722 -0.6611 -0.6611 -0.6611 -0.6611 -0.2600 -0.2600 -0.2600 -0.2600 0.7889 0.7889 0.7889 0.7889 0.8423 0.8423 0.8423 0.8423 0.8939 0.8939 0.8939 0.8939 1.4925 1.4925 1.4925 1.4925 2.2366 2.2366 2.2366 2.2366 2.6503 2.6503 2.6503 2.6503 2.7245 2.7245 2.7245 2.7245 3.2698 3.2698 3.2698 3.2698 3.6939 3.6939 3.6939 3.6939 3.8111 3.8111 3.8111 3.8111 4.3216 4.3216 4.3216 4.3216 4.3586 4.3586 4.3586 4.3586 4.6141 4.6141 4.6141 4.6141 4.8163 4.8163 4.8163 4.8163 4.9416 4.9416 4.9416 4.9416 5.5509 5.5509 5.5509 5.5509 6.4822 6.4822 6.4822 6.4822 6.9778 6.9778 6.9778 6.9778 k = 0.0000 0.3282 0.0095 ( 5076 PWs) bands (ev): -13.1958 -13.1958 -13.1958 -13.1958 -13.0781 -13.0781 -13.0781 -13.0781 -12.1037 -12.1037 -12.1037 -12.1037 -11.4722 -11.4722 -11.4722 -11.4722 -0.6613 -0.6613 -0.6613 -0.6613 -0.2599 -0.2599 -0.2599 -0.2599 0.7892 0.7892 0.7892 0.7892 0.8424 0.8424 0.8424 0.8424 0.8938 0.8938 0.8938 0.8938 1.4935 1.4935 1.4935 1.4935 2.2345 2.2345 2.2345 2.2345 2.6505 2.6505 2.6505 2.6505 2.7246 2.7246 2.7246 2.7246 3.2684 3.2684 3.2684 3.2684 3.6969 3.6969 3.6969 3.6969 3.8103 3.8103 3.8103 3.8103 4.3223 4.3223 4.3223 4.3223 4.3596 4.3596 4.3596 4.3596 4.6131 4.6131 4.6131 4.6131 4.8154 4.8154 4.8154 4.8154 4.9422 4.9422 4.9422 4.9422 5.5506 5.5506 5.5506 5.5506 6.4824 6.4824 6.4824 6.4824 6.9776 6.9776 6.9776 6.9776 k = 0.0000 0.3282 0.0190 ( 5080 PWs) bands (ev): -13.1956 -13.1956 -13.1956 -13.1956 -13.0783 -13.0783 -13.0783 -13.0783 -12.1036 -12.1036 -12.1036 -12.1036 -11.4722 -11.4722 -11.4722 -11.4722 -0.6620 -0.6620 -0.6620 -0.6620 -0.2595 -0.2595 -0.2595 -0.2595 0.7902 0.7902 0.7902 0.7902 0.8427 0.8427 0.8427 0.8427 0.8934 0.8934 0.8934 0.8934 1.4964 1.4964 1.4964 1.4964 2.2283 2.2283 2.2283 2.2283 2.6506 2.6506 2.6506 2.6506 2.7249 2.7249 2.7249 2.7249 3.2645 3.2645 3.2645 3.2645 3.7054 3.7054 3.7054 3.7054 3.8078 3.8078 3.8078 3.8078 4.3241 4.3241 4.3241 4.3241 4.3626 4.3626 4.3626 4.3626 4.6100 4.6100 4.6100 4.6100 4.8128 4.8128 4.8128 4.8128 4.9439 4.9439 4.9439 4.9439 5.5495 5.5495 5.5495 5.5495 6.4830 6.4830 6.4830 6.4830 6.9767 6.9767 6.9767 6.9767 k = 0.0000 0.3282 0.0285 ( 5080 PWs) bands (ev): -13.1954 -13.1954 -13.1954 -13.1954 -13.0787 -13.0787 -13.0787 -13.0787 -12.1035 -12.1035 -12.1035 -12.1035 -11.4723 -11.4723 -11.4723 -11.4723 -0.6631 -0.6631 -0.6631 -0.6631 -0.2589 -0.2589 -0.2589 -0.2589 0.7918 0.7918 0.7918 0.7918 0.8433 0.8433 0.8433 0.8433 0.8927 0.8927 0.8927 0.8927 1.5012 1.5012 1.5012 1.5012 2.2185 2.2185 2.2185 2.2185 2.6505 2.6505 2.6505 2.6505 2.7254 2.7254 2.7254 2.7254 3.2590 3.2590 3.2590 3.2590 3.7186 3.7186 3.7186 3.7186 3.8040 3.8040 3.8040 3.8040 4.3267 4.3267 4.3267 4.3267 4.3681 4.3681 4.3681 4.3681 4.6049 4.6049 4.6049 4.6049 4.8084 4.8084 4.8084 4.8084 4.9467 4.9467 4.9467 4.9467 5.5479 5.5479 5.5479 5.5479 6.4839 6.4839 6.4839 6.4839 6.9754 6.9754 6.9754 6.9754 k = 0.0000 0.3282 0.0379 ( 5076 PWs) bands (ev): -13.1950 -13.1950 -13.1950 -13.1950 -13.0791 -13.0791 -13.0791 -13.0791 -12.1033 -12.1033 -12.1033 -12.1033 -11.4723 -11.4723 -11.4723 -11.4723 -0.6645 -0.6645 -0.6645 -0.6645 -0.2581 -0.2581 -0.2581 -0.2581 0.7939 0.7939 0.7939 0.7939 0.8441 0.8441 0.8441 0.8441 0.8919 0.8919 0.8919 0.8919 1.5078 1.5078 1.5078 1.5078 2.2056 2.2056 2.2056 2.2056 2.6496 2.6496 2.6496 2.6496 2.7262 2.7262 2.7262 2.7262 3.2529 3.2529 3.2529 3.2529 3.7352 3.7352 3.7352 3.7352 3.7993 3.7993 3.7993 3.7993 4.3296 4.3296 4.3296 4.3296 4.3762 4.3762 4.3762 4.3762 4.5981 4.5981 4.5981 4.5981 4.8024 4.8024 4.8024 4.8024 4.9504 4.9504 4.9504 4.9504 5.5455 5.5455 5.5455 5.5455 6.4852 6.4852 6.4852 6.4852 6.9734 6.9734 6.9734 6.9734 k = 0.0000 0.3282 0.0474 ( 5066 PWs) bands (ev): -13.1946 -13.1946 -13.1946 -13.1946 -13.0796 -13.0796 -13.0796 -13.0796 -12.1031 -12.1031 -12.1031 -12.1031 -11.4724 -11.4724 -11.4724 -11.4724 -0.6663 -0.6663 -0.6663 -0.6663 -0.2571 -0.2571 -0.2571 -0.2571 0.7966 0.7966 0.7966 0.7966 0.8451 0.8451 0.8451 0.8451 0.8908 0.8908 0.8908 0.8908 1.5159 1.5159 1.5159 1.5159 2.1903 2.1903 2.1903 2.1903 2.6474 2.6474 2.6474 2.6474 2.7271 2.7271 2.7271 2.7271 3.2472 3.2472 3.2472 3.2472 3.7532 3.7532 3.7532 3.7532 3.7947 3.7947 3.7947 3.7947 4.3327 4.3327 4.3327 4.3327 4.3871 4.3871 4.3871 4.3871 4.5896 4.5896 4.5896 4.5896 4.7947 4.7947 4.7947 4.7947 4.9549 4.9549 4.9549 4.9549 5.5427 5.5427 5.5427 5.5427 6.4868 6.4868 6.4868 6.4868 6.9708 6.9708 6.9708 6.9708 k = 0.0000 0.3282 0.0569 ( 5066 PWs) bands (ev): -13.1941 -13.1941 -13.1941 -13.1941 -13.0803 -13.0803 -13.0803 -13.0803 -12.1029 -12.1029 -12.1029 -12.1029 -11.4725 -11.4725 -11.4725 -11.4725 -0.6683 -0.6683 -0.6683 -0.6683 -0.2560 -0.2560 -0.2560 -0.2560 0.7997 0.7997 0.7997 0.7997 0.8463 0.8463 0.8463 0.8463 0.8895 0.8895 0.8895 0.8895 1.5254 1.5254 1.5254 1.5254 2.1732 2.1732 2.1732 2.1732 2.6434 2.6434 2.6434 2.6434 2.7282 2.7282 2.7282 2.7282 3.2427 3.2427 3.2427 3.2427 3.7677 3.7677 3.7677 3.7677 3.7942 3.7942 3.7942 3.7942 4.3359 4.3359 4.3359 4.3359 4.4003 4.4003 4.4003 4.4003 4.5797 4.5797 4.5797 4.5797 4.7854 4.7854 4.7854 4.7854 4.9599 4.9599 4.9599 4.9599 5.5394 5.5394 5.5394 5.5394 6.4886 6.4886 6.4886 6.4886 6.9678 6.9678 6.9678 6.9678 k = 0.0000 0.3282 0.0664 ( 5080 PWs) bands (ev): -13.1935 -13.1935 -13.1935 -13.1935 -13.0809 -13.0809 -13.0809 -13.0809 -12.1027 -12.1027 -12.1027 -12.1027 -11.4726 -11.4726 -11.4726 -11.4726 -0.6704 -0.6704 -0.6704 -0.6704 -0.2548 -0.2548 -0.2548 -0.2548 0.8031 0.8031 0.8031 0.8031 0.8477 0.8477 0.8477 0.8477 0.8879 0.8879 0.8879 0.8879 1.5361 1.5361 1.5361 1.5361 2.1551 2.1551 2.1551 2.1551 2.6376 2.6376 2.6376 2.6376 2.7293 2.7293 2.7293 2.7293 3.2399 3.2399 3.2399 3.2399 3.7697 3.7697 3.7697 3.7697 3.8061 3.8061 3.8061 3.8061 4.3395 4.3395 4.3395 4.3395 4.4155 4.4155 4.4155 4.4155 4.5685 4.5685 4.5685 4.5685 4.7747 4.7747 4.7747 4.7747 4.9653 4.9653 4.9653 4.9653 5.5357 5.5357 5.5357 5.5357 6.4906 6.4906 6.4906 6.4906 6.9643 6.9643 6.9643 6.9643 k = 0.0000 0.3282 0.0759 ( 5076 PWs) bands (ev): -13.1930 -13.1930 -13.1930 -13.1930 -13.0817 -13.0817 -13.0817 -13.0817 -12.1024 -12.1024 -12.1024 -12.1024 -11.4727 -11.4727 -11.4727 -11.4727 -0.6726 -0.6726 -0.6726 -0.6726 -0.2537 -0.2537 -0.2537 -0.2537 0.8066 0.8066 0.8066 0.8066 0.8493 0.8493 0.8493 0.8493 0.8862 0.8862 0.8862 0.8862 1.5475 1.5475 1.5475 1.5475 2.1366 2.1366 2.1366 2.1366 2.6302 2.6302 2.6302 2.6302 2.7306 2.7306 2.7306 2.7306 3.2390 3.2390 3.2390 3.2390 3.7646 3.7646 3.7646 3.7646 3.8246 3.8246 3.8246 3.8246 4.3438 4.3438 4.3438 4.3438 4.4322 4.4322 4.4322 4.4322 4.5564 4.5564 4.5564 4.5564 4.7626 4.7626 4.7626 4.7626 4.9710 4.9710 4.9710 4.9710 5.5317 5.5317 5.5317 5.5317 6.4927 6.4927 6.4927 6.4927 6.9605 6.9605 6.9605 6.9605 k = 0.0000 0.3282 0.0854 ( 5080 PWs) bands (ev): -13.1924 -13.1924 -13.1924 -13.1924 -13.0824 -13.0824 -13.0824 -13.0824 -12.1022 -12.1022 -12.1022 -12.1022 -11.4729 -11.4729 -11.4729 -11.4729 -0.6748 -0.6748 -0.6748 -0.6748 -0.2525 -0.2525 -0.2525 -0.2525 0.8103 0.8103 0.8103 0.8103 0.8511 0.8511 0.8511 0.8511 0.8843 0.8843 0.8843 0.8843 1.5594 1.5594 1.5594 1.5594 2.1184 2.1184 2.1184 2.1184 2.6214 2.6214 2.6214 2.6214 2.7319 2.7319 2.7319 2.7319 3.2399 3.2399 3.2399 3.2399 3.7581 3.7581 3.7581 3.7581 3.8433 3.8433 3.8433 3.8433 4.3490 4.3490 4.3490 4.3490 4.4498 4.4498 4.4498 4.4498 4.5438 4.5438 4.5438 4.5438 4.7493 4.7493 4.7493 4.7493 4.9766 4.9766 4.9766 4.9766 5.5277 5.5277 5.5277 5.5277 6.4949 6.4949 6.4949 6.4949 6.9567 6.9567 6.9567 6.9567 k = 0.0000 0.3282 0.0949 ( 5084 PWs) bands (ev): -13.1918 -13.1918 -13.1918 -13.1918 -13.0831 -13.0831 -13.0831 -13.0831 -12.1019 -12.1019 -12.1019 -12.1019 -11.4730 -11.4730 -11.4730 -11.4730 -0.6769 -0.6769 -0.6769 -0.6769 -0.2514 -0.2514 -0.2514 -0.2514 0.8138 0.8138 0.8138 0.8138 0.8530 0.8530 0.8530 0.8530 0.8823 0.8823 0.8823 0.8823 1.5713 1.5713 1.5713 1.5713 2.1010 2.1010 2.1010 2.1010 2.6118 2.6118 2.6118 2.6118 2.7332 2.7332 2.7332 2.7332 3.2421 3.2421 3.2421 3.2421 3.7516 3.7516 3.7516 3.7516 3.8607 3.8607 3.8607 3.8607 4.3553 4.3553 4.3553 4.3553 4.4673 4.4673 4.4673 4.4673 4.5314 4.5314 4.5314 4.5314 4.7348 4.7348 4.7348 4.7348 4.9819 4.9819 4.9819 4.9819 5.5237 5.5237 5.5237 5.5237 6.4970 6.4970 6.4970 6.4970 6.9529 6.9529 6.9529 6.9529 k = 0.0000 0.3282 0.1043 ( 5080 PWs) bands (ev): -13.1913 -13.1913 -13.1913 -13.1913 -13.0837 -13.0837 -13.0837 -13.0837 -12.1017 -12.1017 -12.1017 -12.1017 -11.4731 -11.4731 -11.4731 -11.4731 -0.6788 -0.6788 -0.6788 -0.6788 -0.2504 -0.2504 -0.2504 -0.2504 0.8171 0.8171 0.8171 0.8171 0.8550 0.8550 0.8550 0.8550 0.8802 0.8802 0.8802 0.8802 1.5826 1.5826 1.5826 1.5826 2.0850 2.0850 2.0850 2.0850 2.6021 2.6021 2.6021 2.6021 2.7344 2.7344 2.7344 2.7344 3.2451 3.2451 3.2451 3.2451 3.7456 3.7456 3.7456 3.7456 3.8760 3.8760 3.8760 3.8760 4.3628 4.3628 4.3628 4.3628 4.4823 4.4823 4.4823 4.4823 4.5215 4.5215 4.5215 4.5215 4.7197 4.7197 4.7197 4.7197 4.9869 4.9869 4.9869 4.9869 5.5200 5.5200 5.5200 5.5200 6.4990 6.4990 6.4990 6.4990 6.9493 6.9493 6.9493 6.9493 k = 0.0000 0.3282 0.1138 ( 5080 PWs) bands (ev): -13.1908 -13.1908 -13.1908 -13.1908 -13.0843 -13.0843 -13.0843 -13.0843 -12.1015 -12.1015 -12.1015 -12.1015 -11.4731 -11.4731 -11.4731 -11.4731 -0.6805 -0.6805 -0.6805 -0.6805 -0.2496 -0.2496 -0.2496 -0.2496 0.8200 0.8200 0.8200 0.8200 0.8571 0.8571 0.8571 0.8571 0.8780 0.8780 0.8780 0.8780 1.5930 1.5930 1.5930 1.5930 2.0709 2.0709 2.0709 2.0709 2.5931 2.5931 2.5931 2.5931 2.7355 2.7355 2.7355 2.7355 3.2486 3.2486 3.2486 3.2486 3.7403 3.7403 3.7403 3.7403 3.8888 3.8888 3.8888 3.8888 4.3714 4.3714 4.3714 4.3714 4.4865 4.4865 4.4865 4.4865 4.5222 4.5222 4.5222 4.5222 4.7040 4.7040 4.7040 4.7040 4.9912 4.9912 4.9912 4.9912 5.5166 5.5166 5.5166 5.5166 6.5008 6.5008 6.5008 6.5008 6.9461 6.9461 6.9461 6.9461 k = 0.0000 0.3282 0.1233 ( 5076 PWs) bands (ev): -13.1904 -13.1904 -13.1904 -13.1904 -13.0848 -13.0848 -13.0848 -13.0848 -12.1014 -12.1014 -12.1014 -12.1014 -11.4732 -11.4732 -11.4732 -11.4732 -0.6818 -0.6818 -0.6818 -0.6818 -0.2489 -0.2489 -0.2489 -0.2489 0.8224 0.8224 0.8224 0.8224 0.8592 0.8592 0.8592 0.8592 0.8759 0.8759 0.8759 0.8759 1.6019 1.6019 1.6019 1.6019 2.0593 2.0593 2.0593 2.0593 2.5853 2.5853 2.5853 2.5853 2.7364 2.7364 2.7364 2.7364 3.2518 3.2518 3.2518 3.2518 3.7361 3.7361 3.7361 3.7361 3.8989 3.8989 3.8989 3.8989 4.3808 4.3808 4.3808 4.3808 4.4783 4.4783 4.4783 4.4783 4.5348 4.5348 4.5348 4.5348 4.6885 4.6885 4.6885 4.6885 4.9948 4.9948 4.9948 4.9948 5.5138 5.5138 5.5138 5.5138 6.5023 6.5023 6.5023 6.5023 6.9435 6.9435 6.9435 6.9435 k = 0.0000 0.3282 0.1328 ( 5066 PWs) bands (ev): -13.1901 -13.1901 -13.1901 -13.1901 -13.0851 -13.0851 -13.0851 -13.0851 -12.1012 -12.1012 -12.1012 -12.1012 -11.4733 -11.4733 -11.4733 -11.4733 -0.6828 -0.6828 -0.6828 -0.6828 -0.2484 -0.2484 -0.2484 -0.2484 0.8242 0.8242 0.8242 0.8242 0.8612 0.8612 0.8612 0.8612 0.8738 0.8738 0.8738 0.8738 1.6087 1.6087 1.6087 1.6087 2.0506 2.0506 2.0506 2.0506 2.5793 2.5793 2.5793 2.5793 2.7370 2.7370 2.7370 2.7370 3.2545 3.2545 3.2545 3.2545 3.7330 3.7330 3.7330 3.7330 3.9062 3.9062 3.9062 3.9062 4.3903 4.3903 4.3903 4.3903 4.4673 4.4673 4.4673 4.4673 4.5495 4.5495 4.5495 4.5495 4.6743 4.6743 4.6743 4.6743 4.9976 4.9976 4.9976 4.9976 5.5117 5.5117 5.5117 5.5117 6.5034 6.5034 6.5034 6.5034 6.9415 6.9415 6.9415 6.9415 k = 0.0000 0.3282 0.1423 ( 5062 PWs) bands (ev): -13.1899 -13.1899 -13.1899 -13.1899 -13.0854 -13.0854 -13.0854 -13.0854 -12.1012 -12.1012 -12.1012 -12.1012 -11.4733 -11.4733 -11.4733 -11.4733 -0.6834 -0.6834 -0.6834 -0.6834 -0.2480 -0.2480 -0.2480 -0.2480 0.8254 0.8254 0.8254 0.8254 0.8629 0.8629 0.8629 0.8629 0.8721 0.8721 0.8721 0.8721 1.6130 1.6130 1.6130 1.6130 2.0451 2.0451 2.0451 2.0451 2.5755 2.5755 2.5755 2.5755 2.7375 2.7375 2.7375 2.7375 3.2563 3.2563 3.2563 3.2563 3.7310 3.7310 3.7310 3.7310 3.9105 3.9105 3.9105 3.9105 4.3983 4.3983 4.3983 4.3983 4.4580 4.4580 4.4580 4.4580 4.5611 4.5611 4.5611 4.5611 4.6634 4.6634 4.6634 4.6634 4.9992 4.9992 4.9992 4.9992 5.5104 5.5104 5.5104 5.5104 6.5041 6.5041 6.5041 6.5041 6.9403 6.9403 6.9403 6.9403 k = 0.0000 0.3282 0.1518 ( 5072 PWs) bands (ev): -13.1899 -13.1899 -13.1899 -13.1899 -13.0854 -13.0854 -13.0854 -13.0854 -12.1012 -12.1012 -12.1012 -12.1012 -11.4733 -11.4733 -11.4733 -11.4733 -0.6836 -0.6836 -0.6836 -0.6836 -0.2480 -0.2480 -0.2480 -0.2480 0.8257 0.8257 0.8257 0.8257 0.8637 0.8637 0.8637 0.8637 0.8713 0.8713 0.8713 0.8713 1.6144 1.6144 1.6144 1.6144 2.0432 2.0432 2.0432 2.0432 2.5742 2.5742 2.5742 2.5742 2.7376 2.7376 2.7376 2.7376 3.2568 3.2568 3.2568 3.2568 3.7304 3.7304 3.7304 3.7304 3.9119 3.9119 3.9119 3.9119 4.4017 4.4017 4.4017 4.4017 4.4540 4.4540 4.4540 4.4540 4.5656 4.5656 4.5656 4.5656 4.6591 4.6591 4.6591 4.6591 4.9997 4.9997 4.9997 4.9997 5.5099 5.5099 5.5099 5.5099 6.5043 6.5043 6.5043 6.5043 6.9399 6.9399 6.9399 6.9399 k = 0.5000-0.0000 0.1518 ( 5104 PWs) bands (ev): -12.8434 -12.8434 -12.8434 -12.8434 -12.8395 -12.8395 -12.8395 -12.8395 -11.5839 -11.5839 -11.5839 -11.5839 -11.5836 -11.5836 -11.5836 -11.5836 -0.2520 -0.2520 -0.2520 -0.2520 -0.2512 -0.2512 -0.2512 -0.2512 0.2688 0.2688 0.2688 0.2688 0.2742 0.2742 0.2742 0.2742 1.5821 1.5821 1.5821 1.5821 1.5833 1.5833 1.5833 1.5833 1.9490 1.9490 1.9490 1.9490 1.9551 1.9551 1.9551 1.9551 2.2734 2.2734 2.2734 2.2734 2.2770 2.2770 2.2770 2.2770 3.2343 3.2343 3.2343 3.2343 3.2393 3.2393 3.2393 3.2393 4.3120 4.3120 4.3120 4.3120 4.3573 4.3573 4.3573 4.3573 4.7882 4.7882 4.7882 4.7882 4.7992 4.7992 4.7992 4.7992 5.3820 5.3820 5.3820 5.3820 5.4266 5.4266 5.4266 5.4266 6.2443 6.2443 6.2443 6.2443 6.2569 6.2569 6.2569 6.2569 k = 0.5000-0.0000 0.1423 ( 5106 PWs) bands (ev): -12.8437 -12.8437 -12.8437 -12.8437 -12.8392 -12.8392 -12.8392 -12.8392 -11.5849 -11.5849 -11.5849 -11.5849 -11.5826 -11.5826 -11.5826 -11.5826 -0.2753 -0.2753 -0.2753 -0.2753 -0.2274 -0.2274 -0.2274 -0.2274 0.2665 0.2665 0.2665 0.2665 0.2770 0.2770 0.2770 0.2770 1.5735 1.5735 1.5735 1.5735 1.5889 1.5889 1.5889 1.5889 1.9383 1.9383 1.9383 1.9383 1.9658 1.9658 1.9658 1.9658 2.2723 2.2723 2.2723 2.2723 2.2804 2.2804 2.2804 2.2804 3.2282 3.2282 3.2282 3.2282 3.2452 3.2452 3.2452 3.2452 4.3055 4.3055 4.3055 4.3055 4.3636 4.3636 4.3636 4.3636 4.7882 4.7882 4.7882 4.7882 4.7996 4.7996 4.7996 4.7996 5.3768 5.3768 5.3768 5.3768 5.4313 5.4313 5.4313 5.4313 6.2402 6.2402 6.2402 6.2402 6.2612 6.2612 6.2612 6.2612 k = 0.5000-0.0000 0.1328 ( 5102 PWs) bands (ev): -12.8446 -12.8446 -12.8446 -12.8446 -12.8383 -12.8383 -12.8383 -12.8383 -11.5860 -11.5860 -11.5860 -11.5860 -11.5814 -11.5814 -11.5814 -11.5814 -0.2983 -0.2983 -0.2983 -0.2983 -0.2029 -0.2029 -0.2029 -0.2029 0.2634 0.2634 0.2634 0.2634 0.2819 0.2819 0.2819 0.2819 1.5612 1.5612 1.5612 1.5612 1.5926 1.5926 1.5926 1.5926 1.9258 1.9258 1.9258 1.9258 1.9782 1.9782 1.9782 1.9782 2.2719 2.2719 2.2719 2.2719 2.2876 2.2876 2.2876 2.2876 3.2201 3.2201 3.2201 3.2201 3.2529 3.2529 3.2529 3.2529 4.2918 4.2918 4.2918 4.2918 4.3772 4.3772 4.3772 4.3772 4.7882 4.7882 4.7882 4.7882 4.8006 4.8006 4.8006 4.8006 5.3652 5.3652 5.3652 5.3652 5.4420 5.4420 5.4420 5.4420 6.2331 6.2331 6.2331 6.2331 6.2689 6.2689 6.2689 6.2689 k = 0.5000-0.0000 0.1233 ( 5114 PWs) bands (ev): -12.8456 -12.8456 -12.8456 -12.8456 -12.8373 -12.8373 -12.8373 -12.8373 -11.5871 -11.5871 -11.5871 -11.5871 -11.5803 -11.5803 -11.5803 -11.5803 -0.3203 -0.3203 -0.3203 -0.3203 -0.1786 -0.1786 -0.1786 -0.1786 0.2608 0.2608 0.2608 0.2608 0.2873 0.2873 0.2873 0.2873 1.5455 1.5455 1.5455 1.5455 1.5942 1.5942 1.5942 1.5942 1.9147 1.9147 1.9147 1.9147 1.9892 1.9892 1.9892 1.9892 2.2729 2.2729 2.2729 2.2729 2.2977 2.2977 2.2977 2.2977 3.2117 3.2117 3.2117 3.2117 3.2604 3.2604 3.2604 3.2604 4.2758 4.2758 4.2758 4.2758 4.3927 4.3927 4.3927 4.3927 4.7882 4.7882 4.7882 4.7882 4.8023 4.8023 4.8023 4.8023 5.3511 5.3511 5.3511 5.3511 5.4544 5.4544 5.4544 5.4544 6.2256 6.2256 6.2256 6.2256 6.2772 6.2772 6.2772 6.2772 k = 0.5000-0.0000 0.1138 ( 5122 PWs) bands (ev): -12.8467 -12.8467 -12.8467 -12.8467 -12.8362 -12.8362 -12.8362 -12.8362 -11.5882 -11.5882 -11.5882 -11.5882 -11.5792 -11.5792 -11.5792 -11.5792 -0.3413 -0.3413 -0.3413 -0.3413 -0.1546 -0.1546 -0.1546 -0.1546 0.2592 0.2592 0.2592 0.2592 0.2929 0.2929 0.2929 0.2929 1.5267 1.5267 1.5267 1.5267 1.5942 1.5942 1.5942 1.5942 1.9053 1.9053 1.9053 1.9053 1.9983 1.9983 1.9983 1.9983 2.2750 2.2750 2.2750 2.2750 2.3104 2.3104 2.3104 2.3104 3.2034 3.2034 3.2034 3.2034 3.2677 3.2677 3.2677 3.2677 4.2594 4.2594 4.2594 4.2594 4.4084 4.4084 4.4084 4.4084 4.7883 4.7883 4.7883 4.7883 4.8046 4.8046 4.8046 4.8046 5.3361 5.3361 5.3361 5.3361 5.4672 5.4672 5.4672 5.4672 6.2184 6.2184 6.2184 6.2184 6.2858 6.2858 6.2858 6.2858 k = 0.5000-0.0000 0.1043 ( 5114 PWs) bands (ev): -12.8477 -12.8477 -12.8477 -12.8477 -12.8351 -12.8351 -12.8351 -12.8351 -11.5893 -11.5893 -11.5893 -11.5893 -11.5782 -11.5782 -11.5782 -11.5782 -0.3611 -0.3611 -0.3611 -0.3611 -0.1314 -0.1314 -0.1314 -0.1314 0.2587 0.2587 0.2587 0.2587 0.2985 0.2985 0.2985 0.2985 1.5052 1.5052 1.5052 1.5052 1.5930 1.5930 1.5930 1.5930 1.8980 1.8980 1.8980 1.8980 2.0053 2.0053 2.0053 2.0053 2.2779 2.2779 2.2779 2.2779 2.3255 2.3255 2.3255 2.3255 3.1950 3.1950 3.1950 3.1950 3.2747 3.2747 3.2747 3.2747 4.2432 4.2432 4.2432 4.2432 4.4238 4.4238 4.4238 4.4238 4.7885 4.7885 4.7885 4.7885 4.8075 4.8075 4.8075 4.8075 5.3208 5.3208 5.3208 5.3208 5.4797 5.4797 5.4797 5.4797 6.2114 6.2114 6.2114 6.2114 6.2945 6.2945 6.2945 6.2945 k = 0.5000-0.0000 0.0949 ( 5108 PWs) bands (ev): -12.8488 -12.8488 -12.8488 -12.8488 -12.8341 -12.8341 -12.8341 -12.8341 -11.5903 -11.5903 -11.5903 -11.5903 -11.5772 -11.5772 -11.5772 -11.5772 -0.3795 -0.3795 -0.3795 -0.3795 -0.1093 -0.1093 -0.1093 -0.1093 0.2595 0.2595 0.2595 0.2595 0.3042 0.3042 0.3042 0.3042 1.4815 1.4815 1.4815 1.4815 1.5908 1.5908 1.5908 1.5908 1.8925 1.8925 1.8925 1.8925 2.0102 2.0102 2.0102 2.0102 2.2813 2.2813 2.2813 2.2813 2.3423 2.3423 2.3423 2.3423 3.1868 3.1868 3.1868 3.1868 3.2814 3.2814 3.2814 3.2814 4.2277 4.2277 4.2277 4.2277 4.4384 4.4384 4.4384 4.4384 4.7888 4.7888 4.7888 4.7888 4.8110 4.8110 4.8110 4.8110 5.3056 5.3056 5.3056 5.3056 5.4916 5.4916 5.4916 5.4916 6.2049 6.2049 6.2049 6.2049 6.3031 6.3031 6.3031 6.3031 k = 0.5000-0.0000 0.0854 ( 5108 PWs) bands (ev): -12.8497 -12.8497 -12.8497 -12.8497 -12.8331 -12.8331 -12.8331 -12.8331 -11.5912 -11.5912 -11.5912 -11.5912 -11.5763 -11.5763 -11.5763 -11.5763 -0.3965 -0.3965 -0.3965 -0.3965 -0.0888 -0.0888 -0.0888 -0.0888 0.2617 0.2617 0.2617 0.2617 0.3096 0.3096 0.3096 0.3096 1.4564 1.4564 1.4564 1.4564 1.5881 1.5881 1.5881 1.5881 1.8887 1.8887 1.8887 1.8887 2.0135 2.0135 2.0135 2.0135 2.2850 2.2850 2.2850 2.2850 2.3602 2.3602 2.3602 2.3602 3.1788 3.1788 3.1788 3.1788 3.2876 3.2876 3.2876 3.2876 4.2129 4.2129 4.2129 4.2129 4.4520 4.4520 4.4520 4.4520 4.7891 4.7891 4.7891 4.7891 4.8149 4.8149 4.8149 4.8149 5.2908 5.2908 5.2908 5.2908 5.5028 5.5028 5.5028 5.5028 6.1987 6.1987 6.1987 6.1987 6.3116 6.3116 6.3116 6.3116 k = 0.5000-0.0000 0.0759 ( 5108 PWs) bands (ev): -12.8506 -12.8506 -12.8506 -12.8506 -12.8322 -12.8322 -12.8322 -12.8322 -11.5921 -11.5921 -11.5921 -11.5921 -11.5755 -11.5755 -11.5755 -11.5755 -0.4119 -0.4119 -0.4119 -0.4119 -0.0700 -0.0700 -0.0700 -0.0700 0.2651 0.2651 0.2651 0.2651 0.3148 0.3148 0.3148 0.3148 1.4307 1.4307 1.4307 1.4307 1.5850 1.5850 1.5850 1.5850 1.8863 1.8863 1.8863 1.8863 2.0153 2.0153 2.0153 2.0153 2.2887 2.2887 2.2887 2.2887 2.3784 2.3784 2.3784 2.3784 3.1711 3.1711 3.1711 3.1711 3.2934 3.2934 3.2934 3.2934 4.1991 4.1991 4.1991 4.1991 4.4645 4.4645 4.4645 4.4645 4.7893 4.7893 4.7893 4.7893 4.8193 4.8193 4.8193 4.8193 5.2765 5.2765 5.2765 5.2765 5.5130 5.5130 5.5130 5.5130 6.1931 6.1931 6.1931 6.1931 6.3198 6.3198 6.3198 6.3198 k = 0.5000-0.0000 0.0664 ( 5104 PWs) bands (ev): -12.8514 -12.8514 -12.8514 -12.8514 -12.8313 -12.8313 -12.8313 -12.8313 -11.5929 -11.5929 -11.5929 -11.5929 -11.5747 -11.5747 -11.5747 -11.5747 -0.4256 -0.4256 -0.4256 -0.4256 -0.0534 -0.0534 -0.0534 -0.0534 0.2699 0.2699 0.2699 0.2699 0.3197 0.3197 0.3197 0.3197 1.4053 1.4053 1.4053 1.4053 1.5819 1.5819 1.5819 1.5819 1.8849 1.8849 1.8849 1.8849 2.0161 2.0161 2.0161 2.0161 2.2924 2.2924 2.2924 2.2924 2.3963 2.3963 2.3963 2.3963 3.1638 3.1638 3.1638 3.1638 3.2986 3.2986 3.2986 3.2986 4.1866 4.1866 4.1866 4.1866 4.4757 4.4757 4.4757 4.4757 4.7897 4.7897 4.7897 4.7897 4.8239 4.8239 4.8239 4.8239 5.2630 5.2630 5.2630 5.2630 5.5223 5.5223 5.5223 5.5223 6.1880 6.1880 6.1880 6.1880 6.3277 6.3277 6.3277 6.3277 k = 0.5000-0.0000 0.0569 ( 5104 PWs) bands (ev): -12.8521 -12.8521 -12.8521 -12.8521 -12.8306 -12.8306 -12.8306 -12.8306 -11.5936 -11.5936 -11.5936 -11.5936 -11.5741 -11.5741 -11.5741 -11.5741 -0.4377 -0.4377 -0.4377 -0.4377 -0.0392 -0.0392 -0.0392 -0.0392 0.2755 0.2755 0.2755 0.2755 0.3240 0.3240 0.3240 0.3240 1.3810 1.3810 1.3810 1.3810 1.5788 1.5788 1.5788 1.5788 1.8843 1.8843 1.8843 1.8843 2.0162 2.0162 2.0162 2.0162 2.2958 2.2958 2.2958 2.2958 2.4132 2.4132 2.4132 2.4132 3.1571 3.1571 3.1571 3.1571 3.3033 3.3033 3.3033 3.3033 4.1754 4.1754 4.1754 4.1754 4.4855 4.4855 4.4855 4.4855 4.7900 4.7900 4.7900 4.7900 4.8286 4.8286 4.8286 4.8286 5.2506 5.2506 5.2506 5.2506 5.5306 5.5306 5.5306 5.5306 6.1835 6.1835 6.1835 6.1835 6.3350 6.3350 6.3350 6.3350 k = 0.5000-0.0000 0.0474 ( 5104 PWs) bands (ev): -12.8528 -12.8528 -12.8528 -12.8528 -12.8299 -12.8299 -12.8299 -12.8299 -11.5942 -11.5942 -11.5942 -11.5942 -11.5735 -11.5735 -11.5735 -11.5735 -0.4480 -0.4480 -0.4480 -0.4480 -0.0273 -0.0273 -0.0273 -0.0273 0.2818 0.2818 0.2818 0.2818 0.3279 0.3279 0.3279 0.3279 1.3587 1.3587 1.3587 1.3587 1.5759 1.5759 1.5759 1.5759 1.8841 1.8841 1.8841 1.8841 2.0159 2.0159 2.0159 2.0159 2.2988 2.2988 2.2988 2.2988 2.4285 2.4285 2.4285 2.4285 3.1510 3.1510 3.1510 3.1510 3.3074 3.3074 3.3074 3.3074 4.1657 4.1657 4.1657 4.1657 4.4939 4.4939 4.4939 4.4939 4.7903 4.7903 4.7903 4.7903 4.8332 4.8332 4.8332 4.8332 5.2394 5.2394 5.2394 5.2394 5.5376 5.5376 5.5376 5.5376 6.1795 6.1795 6.1795 6.1795 6.3417 6.3417 6.3417 6.3417 k = 0.5000-0.0000 0.0379 ( 5100 PWs) bands (ev): -12.8533 -12.8533 -12.8533 -12.8533 -12.8294 -12.8294 -12.8294 -12.8294 -11.5947 -11.5947 -11.5947 -11.5947 -11.5730 -11.5730 -11.5730 -11.5730 -0.4565 -0.4565 -0.4565 -0.4565 -0.0179 -0.0179 -0.0179 -0.0179 0.2881 0.2881 0.2881 0.2881 0.3311 0.3311 0.3311 0.3311 1.3392 1.3392 1.3392 1.3392 1.5734 1.5734 1.5734 1.5734 1.8843 1.8843 1.8843 1.8843 2.0153 2.0153 2.0153 2.0153 2.3014 2.3014 2.3014 2.3014 2.4418 2.4418 2.4418 2.4418 3.1458 3.1458 3.1458 3.1458 3.3108 3.3108 3.3108 3.3108 4.1576 4.1576 4.1576 4.1576 4.5007 4.5007 4.5007 4.5007 4.7905 4.7905 4.7905 4.7905 4.8374 4.8374 4.8374 4.8374 5.2298 5.2298 5.2298 5.2298 5.5435 5.5435 5.5435 5.5435 6.1763 6.1763 6.1763 6.1763 6.3474 6.3474 6.3474 6.3474 k = 0.5000-0.0000 0.0285 ( 5100 PWs) bands (ev): -12.8537 -12.8537 -12.8537 -12.8537 -12.8290 -12.8290 -12.8290 -12.8290 -11.5951 -11.5951 -11.5951 -11.5951 -11.5726 -11.5726 -11.5726 -11.5726 -0.4631 -0.4631 -0.4631 -0.4631 -0.0107 -0.0107 -0.0107 -0.0107 0.2939 0.2939 0.2939 0.2939 0.3337 0.3337 0.3337 0.3337 1.3232 1.3232 1.3232 1.3232 1.5714 1.5714 1.5714 1.5714 1.8846 1.8846 1.8846 1.8846 2.0147 2.0147 2.0147 2.0147 2.3035 2.3035 2.3035 2.3035 2.4525 2.4525 2.4525 2.4525 3.1416 3.1416 3.1416 3.1416 3.3135 3.3135 3.3135 3.3135 4.1512 4.1512 4.1512 4.1512 4.5060 4.5060 4.5060 4.5060 4.7907 4.7907 4.7907 4.7907 4.8410 4.8410 4.8410 4.8410 5.2220 5.2220 5.2220 5.2220 5.5481 5.5481 5.5481 5.5481 6.1737 6.1737 6.1737 6.1737 6.3522 6.3522 6.3522 6.3522 k = 0.5000-0.0000 0.0190 ( 5094 PWs) bands (ev): -12.8540 -12.8540 -12.8540 -12.8540 -12.8287 -12.8287 -12.8287 -12.8287 -11.5954 -11.5954 -11.5954 -11.5954 -11.5723 -11.5723 -11.5723 -11.5723 -0.4679 -0.4679 -0.4679 -0.4679 -0.0057 -0.0057 -0.0057 -0.0057 0.2985 0.2985 0.2985 0.2985 0.3356 0.3356 0.3356 0.3356 1.3112 1.3112 1.3112 1.3112 1.5699 1.5699 1.5699 1.5699 1.8849 1.8849 1.8849 1.8849 2.0142 2.0142 2.0142 2.0142 2.3051 2.3051 2.3051 2.3051 2.4605 2.4605 2.4605 2.4605 3.1385 3.1385 3.1385 3.1385 3.3154 3.3154 3.3154 3.3154 4.1466 4.1466 4.1466 4.1466 4.5098 4.5098 4.5098 4.5098 4.7909 4.7909 4.7909 4.7909 4.8439 4.8439 4.8439 4.8439 5.2162 5.2162 5.2162 5.2162 5.5515 5.5515 5.5515 5.5515 6.1719 6.1719 6.1719 6.1719 6.3557 6.3557 6.3557 6.3557 k = 0.5000-0.0000 0.0095 ( 5090 PWs) bands (ev): -12.8542 -12.8542 -12.8542 -12.8542 -12.8285 -12.8285 -12.8285 -12.8285 -11.5955 -11.5955 -11.5955 -11.5955 -11.5722 -11.5722 -11.5722 -11.5722 -0.4707 -0.4707 -0.4707 -0.4707 -0.0028 -0.0028 -0.0028 -0.0028 0.3015 0.3015 0.3015 0.3015 0.3368 0.3368 0.3368 0.3368 1.3038 1.3038 1.3038 1.3038 1.5689 1.5689 1.5689 1.5689 1.8851 1.8851 1.8851 1.8851 2.0139 2.0139 2.0139 2.0139 2.3060 2.3060 2.3060 2.3060 2.4653 2.4653 2.4653 2.4653 3.1365 3.1365 3.1365 3.1365 3.3166 3.3166 3.3166 3.3166 4.1438 4.1438 4.1438 4.1438 4.5121 4.5121 4.5121 4.5121 4.7910 4.7910 4.7910 4.7910 4.8456 4.8456 4.8456 4.8456 5.2126 5.2126 5.2126 5.2126 5.5535 5.5535 5.5535 5.5535 6.1708 6.1708 6.1708 6.1708 6.3580 6.3580 6.3580 6.3580 k = 0.5000-0.0000-0.0000 ( 5088 PWs) bands (ev): -12.8542 -12.8542 -12.8542 -12.8542 -12.8284 -12.8284 -12.8284 -12.8284 -11.5956 -11.5956 -11.5956 -11.5956 -11.5721 -11.5721 -11.5721 -11.5721 -0.4717 -0.4717 -0.4717 -0.4717 -0.0018 -0.0018 -0.0018 -0.0018 0.3025 0.3025 0.3025 0.3025 0.3371 0.3371 0.3371 0.3371 1.3013 1.3013 1.3013 1.3013 1.5686 1.5686 1.5686 1.5686 1.8852 1.8852 1.8852 1.8852 2.0137 2.0137 2.0137 2.0137 2.3063 2.3063 2.3063 2.3063 2.4670 2.4670 2.4670 2.4670 3.1359 3.1359 3.1359 3.1359 3.3170 3.3170 3.3170 3.3170 4.1428 4.1428 4.1428 4.1428 4.5129 4.5129 4.5129 4.5129 4.7910 4.7910 4.7910 4.7910 4.8463 4.8463 4.8463 4.8463 5.2115 5.2115 5.2115 5.2115 5.5542 5.5542 5.5542 5.5542 6.1704 6.1704 6.1704 6.1704 6.3587 6.3587 6.3587 6.3587 k = 0.5000 0.3282-0.0000 ( 5112 PWs) bands (ev): -12.8196 -12.8196 -12.8196 -12.8196 -12.8148 -12.8148 -12.8148 -12.8148 -11.6097 -11.6097 -11.6097 -11.6097 -11.6016 -11.6016 -11.6016 -11.6016 -0.3985 -0.3985 -0.3985 -0.3985 -0.0594 -0.0594 -0.0594 -0.0594 0.1396 0.1396 0.1396 0.1396 0.2849 0.2849 0.2849 0.2849 0.9600 0.9600 0.9600 0.9600 1.3461 1.3461 1.3461 1.3461 1.8970 1.8970 1.8970 1.8970 2.0979 2.0979 2.0979 2.0979 2.3050 2.3050 2.3050 2.3050 2.6455 2.6455 2.6455 2.6455 3.3899 3.3899 3.3899 3.3899 3.9112 3.9112 3.9112 3.9112 4.2624 4.2624 4.2624 4.2624 4.4960 4.4960 4.4960 4.4960 4.7992 4.7992 4.7992 4.7992 4.8553 4.8553 4.8553 4.8553 5.0726 5.0726 5.0726 5.0726 5.2418 5.2418 5.2418 5.2418 6.0826 6.0826 6.0826 6.0826 6.5436 6.5436 6.5436 6.5436 k = 0.5000 0.3282 0.0095 ( 5092 PWs) bands (ev): -12.8196 -12.8196 -12.8196 -12.8196 -12.8148 -12.8148 -12.8148 -12.8148 -11.6097 -11.6097 -11.6097 -11.6097 -11.6016 -11.6016 -11.6016 -11.6016 -0.3980 -0.3980 -0.3980 -0.3980 -0.0614 -0.0614 -0.0614 -0.0614 0.1415 0.1415 0.1415 0.1415 0.2850 0.2850 0.2850 0.2850 0.9602 0.9602 0.9602 0.9602 1.3439 1.3439 1.3439 1.3439 1.8990 1.8990 1.8990 1.8990 2.0980 2.0980 2.0980 2.0980 2.3053 2.3053 2.3053 2.3053 2.6443 2.6443 2.6443 2.6443 3.3915 3.3915 3.3915 3.3915 3.9099 3.9099 3.9099 3.9099 4.2633 4.2633 4.2633 4.2633 4.4958 4.4958 4.4958 4.4958 4.7992 4.7992 4.7992 4.7992 4.8551 4.8551 4.8551 4.8551 5.0730 5.0730 5.0730 5.0730 5.2413 5.2413 5.2413 5.2413 6.0833 6.0833 6.0833 6.0833 6.5405 6.5405 6.5405 6.5405 k = 0.5000 0.3282 0.0190 ( 5092 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6096 -11.6096 -11.6096 -11.6096 -11.6017 -11.6017 -11.6017 -11.6017 -0.3964 -0.3964 -0.3964 -0.3964 -0.0673 -0.0673 -0.0673 -0.0673 0.1467 0.1467 0.1467 0.1467 0.2853 0.2853 0.2853 0.2853 0.9608 0.9608 0.9608 0.9608 1.3374 1.3374 1.3374 1.3374 1.9047 1.9047 1.9047 1.9047 2.0982 2.0982 2.0982 2.0982 2.3062 2.3062 2.3062 2.3062 2.6407 2.6407 2.6407 2.6407 3.3960 3.3960 3.3960 3.3960 3.9059 3.9059 3.9059 3.9059 4.2660 4.2660 4.2660 4.2660 4.4948 4.4948 4.4948 4.4948 4.7993 4.7993 4.7993 4.7993 4.8542 4.8542 4.8542 4.8542 5.0740 5.0740 5.0740 5.0740 5.2398 5.2398 5.2398 5.2398 6.0854 6.0854 6.0854 6.0854 6.5314 6.5314 6.5314 6.5314 k = 0.5000 0.3282 0.0285 ( 5092 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6095 -11.6095 -11.6095 -11.6095 -11.6018 -11.6018 -11.6018 -11.6018 -0.3938 -0.3938 -0.3938 -0.3938 -0.0765 -0.0765 -0.0765 -0.0765 0.1547 0.1547 0.1547 0.1547 0.2857 0.2857 0.2857 0.2857 0.9619 0.9619 0.9619 0.9619 1.3270 1.3270 1.3270 1.3270 1.9139 1.9139 1.9139 1.9139 2.0985 2.0985 2.0985 2.0985 2.3078 2.3078 2.3078 2.3078 2.6347 2.6347 2.6347 2.6347 3.4034 3.4034 3.4034 3.4034 3.8995 3.8995 3.8995 3.8995 4.2703 4.2703 4.2703 4.2703 4.4931 4.4931 4.4931 4.4931 4.7994 4.7994 4.7994 4.7994 4.8528 4.8528 4.8528 4.8528 5.0757 5.0757 5.0757 5.0757 5.2373 5.2373 5.2373 5.2373 6.0888 6.0888 6.0888 6.0888 6.5176 6.5176 6.5176 6.5176 k = 0.5000 0.3282 0.0379 ( 5088 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6094 -11.6094 -11.6094 -11.6094 -11.6019 -11.6019 -11.6019 -11.6019 -0.3901 -0.3901 -0.3901 -0.3901 -0.0881 -0.0881 -0.0881 -0.0881 0.1648 0.1648 0.1648 0.1648 0.2863 0.2863 0.2863 0.2863 0.9636 0.9636 0.9636 0.9636 1.3132 1.3132 1.3132 1.3132 1.9259 1.9259 1.9259 1.9259 2.0989 2.0989 2.0989 2.0989 2.3100 2.3100 2.3100 2.3100 2.6265 2.6265 2.6265 2.6265 3.4136 3.4136 3.4136 3.4136 3.8906 3.8906 3.8906 3.8906 4.2762 4.2762 4.2762 4.2762 4.4908 4.4908 4.4908 4.4908 4.7996 4.7996 4.7996 4.7996 4.8509 4.8509 4.8509 4.8509 5.0780 5.0780 5.0780 5.0780 5.2339 5.2339 5.2339 5.2339 6.0936 6.0936 6.0936 6.0936 6.5002 6.5002 6.5002 6.5002 k = 0.5000 0.3282 0.0474 ( 5076 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6092 -11.6092 -11.6092 -11.6092 -11.6021 -11.6021 -11.6021 -11.6021 -0.3855 -0.3855 -0.3855 -0.3855 -0.1016 -0.1016 -0.1016 -0.1016 0.1762 0.1762 0.1762 0.1762 0.2870 0.2870 0.2870 0.2870 0.9659 0.9659 0.9659 0.9659 1.2965 1.2965 1.2965 1.2965 1.9401 1.9401 1.9401 1.9401 2.0993 2.0993 2.0993 2.0993 2.3130 2.3130 2.3130 2.3130 2.6163 2.6163 2.6163 2.6163 3.4263 3.4263 3.4263 3.4263 3.8795 3.8795 3.8795 3.8795 4.2835 4.2835 4.2835 4.2835 4.4879 4.4879 4.4879 4.4879 4.7998 4.7998 4.7998 4.7998 4.8486 4.8486 4.8486 4.8486 5.0810 5.0810 5.0810 5.0810 5.2296 5.2296 5.2296 5.2296 6.0997 6.0997 6.0997 6.0997 6.4804 6.4804 6.4804 6.4804 k = 0.5000 0.3282 0.0569 ( 5072 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6090 -11.6090 -11.6090 -11.6090 -11.6023 -11.6023 -11.6023 -11.6023 -0.3798 -0.3798 -0.3798 -0.3798 -0.1164 -0.1164 -0.1164 -0.1164 0.1882 0.1882 0.1882 0.1882 0.2877 0.2877 0.2877 0.2877 0.9690 0.9690 0.9690 0.9690 1.2777 1.2777 1.2777 1.2777 1.9558 1.9558 1.9558 1.9558 2.0998 2.0998 2.0998 2.0998 2.3170 2.3170 2.3170 2.3170 2.6042 2.6042 2.6042 2.6042 3.4413 3.4413 3.4413 3.4413 3.8664 3.8664 3.8664 3.8664 4.2919 4.2919 4.2919 4.2919 4.4841 4.4841 4.4841 4.4841 4.8001 4.8001 4.8001 4.8001 4.8461 4.8461 4.8461 4.8461 5.0845 5.0845 5.0845 5.0845 5.2245 5.2245 5.2245 5.2245 6.1071 6.1071 6.1071 6.1071 6.4590 6.4590 6.4590 6.4590 k = 0.5000 0.3282 0.0664 ( 5064 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6088 -11.6088 -11.6088 -11.6088 -11.6025 -11.6025 -11.6025 -11.6025 -0.3732 -0.3732 -0.3732 -0.3732 -0.1320 -0.1320 -0.1320 -0.1320 0.2004 0.2004 0.2004 0.2004 0.2885 0.2885 0.2885 0.2885 0.9730 0.9730 0.9730 0.9730 1.2573 1.2573 1.2573 1.2573 1.9724 1.9724 1.9724 1.9724 2.1002 2.1002 2.1002 2.1002 2.3219 2.3219 2.3219 2.3219 2.5905 2.5905 2.5905 2.5905 3.4583 3.4583 3.4583 3.4583 3.8515 3.8515 3.8515 3.8515 4.3012 4.3012 4.3012 4.3012 4.4796 4.4796 4.4796 4.4796 4.8003 4.8003 4.8003 4.8003 4.8434 4.8434 4.8434 4.8434 5.0885 5.0885 5.0885 5.0885 5.2187 5.2187 5.2187 5.2187 6.1157 6.1157 6.1157 6.1157 6.4367 6.4367 6.4367 6.4367 k = 0.5000 0.3282 0.0759 ( 5068 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6085 -11.6085 -11.6085 -11.6085 -11.6028 -11.6028 -11.6028 -11.6028 -0.3656 -0.3656 -0.3656 -0.3656 -0.1481 -0.1481 -0.1481 -0.1481 0.2125 0.2125 0.2125 0.2125 0.2891 0.2891 0.2891 0.2891 0.9780 0.9780 0.9780 0.9780 1.2357 1.2357 1.2357 1.2357 1.9891 1.9891 1.9891 1.9891 2.1004 2.1004 2.1004 2.1004 2.3281 2.3281 2.3281 2.3281 2.5753 2.5753 2.5753 2.5753 3.4771 3.4771 3.4771 3.4771 3.8350 3.8350 3.8350 3.8350 4.3113 4.3113 4.3113 4.3113 4.4743 4.4743 4.4743 4.4743 4.8006 4.8006 4.8006 4.8006 4.8407 4.8407 4.8407 4.8407 5.0931 5.0931 5.0931 5.0931 5.2122 5.2122 5.2122 5.2122 6.1255 6.1255 6.1255 6.1255 6.4140 6.4140 6.4140 6.4140 k = 0.5000 0.3282 0.0854 ( 5072 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6082 -11.6082 -11.6082 -11.6082 -11.6031 -11.6031 -11.6031 -11.6031 -0.3571 -0.3571 -0.3571 -0.3571 -0.1644 -0.1644 -0.1644 -0.1644 0.2240 0.2240 0.2240 0.2240 0.2895 0.2895 0.2895 0.2895 0.9841 0.9841 0.9841 0.9841 1.2134 1.2134 1.2134 1.2134 2.0056 2.0056 2.0056 2.0056 2.1004 2.1004 2.1004 2.1004 2.3356 2.3356 2.3356 2.3356 2.5590 2.5590 2.5590 2.5590 3.4974 3.4974 3.4974 3.4974 3.8169 3.8169 3.8169 3.8169 4.3220 4.3220 4.3220 4.3220 4.4682 4.4682 4.4682 4.4682 4.8009 4.8009 4.8009 4.8009 4.8380 4.8380 4.8380 4.8380 5.0980 5.0980 5.0980 5.0980 5.2053 5.2053 5.2053 5.2053 6.1365 6.1365 6.1365 6.1365 6.3912 6.3912 6.3912 6.3912 k = 0.5000 0.3282 0.0949 ( 5076 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6079 -11.6079 -11.6079 -11.6079 -11.6034 -11.6034 -11.6034 -11.6034 -0.3476 -0.3476 -0.3476 -0.3476 -0.1809 -0.1809 -0.1809 -0.1809 0.2349 0.2349 0.2349 0.2349 0.2897 0.2897 0.2897 0.2897 0.9916 0.9916 0.9916 0.9916 1.1910 1.1910 1.1910 1.1910 2.0212 2.0212 2.0212 2.0212 2.1001 2.1001 2.1001 2.1001 2.3445 2.3445 2.3445 2.3445 2.5416 2.5416 2.5416 2.5416 3.5190 3.5190 3.5190 3.5190 3.7976 3.7976 3.7976 3.7976 4.3332 4.3332 4.3332 4.3332 4.4614 4.4614 4.4614 4.4614 4.8011 4.8011 4.8011 4.8011 4.8354 4.8354 4.8354 4.8354 5.1034 5.1034 5.1034 5.1034 5.1979 5.1979 5.1979 5.1979 6.1487 6.1487 6.1487 6.1487 6.3686 6.3686 6.3686 6.3686 k = 0.5000 0.3282 0.1043 ( 5088 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6076 -11.6076 -11.6076 -11.6076 -11.6037 -11.6037 -11.6037 -11.6037 -0.3374 -0.3374 -0.3374 -0.3374 -0.1973 -0.1973 -0.1973 -0.1973 0.2449 0.2449 0.2449 0.2449 0.2895 0.2895 0.2895 0.2895 1.0004 1.0004 1.0004 1.0004 1.1686 1.1686 1.1686 1.1686 2.0356 2.0356 2.0356 2.0356 2.0994 2.0994 2.0994 2.0994 2.3550 2.3550 2.3550 2.3550 2.5236 2.5236 2.5236 2.5236 3.5416 3.5416 3.5416 3.5416 3.7770 3.7770 3.7770 3.7770 4.3445 4.3445 4.3445 4.3445 4.4538 4.4538 4.4538 4.4538 4.8014 4.8014 4.8014 4.8014 4.8332 4.8332 4.8332 4.8332 5.1092 5.1092 5.1092 5.1092 5.1903 5.1903 5.1903 5.1903 6.1620 6.1620 6.1620 6.1620 6.3462 6.3462 6.3462 6.3462 k = 0.5000 0.3282 0.1138 ( 5084 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6072 -11.6072 -11.6072 -11.6072 -11.6041 -11.6041 -11.6041 -11.6041 -0.3263 -0.3263 -0.3263 -0.3263 -0.2134 -0.2134 -0.2134 -0.2134 0.2539 0.2539 0.2539 0.2539 0.2889 0.2889 0.2889 0.2889 1.0108 1.0108 1.0108 1.0108 1.1467 1.1467 1.1467 1.1467 2.0485 2.0485 2.0485 2.0485 2.0981 2.0981 2.0981 2.0981 2.3671 2.3671 2.3671 2.3671 2.5050 2.5050 2.5050 2.5050 3.5650 3.5650 3.5650 3.5650 3.7555 3.7555 3.7555 3.7555 4.3561 4.3561 4.3561 4.3561 4.4456 4.4456 4.4456 4.4456 4.8016 4.8016 4.8016 4.8016 4.8312 4.8312 4.8312 4.8312 5.1152 5.1152 5.1152 5.1152 5.1827 5.1827 5.1827 5.1827 6.1763 6.1763 6.1763 6.1763 6.3244 6.3244 6.3244 6.3244 k = 0.5000 0.3282 0.1233 ( 5084 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6068 -11.6068 -11.6068 -11.6068 -11.6045 -11.6045 -11.6045 -11.6045 -0.3144 -0.3144 -0.3144 -0.3144 -0.2293 -0.2293 -0.2293 -0.2293 0.2619 0.2619 0.2619 0.2619 0.2876 0.2876 0.2876 0.2876 1.0227 1.0227 1.0227 1.0227 1.1254 1.1254 1.1254 1.1254 2.0599 2.0599 2.0599 2.0599 2.0962 2.0962 2.0962 2.0962 2.3808 2.3808 2.3808 2.3808 2.4861 2.4861 2.4861 2.4861 3.5890 3.5890 3.5890 3.5890 3.7331 3.7331 3.7331 3.7331 4.3675 4.3675 4.3675 4.3675 4.4369 4.4369 4.4369 4.4369 4.8018 4.8018 4.8018 4.8018 4.8296 4.8296 4.8296 4.8296 5.1213 5.1213 5.1213 5.1213 5.1752 5.1752 5.1752 5.1752 6.1917 6.1917 6.1917 6.1917 6.3032 6.3032 6.3032 6.3032 k = 0.5000 0.3282 0.1328 ( 5092 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6064 -11.6064 -11.6064 -11.6064 -11.6049 -11.6049 -11.6049 -11.6049 -0.3018 -0.3018 -0.3018 -0.3018 -0.2448 -0.2448 -0.2448 -0.2448 0.2688 0.2688 0.2688 0.2688 0.2857 0.2857 0.2857 0.2857 1.0361 1.0361 1.0361 1.0361 1.1051 1.1051 1.1051 1.1051 2.0695 2.0695 2.0695 2.0695 2.0933 2.0933 2.0933 2.0933 2.3958 2.3958 2.3958 2.3958 2.4673 2.4673 2.4673 2.4673 3.6132 3.6132 3.6132 3.6132 3.7100 3.7100 3.7100 3.7100 4.3784 4.3784 4.3784 4.3784 4.4278 4.4278 4.4278 4.4278 4.8019 4.8019 4.8019 4.8019 4.8285 4.8285 4.8285 4.8285 5.1272 5.1272 5.1272 5.1272 5.1683 5.1683 5.1683 5.1683 6.2080 6.2080 6.2080 6.2080 6.2826 6.2826 6.2826 6.2826 k = 0.5000 0.3282 0.1423 ( 5088 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6060 -11.6060 -11.6060 -11.6060 -11.6053 -11.6053 -11.6053 -11.6053 -0.2886 -0.2886 -0.2886 -0.2886 -0.2598 -0.2598 -0.2598 -0.2598 0.2745 0.2745 0.2745 0.2745 0.2829 0.2829 0.2829 0.2829 1.0511 1.0511 1.0511 1.0511 1.0860 1.0860 1.0860 1.0860 2.0774 2.0774 2.0774 2.0774 2.0896 2.0896 2.0896 2.0896 2.4118 2.4118 2.4118 2.4118 2.4490 2.4490 2.4490 2.4490 3.6375 3.6375 3.6375 3.6375 3.6864 3.6864 3.6864 3.6864 4.3880 4.3880 4.3880 4.3880 4.4194 4.4194 4.4194 4.4194 4.8020 4.8020 4.8020 4.8020 4.8278 4.8278 4.8278 4.8278 5.1322 5.1322 5.1322 5.1322 5.1627 5.1627 5.1627 5.1627 6.2252 6.2252 6.2252 6.2252 6.2628 6.2628 6.2628 6.2628 k = 0.5000 0.3282 0.1518 ( 5088 PWs) bands (ev): -12.8195 -12.8195 -12.8195 -12.8195 -12.8148 -12.8148 -12.8148 -12.8148 -11.6057 -11.6057 -11.6057 -11.6057 -11.6056 -11.6056 -11.6056 -11.6056 -0.2766 -0.2766 -0.2766 -0.2766 -0.2724 -0.2724 -0.2724 -0.2724 0.2788 0.2788 0.2788 0.2788 0.2796 0.2796 0.2796 0.2796 1.0651 1.0651 1.0651 1.0651 1.0704 1.0704 1.0704 1.0704 2.0822 2.0822 2.0822 2.0822 2.0861 2.0861 2.0861 2.0861 2.4247 2.4247 2.4247 2.4247 2.4353 2.4353 2.4353 2.4353 3.6588 3.6588 3.6588 3.6588 3.6653 3.6653 3.6653 3.6653 4.3928 4.3928 4.3928 4.3928 4.4150 4.4150 4.4150 4.4150 4.8021 4.8021 4.8021 4.8021 4.8276 4.8276 4.8276 4.8276 5.1343 5.1343 5.1343 5.1343 5.1604 5.1604 5.1604 5.1604 6.2408 6.2408 6.2408 6.2408 6.2464 6.2464 6.2464 6.2464 Writing output data file FeO2.save init_run : 0.22s CPU 0.37s WALL ( 1 calls) electrons : 519.81s CPU 526.94s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 519.79s CPU 526.92s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.07s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.16s WALL ( 424 calls) cegterg : 479.48s CPU 485.23s WALL ( 457 calls) Called by sum_band: Called by *egterg: h_psi : 210.74s CPU 213.84s WALL ( 7992 calls) s_psi : 25.35s CPU 25.37s WALL ( 7992 calls) g_psi : 0.76s CPU 0.69s WALL ( 7111 calls) cdiaghg : 208.62s CPU 211.20s WALL ( 7535 calls) cegterg:over : 27.50s CPU 27.53s WALL ( 7111 calls) cegterg:upda : 22.38s CPU 22.90s WALL ( 7111 calls) cegterg:last : 11.39s CPU 11.39s WALL ( 1340 calls) cdiaghg:chol : 12.69s CPU 13.15s WALL ( 7535 calls) cdiaghg:inve : 9.51s CPU 9.56s WALL ( 7535 calls) cdiaghg:para : 17.46s CPU 17.74s WALL ( 15070 calls) Called by h_psi: h_psi:vloc : 161.82s CPU 165.12s WALL ( 7992 calls) h_psi:vnl : 48.19s CPU 48.00s WALL ( 7992 calls) add_vuspsi : 24.97s CPU 24.73s WALL ( 7992 calls) General routines calbec : 23.18s CPU 23.24s WALL ( 7992 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 152.17s CPU 155.31s WALL ( 1845288 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.42s CPU 0.69s WALL ( 848 calls) Parallel routines fft_scatter : 57.58s CPU 58.26s WALL ( 1845311 calls) PWSCF : 9m18.80s CPU 9m47.80s WALL This run was terminated on: 18:25: 0 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=