Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 13: 7:12 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: ./FeAs.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 33 25 7 1227 829 135 Max 34 26 8 1232 842 142 Sum 1209 927 279 44247 30059 4949 bravais-lattice index = 14 lattice parameter (alat) = 6.2176 a.u. unit-cell volume = 713.6465 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.217576 celldm(2)= 1.642149 celldm(3)= 1.808036 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 1.642149 0.000000 ) a(3) = ( 0.000000 0.000000 1.808036 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.608958 -0.000000 ) b(3) = ( 0.000000 0.000000 0.553086 ) PseudoPot. # 1 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 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 As 5.00 74.92160 As( 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 =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.8210747 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9040180 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.8210747 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.9040180 ) 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 =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 6) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.8210747 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.9040180 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.8210747 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9040180 ) 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= 432 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023148 k( 2) = ( 0.0104167 -0.0000000 -0.0000000), wk = 0.0023148 k( 3) = ( 0.0208333 -0.0000000 -0.0000000), wk = 0.0023148 k( 4) = ( 0.0312500 -0.0000000 -0.0000000), wk = 0.0023148 k( 5) = ( 0.0416667 -0.0000000 -0.0000000), wk = 0.0023148 k( 6) = ( 0.0520833 -0.0000000 -0.0000000), wk = 0.0023148 k( 7) = ( 0.0625000 -0.0000000 -0.0000000), wk = 0.0023148 k( 8) = ( 0.0729167 -0.0000000 -0.0000000), wk = 0.0023148 k( 9) = ( 0.0833333 -0.0000000 -0.0000000), wk = 0.0023148 k( 10) = ( 0.0937500 -0.0000000 -0.0000000), wk = 0.0023148 k( 11) = ( 0.1041667 -0.0000000 -0.0000000), wk = 0.0023148 k( 12) = ( 0.1145833 -0.0000000 -0.0000000), wk = 0.0023148 k( 13) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0023148 k( 14) = ( 0.1354167 -0.0000000 -0.0000000), wk = 0.0023148 k( 15) = ( 0.1458333 -0.0000000 -0.0000000), wk = 0.0023148 k( 16) = ( 0.1562500 -0.0000000 -0.0000000), wk = 0.0023148 k( 17) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0023148 k( 18) = ( 0.1770833 -0.0000000 -0.0000000), wk = 0.0023148 k( 19) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0023148 k( 20) = ( 0.1979167 -0.0000000 -0.0000000), wk = 0.0023148 k( 21) = ( 0.2083333 -0.0000000 -0.0000000), wk = 0.0023148 k( 22) = ( 0.2187500 -0.0000000 -0.0000000), wk = 0.0023148 k( 23) = ( 0.2291667 -0.0000000 -0.0000000), wk = 0.0023148 k( 24) = ( 0.2395833 -0.0000000 -0.0000000), wk = 0.0023148 k( 25) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0023148 k( 26) = ( 0.2604167 -0.0000000 -0.0000000), wk = 0.0023148 k( 27) = ( 0.2708333 -0.0000000 -0.0000000), wk = 0.0023148 k( 28) = ( 0.2812500 -0.0000000 -0.0000000), wk = 0.0023148 k( 29) = ( 0.2916667 -0.0000000 -0.0000000), wk = 0.0023148 k( 30) = ( 0.3020833 -0.0000000 -0.0000000), wk = 0.0023148 k( 31) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0023148 k( 32) = ( 0.3229167 -0.0000000 -0.0000000), wk = 0.0023148 k( 33) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0023148 k( 34) = ( 0.3437500 -0.0000000 -0.0000000), wk = 0.0023148 k( 35) = ( 0.3541667 -0.0000000 -0.0000000), wk = 0.0023148 k( 36) = ( 0.3645833 -0.0000000 -0.0000000), wk = 0.0023148 k( 37) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0023148 k( 38) = ( 0.3854167 -0.0000000 -0.0000000), wk = 0.0023148 k( 39) = ( 0.3958333 -0.0000000 -0.0000000), wk = 0.0023148 k( 40) = ( 0.4062500 -0.0000000 -0.0000000), wk = 0.0023148 k( 41) = ( 0.4166667 -0.0000000 -0.0000000), wk = 0.0023148 k( 42) = ( 0.4270833 -0.0000000 -0.0000000), wk = 0.0023148 k( 43) = ( 0.4375000 -0.0000000 -0.0000000), wk = 0.0023148 k( 44) = ( 0.4479167 -0.0000000 -0.0000000), wk = 0.0023148 k( 45) = ( 0.4583333 -0.0000000 -0.0000000), wk = 0.0023148 k( 46) = ( 0.4687500 -0.0000000 -0.0000000), wk = 0.0023148 k( 47) = ( 0.4791667 -0.0000000 -0.0000000), wk = 0.0023148 k( 48) = ( 0.4895833 -0.0000000 -0.0000000), wk = 0.0023148 k( 49) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023148 k( 50) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023148 k( 51) = ( 0.5000000 0.0101493 -0.0000000), wk = 0.0023148 k( 52) = ( 0.5000000 0.0202986 -0.0000000), wk = 0.0023148 k( 53) = ( 0.5000000 0.0304479 -0.0000000), wk = 0.0023148 k( 54) = ( 0.5000000 0.0405972 -0.0000000), wk = 0.0023148 k( 55) = ( 0.5000000 0.0507465 -0.0000000), wk = 0.0023148 k( 56) = ( 0.5000000 0.0608958 -0.0000000), wk = 0.0023148 k( 57) = ( 0.5000000 0.0710451 -0.0000000), wk = 0.0023148 k( 58) = ( 0.5000000 0.0811944 -0.0000000), wk = 0.0023148 k( 59) = ( 0.5000000 0.0913437 -0.0000000), wk = 0.0023148 k( 60) = ( 0.5000000 0.1014930 -0.0000000), wk = 0.0023148 k( 61) = ( 0.5000000 0.1116423 -0.0000000), wk = 0.0023148 k( 62) = ( 0.5000000 0.1217916 -0.0000000), wk = 0.0023148 k( 63) = ( 0.5000000 0.1319409 -0.0000000), wk = 0.0023148 k( 64) = ( 0.5000000 0.1420902 -0.0000000), wk = 0.0023148 k( 65) = ( 0.5000000 0.1522395 -0.0000000), wk = 0.0023148 k( 66) = ( 0.5000000 0.1623888 -0.0000000), wk = 0.0023148 k( 67) = ( 0.5000000 0.1725381 -0.0000000), wk = 0.0023148 k( 68) = ( 0.5000000 0.1826874 -0.0000000), wk = 0.0023148 k( 69) = ( 0.5000000 0.1928367 -0.0000000), wk = 0.0023148 k( 70) = ( 0.5000000 0.2029860 -0.0000000), wk = 0.0023148 k( 71) = ( 0.5000000 0.2131353 -0.0000000), wk = 0.0023148 k( 72) = ( 0.5000000 0.2232846 -0.0000000), wk = 0.0023148 k( 73) = ( 0.5000000 0.2334339 -0.0000000), wk = 0.0023148 k( 74) = ( 0.5000000 0.2435832 -0.0000000), wk = 0.0023148 k( 75) = ( 0.5000000 0.2537325 -0.0000000), wk = 0.0023148 k( 76) = ( 0.5000000 0.2638818 -0.0000000), wk = 0.0023148 k( 77) = ( 0.5000000 0.2740311 -0.0000000), wk = 0.0023148 k( 78) = ( 0.5000000 0.2841804 -0.0000000), wk = 0.0023148 k( 79) = ( 0.5000000 0.2943297 -0.0000000), wk = 0.0023148 k( 80) = ( 0.5000000 0.3044790 -0.0000000), wk = 0.0023148 k( 81) = ( 0.5000000 0.3044790 -0.0000000), wk = 0.0023148 k( 82) = ( 0.4895833 0.3044790 -0.0000000), wk = 0.0023148 k( 83) = ( 0.4791667 0.3044790 -0.0000000), wk = 0.0023148 k( 84) = ( 0.4687500 0.3044790 -0.0000000), wk = 0.0023148 k( 85) = ( 0.4583333 0.3044790 -0.0000000), wk = 0.0023148 k( 86) = ( 0.4479167 0.3044790 -0.0000000), wk = 0.0023148 k( 87) = ( 0.4375000 0.3044790 -0.0000000), wk = 0.0023148 k( 88) = ( 0.4270833 0.3044790 -0.0000000), wk = 0.0023148 k( 89) = ( 0.4166667 0.3044790 -0.0000000), wk = 0.0023148 k( 90) = ( 0.4062500 0.3044790 -0.0000000), wk = 0.0023148 k( 91) = ( 0.3958333 0.3044790 -0.0000000), wk = 0.0023148 k( 92) = ( 0.3854167 0.3044790 -0.0000000), wk = 0.0023148 k( 93) = ( 0.3750000 0.3044790 -0.0000000), wk = 0.0023148 k( 94) = ( 0.3645833 0.3044790 -0.0000000), wk = 0.0023148 k( 95) = ( 0.3541667 0.3044790 -0.0000000), wk = 0.0023148 k( 96) = ( 0.3437500 0.3044790 -0.0000000), wk = 0.0023148 k( 97) = ( 0.3333333 0.3044790 -0.0000000), wk = 0.0023148 k( 98) = ( 0.3229167 0.3044790 -0.0000000), wk = 0.0023148 k( 99) = ( 0.3125000 0.3044790 -0.0000000), wk = 0.0023148 k( 100) = ( 0.3020833 0.3044790 -0.0000000), wk = 0.0023148 k( 101) = ( 0.2916667 0.3044790 -0.0000000), wk = 0.0023148 k( 102) = ( 0.2812500 0.3044790 -0.0000000), wk = 0.0023148 k( 103) = ( 0.2708333 0.3044790 -0.0000000), wk = 0.0023148 k( 104) = ( 0.2604167 0.3044790 -0.0000000), wk = 0.0023148 k( 105) = ( 0.2500000 0.3044790 -0.0000000), wk = 0.0023148 k( 106) = ( 0.2395833 0.3044790 -0.0000000), wk = 0.0023148 k( 107) = ( 0.2291667 0.3044790 -0.0000000), wk = 0.0023148 k( 108) = ( 0.2187500 0.3044790 -0.0000000), wk = 0.0023148 k( 109) = ( 0.2083333 0.3044790 -0.0000000), wk = 0.0023148 k( 110) = ( 0.1979167 0.3044790 -0.0000000), wk = 0.0023148 k( 111) = ( 0.1875000 0.3044790 -0.0000000), wk = 0.0023148 k( 112) = ( 0.1770833 0.3044790 -0.0000000), wk = 0.0023148 k( 113) = ( 0.1666667 0.3044790 -0.0000000), wk = 0.0023148 k( 114) = ( 0.1562500 0.3044790 -0.0000000), wk = 0.0023148 k( 115) = ( 0.1458333 0.3044790 -0.0000000), wk = 0.0023148 k( 116) = ( 0.1354167 0.3044790 -0.0000000), wk = 0.0023148 k( 117) = ( 0.1250000 0.3044790 -0.0000000), wk = 0.0023148 k( 118) = ( 0.1145833 0.3044790 -0.0000000), wk = 0.0023148 k( 119) = ( 0.1041667 0.3044790 -0.0000000), wk = 0.0023148 k( 120) = ( 0.0937500 0.3044790 -0.0000000), wk = 0.0023148 k( 121) = ( 0.0833333 0.3044790 -0.0000000), wk = 0.0023148 k( 122) = ( 0.0729167 0.3044790 -0.0000000), wk = 0.0023148 k( 123) = ( 0.0625000 0.3044790 -0.0000000), wk = 0.0023148 k( 124) = ( 0.0520833 0.3044790 -0.0000000), wk = 0.0023148 k( 125) = ( 0.0416667 0.3044790 -0.0000000), wk = 0.0023148 k( 126) = ( 0.0312500 0.3044790 -0.0000000), wk = 0.0023148 k( 127) = ( 0.0208333 0.3044790 -0.0000000), wk = 0.0023148 k( 128) = ( 0.0104167 0.3044790 -0.0000000), wk = 0.0023148 k( 129) = ( 0.0000000 0.3044790 -0.0000000), wk = 0.0023148 k( 130) = ( 0.0000000 0.3044790 -0.0000000), wk = 0.0023148 k( 131) = ( 0.0000000 0.2943297 -0.0000000), wk = 0.0023148 k( 132) = ( 0.0000000 0.2841804 -0.0000000), wk = 0.0023148 k( 133) = ( 0.0000000 0.2740311 -0.0000000), wk = 0.0023148 k( 134) = ( 0.0000000 0.2638818 -0.0000000), wk = 0.0023148 k( 135) = ( 0.0000000 0.2537325 -0.0000000), wk = 0.0023148 k( 136) = ( 0.0000000 0.2435832 -0.0000000), wk = 0.0023148 k( 137) = ( 0.0000000 0.2334339 -0.0000000), wk = 0.0023148 k( 138) = ( 0.0000000 0.2232846 -0.0000000), wk = 0.0023148 k( 139) = ( 0.0000000 0.2131353 -0.0000000), wk = 0.0023148 k( 140) = ( 0.0000000 0.2029860 -0.0000000), wk = 0.0023148 k( 141) = ( 0.0000000 0.1928367 -0.0000000), wk = 0.0023148 k( 142) = ( 0.0000000 0.1826874 -0.0000000), wk = 0.0023148 k( 143) = ( 0.0000000 0.1725381 -0.0000000), wk = 0.0023148 k( 144) = ( 0.0000000 0.1623888 -0.0000000), wk = 0.0023148 k( 145) = ( 0.0000000 0.1522395 -0.0000000), wk = 0.0023148 k( 146) = ( 0.0000000 0.1420902 -0.0000000), wk = 0.0023148 k( 147) = ( 0.0000000 0.1319409 -0.0000000), wk = 0.0023148 k( 148) = ( 0.0000000 0.1217916 -0.0000000), wk = 0.0023148 k( 149) = ( 0.0000000 0.1116423 -0.0000000), wk = 0.0023148 k( 150) = ( 0.0000000 0.1014930 -0.0000000), wk = 0.0023148 k( 151) = ( 0.0000000 0.0913437 -0.0000000), wk = 0.0023148 k( 152) = ( 0.0000000 0.0811944 -0.0000000), wk = 0.0023148 k( 153) = ( 0.0000000 0.0710451 -0.0000000), wk = 0.0023148 k( 154) = ( 0.0000000 0.0608958 -0.0000000), wk = 0.0023148 k( 155) = ( 0.0000000 0.0507465 -0.0000000), wk = 0.0023148 k( 156) = ( 0.0000000 0.0405972 -0.0000000), wk = 0.0023148 k( 157) = ( 0.0000000 0.0304479 -0.0000000), wk = 0.0023148 k( 158) = ( 0.0000000 0.0202986 -0.0000000), wk = 0.0023148 k( 159) = ( 0.0000000 0.0101493 -0.0000000), wk = 0.0023148 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023148 k( 161) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023148 k( 162) = ( 0.0000000 0.0000000 0.0102423), wk = 0.0023148 k( 163) = ( 0.0000000 0.0000000 0.0204847), wk = 0.0023148 k( 164) = ( 0.0000000 0.0000000 0.0307270), wk = 0.0023148 k( 165) = ( 0.0000000 0.0000000 0.0409694), wk = 0.0023148 k( 166) = ( 0.0000000 0.0000000 0.0512117), wk = 0.0023148 k( 167) = ( 0.0000000 0.0000000 0.0614540), wk = 0.0023148 k( 168) = ( 0.0000000 0.0000000 0.0716964), wk = 0.0023148 k( 169) = ( 0.0000000 0.0000000 0.0819387), wk = 0.0023148 k( 170) = ( 0.0000000 0.0000000 0.0921811), wk = 0.0023148 k( 171) = ( 0.0000000 0.0000000 0.1024234), wk = 0.0023148 k( 172) = ( 0.0000000 0.0000000 0.1126657), wk = 0.0023148 k( 173) = ( 0.0000000 0.0000000 0.1229081), wk = 0.0023148 k( 174) = ( 0.0000000 0.0000000 0.1331504), wk = 0.0023148 k( 175) = ( 0.0000000 0.0000000 0.1433928), wk = 0.0023148 k( 176) = ( 0.0000000 0.0000000 0.1536351), wk = 0.0023148 k( 177) = ( 0.0000000 0.0000000 0.1638774), wk = 0.0023148 k( 178) = ( 0.0000000 0.0000000 0.1741198), wk = 0.0023148 k( 179) = ( 0.0000000 0.0000000 0.1843621), wk = 0.0023148 k( 180) = ( 0.0000000 0.0000000 0.1946045), wk = 0.0023148 k( 181) = ( 0.0000000 0.0000000 0.2048468), wk = 0.0023148 k( 182) = ( 0.0000000 0.0000000 0.2150891), wk = 0.0023148 k( 183) = ( 0.0000000 0.0000000 0.2253315), wk = 0.0023148 k( 184) = ( 0.0000000 0.0000000 0.2355738), wk = 0.0023148 k( 185) = ( 0.0000000 0.0000000 0.2458161), wk = 0.0023148 k( 186) = ( 0.0000000 0.0000000 0.2560585), wk = 0.0023148 k( 187) = ( 0.0000000 0.0000000 0.2663008), wk = 0.0023148 k( 188) = ( 0.0000000 0.0000000 0.2765432), wk = 0.0023148 k( 189) = ( 0.0000000 0.0000000 0.2765432), wk = 0.0023148 k( 190) = ( 0.0104167 -0.0000000 0.2765432), wk = 0.0023148 k( 191) = ( 0.0208333 -0.0000000 0.2765432), wk = 0.0023148 k( 192) = ( 0.0312500 -0.0000000 0.2765432), wk = 0.0023148 k( 193) = ( 0.0416667 -0.0000000 0.2765432), wk = 0.0023148 k( 194) = ( 0.0520833 -0.0000000 0.2765432), wk = 0.0023148 k( 195) = ( 0.0625000 -0.0000000 0.2765432), wk = 0.0023148 k( 196) = ( 0.0729167 -0.0000000 0.2765432), wk = 0.0023148 k( 197) = ( 0.0833333 -0.0000000 0.2765432), wk = 0.0023148 k( 198) = ( 0.0937500 -0.0000000 0.2765432), wk = 0.0023148 k( 199) = ( 0.1041667 -0.0000000 0.2765432), wk = 0.0023148 k( 200) = ( 0.1145833 -0.0000000 0.2765432), wk = 0.0023148 k( 201) = ( 0.1250000 -0.0000000 0.2765432), wk = 0.0023148 k( 202) = ( 0.1354167 -0.0000000 0.2765432), wk = 0.0023148 k( 203) = ( 0.1458333 -0.0000000 0.2765432), wk = 0.0023148 k( 204) = ( 0.1562500 -0.0000000 0.2765432), wk = 0.0023148 k( 205) = ( 0.1666667 -0.0000000 0.2765432), wk = 0.0023148 k( 206) = ( 0.1770833 -0.0000000 0.2765432), wk = 0.0023148 k( 207) = ( 0.1875000 -0.0000000 0.2765432), wk = 0.0023148 k( 208) = ( 0.1979167 -0.0000000 0.2765432), wk = 0.0023148 k( 209) = ( 0.2083333 -0.0000000 0.2765432), wk = 0.0023148 k( 210) = ( 0.2187500 -0.0000000 0.2765432), wk = 0.0023148 k( 211) = ( 0.2291667 -0.0000000 0.2765432), wk = 0.0023148 k( 212) = ( 0.2395833 -0.0000000 0.2765432), wk = 0.0023148 k( 213) = ( 0.2500000 -0.0000000 0.2765432), wk = 0.0023148 k( 214) = ( 0.2604167 -0.0000000 0.2765432), wk = 0.0023148 k( 215) = ( 0.2708333 -0.0000000 0.2765432), wk = 0.0023148 k( 216) = ( 0.2812500 -0.0000000 0.2765432), wk = 0.0023148 k( 217) = ( 0.2916667 -0.0000000 0.2765432), wk = 0.0023148 k( 218) = ( 0.3020833 -0.0000000 0.2765432), wk = 0.0023148 k( 219) = ( 0.3125000 -0.0000000 0.2765432), wk = 0.0023148 k( 220) = ( 0.3229167 -0.0000000 0.2765432), wk = 0.0023148 k( 221) = ( 0.3333333 -0.0000000 0.2765432), wk = 0.0023148 k( 222) = ( 0.3437500 -0.0000000 0.2765432), wk = 0.0023148 k( 223) = ( 0.3541667 -0.0000000 0.2765432), wk = 0.0023148 k( 224) = ( 0.3645833 -0.0000000 0.2765432), wk = 0.0023148 k( 225) = ( 0.3750000 -0.0000000 0.2765432), wk = 0.0023148 k( 226) = ( 0.3854167 -0.0000000 0.2765432), wk = 0.0023148 k( 227) = ( 0.3958333 -0.0000000 0.2765432), wk = 0.0023148 k( 228) = ( 0.4062500 -0.0000000 0.2765432), wk = 0.0023148 k( 229) = ( 0.4166667 -0.0000000 0.2765432), wk = 0.0023148 k( 230) = ( 0.4270833 -0.0000000 0.2765432), wk = 0.0023148 k( 231) = ( 0.4375000 -0.0000000 0.2765432), wk = 0.0023148 k( 232) = ( 0.4479167 -0.0000000 0.2765432), wk = 0.0023148 k( 233) = ( 0.4583333 -0.0000000 0.2765432), wk = 0.0023148 k( 234) = ( 0.4687500 -0.0000000 0.2765432), wk = 0.0023148 k( 235) = ( 0.4791667 -0.0000000 0.2765432), wk = 0.0023148 k( 236) = ( 0.4895833 -0.0000000 0.2765432), wk = 0.0023148 k( 237) = ( 0.5000000 -0.0000000 0.2765432), wk = 0.0023148 k( 238) = ( 0.5000000 -0.0000000 0.2765432), wk = 0.0023148 k( 239) = ( 0.5000000 0.0101493 0.2765432), wk = 0.0023148 k( 240) = ( 0.5000000 0.0202986 0.2765432), wk = 0.0023148 k( 241) = ( 0.5000000 0.0304479 0.2765432), wk = 0.0023148 k( 242) = ( 0.5000000 0.0405972 0.2765432), wk = 0.0023148 k( 243) = ( 0.5000000 0.0507465 0.2765432), wk = 0.0023148 k( 244) = ( 0.5000000 0.0608958 0.2765432), wk = 0.0023148 k( 245) = ( 0.5000000 0.0710451 0.2765432), wk = 0.0023148 k( 246) = ( 0.5000000 0.0811944 0.2765432), wk = 0.0023148 k( 247) = ( 0.5000000 0.0913437 0.2765432), wk = 0.0023148 k( 248) = ( 0.5000000 0.1014930 0.2765432), wk = 0.0023148 k( 249) = ( 0.5000000 0.1116423 0.2765432), wk = 0.0023148 k( 250) = ( 0.5000000 0.1217916 0.2765432), wk = 0.0023148 k( 251) = ( 0.5000000 0.1319409 0.2765432), wk = 0.0023148 k( 252) = ( 0.5000000 0.1420902 0.2765432), wk = 0.0023148 k( 253) = ( 0.5000000 0.1522395 0.2765432), wk = 0.0023148 k( 254) = ( 0.5000000 0.1623888 0.2765432), wk = 0.0023148 k( 255) = ( 0.5000000 0.1725381 0.2765432), wk = 0.0023148 k( 256) = ( 0.5000000 0.1826874 0.2765432), wk = 0.0023148 k( 257) = ( 0.5000000 0.1928367 0.2765432), wk = 0.0023148 k( 258) = ( 0.5000000 0.2029860 0.2765432), wk = 0.0023148 k( 259) = ( 0.5000000 0.2131353 0.2765432), wk = 0.0023148 k( 260) = ( 0.5000000 0.2232846 0.2765432), wk = 0.0023148 k( 261) = ( 0.5000000 0.2334339 0.2765432), wk = 0.0023148 k( 262) = ( 0.5000000 0.2435832 0.2765432), wk = 0.0023148 k( 263) = ( 0.5000000 0.2537325 0.2765432), wk = 0.0023148 k( 264) = ( 0.5000000 0.2638818 0.2765432), wk = 0.0023148 k( 265) = ( 0.5000000 0.2740311 0.2765432), wk = 0.0023148 k( 266) = ( 0.5000000 0.2841804 0.2765432), wk = 0.0023148 k( 267) = ( 0.5000000 0.2943297 0.2765432), wk = 0.0023148 k( 268) = ( 0.5000000 0.3044790 0.2765432), wk = 0.0023148 k( 269) = ( 0.5000000 0.3044790 0.2765432), wk = 0.0023148 k( 270) = ( 0.4895833 0.3044790 0.2765432), wk = 0.0023148 k( 271) = ( 0.4791667 0.3044790 0.2765432), wk = 0.0023148 k( 272) = ( 0.4687500 0.3044790 0.2765432), wk = 0.0023148 k( 273) = ( 0.4583333 0.3044790 0.2765432), wk = 0.0023148 k( 274) = ( 0.4479167 0.3044790 0.2765432), wk = 0.0023148 k( 275) = ( 0.4375000 0.3044790 0.2765432), wk = 0.0023148 k( 276) = ( 0.4270833 0.3044790 0.2765432), wk = 0.0023148 k( 277) = ( 0.4166667 0.3044790 0.2765432), wk = 0.0023148 k( 278) = ( 0.4062500 0.3044790 0.2765432), wk = 0.0023148 k( 279) = ( 0.3958333 0.3044790 0.2765432), wk = 0.0023148 k( 280) = ( 0.3854167 0.3044790 0.2765432), wk = 0.0023148 k( 281) = ( 0.3750000 0.3044790 0.2765432), wk = 0.0023148 k( 282) = ( 0.3645833 0.3044790 0.2765432), wk = 0.0023148 k( 283) = ( 0.3541667 0.3044790 0.2765432), wk = 0.0023148 k( 284) = ( 0.3437500 0.3044790 0.2765432), wk = 0.0023148 k( 285) = ( 0.3333333 0.3044790 0.2765432), wk = 0.0023148 k( 286) = ( 0.3229167 0.3044790 0.2765432), wk = 0.0023148 k( 287) = ( 0.3125000 0.3044790 0.2765432), wk = 0.0023148 k( 288) = ( 0.3020833 0.3044790 0.2765432), wk = 0.0023148 k( 289) = ( 0.2916667 0.3044790 0.2765432), wk = 0.0023148 k( 290) = ( 0.2812500 0.3044790 0.2765432), wk = 0.0023148 k( 291) = ( 0.2708333 0.3044790 0.2765432), wk = 0.0023148 k( 292) = ( 0.2604167 0.3044790 0.2765432), wk = 0.0023148 k( 293) = ( 0.2500000 0.3044790 0.2765432), wk = 0.0023148 k( 294) = ( 0.2395833 0.3044790 0.2765432), wk = 0.0023148 k( 295) = ( 0.2291667 0.3044790 0.2765432), wk = 0.0023148 k( 296) = ( 0.2187500 0.3044790 0.2765432), wk = 0.0023148 k( 297) = ( 0.2083333 0.3044790 0.2765432), wk = 0.0023148 k( 298) = ( 0.1979167 0.3044790 0.2765432), wk = 0.0023148 k( 299) = ( 0.1875000 0.3044790 0.2765432), wk = 0.0023148 k( 300) = ( 0.1770833 0.3044790 0.2765432), wk = 0.0023148 k( 301) = ( 0.1666667 0.3044790 0.2765432), wk = 0.0023148 k( 302) = ( 0.1562500 0.3044790 0.2765432), wk = 0.0023148 k( 303) = ( 0.1458333 0.3044790 0.2765432), wk = 0.0023148 k( 304) = ( 0.1354167 0.3044790 0.2765432), wk = 0.0023148 k( 305) = ( 0.1250000 0.3044790 0.2765432), wk = 0.0023148 k( 306) = ( 0.1145833 0.3044790 0.2765432), wk = 0.0023148 k( 307) = ( 0.1041667 0.3044790 0.2765432), wk = 0.0023148 k( 308) = ( 0.0937500 0.3044790 0.2765432), wk = 0.0023148 k( 309) = ( 0.0833333 0.3044790 0.2765432), wk = 0.0023148 k( 310) = ( 0.0729167 0.3044790 0.2765432), wk = 0.0023148 k( 311) = ( 0.0625000 0.3044790 0.2765432), wk = 0.0023148 k( 312) = ( 0.0520833 0.3044790 0.2765432), wk = 0.0023148 k( 313) = ( 0.0416667 0.3044790 0.2765432), wk = 0.0023148 k( 314) = ( 0.0312500 0.3044790 0.2765432), wk = 0.0023148 k( 315) = ( 0.0208333 0.3044790 0.2765432), wk = 0.0023148 k( 316) = ( 0.0104167 0.3044790 0.2765432), wk = 0.0023148 k( 317) = ( 0.0000000 0.3044790 0.2765432), wk = 0.0023148 k( 318) = ( 0.0000000 0.3044790 0.2765432), wk = 0.0023148 k( 319) = ( 0.0000000 0.2943297 0.2765432), wk = 0.0023148 k( 320) = ( 0.0000000 0.2841804 0.2765432), wk = 0.0023148 k( 321) = ( 0.0000000 0.2740311 0.2765432), wk = 0.0023148 k( 322) = ( 0.0000000 0.2638818 0.2765432), wk = 0.0023148 k( 323) = ( 0.0000000 0.2537325 0.2765432), wk = 0.0023148 k( 324) = ( 0.0000000 0.2435832 0.2765432), wk = 0.0023148 k( 325) = ( 0.0000000 0.2334339 0.2765432), wk = 0.0023148 k( 326) = ( 0.0000000 0.2232846 0.2765432), wk = 0.0023148 k( 327) = ( 0.0000000 0.2131353 0.2765432), wk = 0.0023148 k( 328) = ( 0.0000000 0.2029860 0.2765432), wk = 0.0023148 k( 329) = ( 0.0000000 0.1928367 0.2765432), wk = 0.0023148 k( 330) = ( 0.0000000 0.1826874 0.2765432), wk = 0.0023148 k( 331) = ( 0.0000000 0.1725381 0.2765432), wk = 0.0023148 k( 332) = ( 0.0000000 0.1623888 0.2765432), wk = 0.0023148 k( 333) = ( 0.0000000 0.1522395 0.2765432), wk = 0.0023148 k( 334) = ( 0.0000000 0.1420902 0.2765432), wk = 0.0023148 k( 335) = ( 0.0000000 0.1319409 0.2765432), wk = 0.0023148 k( 336) = ( 0.0000000 0.1217916 0.2765432), wk = 0.0023148 k( 337) = ( 0.0000000 0.1116423 0.2765432), wk = 0.0023148 k( 338) = ( 0.0000000 0.1014930 0.2765432), wk = 0.0023148 k( 339) = ( 0.0000000 0.0913437 0.2765432), wk = 0.0023148 k( 340) = ( 0.0000000 0.0811944 0.2765432), wk = 0.0023148 k( 341) = ( 0.0000000 0.0710451 0.2765432), wk = 0.0023148 k( 342) = ( 0.0000000 0.0608958 0.2765432), wk = 0.0023148 k( 343) = ( 0.0000000 0.0507465 0.2765432), wk = 0.0023148 k( 344) = ( 0.0000000 0.0405972 0.2765432), wk = 0.0023148 k( 345) = ( 0.0000000 0.0304479 0.2765432), wk = 0.0023148 k( 346) = ( 0.0000000 0.0202986 0.2765432), wk = 0.0023148 k( 347) = ( 0.0000000 0.0101493 0.2765432), wk = 0.0023148 k( 348) = ( 0.0000000 0.0000000 0.2765432), wk = 0.0023148 k( 349) = ( 0.0000000 0.3044790 -0.0000000), wk = 0.0023148 k( 350) = ( 0.0000000 0.3044790 0.0102423), wk = 0.0023148 k( 351) = ( 0.0000000 0.3044790 0.0204847), wk = 0.0023148 k( 352) = ( 0.0000000 0.3044790 0.0307270), wk = 0.0023148 k( 353) = ( 0.0000000 0.3044790 0.0409694), wk = 0.0023148 k( 354) = ( 0.0000000 0.3044790 0.0512117), wk = 0.0023148 k( 355) = ( 0.0000000 0.3044790 0.0614540), wk = 0.0023148 k( 356) = ( 0.0000000 0.3044790 0.0716964), wk = 0.0023148 k( 357) = ( 0.0000000 0.3044790 0.0819387), wk = 0.0023148 k( 358) = ( 0.0000000 0.3044790 0.0921811), wk = 0.0023148 k( 359) = ( 0.0000000 0.3044790 0.1024234), wk = 0.0023148 k( 360) = ( 0.0000000 0.3044790 0.1126657), wk = 0.0023148 k( 361) = ( 0.0000000 0.3044790 0.1229081), wk = 0.0023148 k( 362) = ( 0.0000000 0.3044790 0.1331504), wk = 0.0023148 k( 363) = ( 0.0000000 0.3044790 0.1433928), wk = 0.0023148 k( 364) = ( 0.0000000 0.3044790 0.1536351), wk = 0.0023148 k( 365) = ( 0.0000000 0.3044790 0.1638774), wk = 0.0023148 k( 366) = ( 0.0000000 0.3044790 0.1741198), wk = 0.0023148 k( 367) = ( 0.0000000 0.3044790 0.1843621), wk = 0.0023148 k( 368) = ( 0.0000000 0.3044790 0.1946045), wk = 0.0023148 k( 369) = ( 0.0000000 0.3044790 0.2048468), wk = 0.0023148 k( 370) = ( 0.0000000 0.3044790 0.2150891), wk = 0.0023148 k( 371) = ( 0.0000000 0.3044790 0.2253315), wk = 0.0023148 k( 372) = ( 0.0000000 0.3044790 0.2355738), wk = 0.0023148 k( 373) = ( 0.0000000 0.3044790 0.2458161), wk = 0.0023148 k( 374) = ( 0.0000000 0.3044790 0.2560585), wk = 0.0023148 k( 375) = ( 0.0000000 0.3044790 0.2663008), wk = 0.0023148 k( 376) = ( 0.0000000 0.3044790 0.2765432), wk = 0.0023148 k( 377) = ( 0.5000000 -0.0000000 0.2765432), wk = 0.0023148 k( 378) = ( 0.5000000 -0.0000000 0.2663008), wk = 0.0023148 k( 379) = ( 0.5000000 -0.0000000 0.2560585), wk = 0.0023148 k( 380) = ( 0.5000000 -0.0000000 0.2458161), wk = 0.0023148 k( 381) = ( 0.5000000 -0.0000000 0.2355738), wk = 0.0023148 k( 382) = ( 0.5000000 -0.0000000 0.2253315), wk = 0.0023148 k( 383) = ( 0.5000000 -0.0000000 0.2150891), wk = 0.0023148 k( 384) = ( 0.5000000 -0.0000000 0.2048468), wk = 0.0023148 k( 385) = ( 0.5000000 -0.0000000 0.1946045), wk = 0.0023148 k( 386) = ( 0.5000000 -0.0000000 0.1843621), wk = 0.0023148 k( 387) = ( 0.5000000 -0.0000000 0.1741198), wk = 0.0023148 k( 388) = ( 0.5000000 -0.0000000 0.1638774), wk = 0.0023148 k( 389) = ( 0.5000000 -0.0000000 0.1536351), wk = 0.0023148 k( 390) = ( 0.5000000 -0.0000000 0.1433928), wk = 0.0023148 k( 391) = ( 0.5000000 -0.0000000 0.1331504), wk = 0.0023148 k( 392) = ( 0.5000000 -0.0000000 0.1229081), wk = 0.0023148 k( 393) = ( 0.5000000 -0.0000000 0.1126657), wk = 0.0023148 k( 394) = ( 0.5000000 -0.0000000 0.1024234), wk = 0.0023148 k( 395) = ( 0.5000000 -0.0000000 0.0921811), wk = 0.0023148 k( 396) = ( 0.5000000 -0.0000000 0.0819387), wk = 0.0023148 k( 397) = ( 0.5000000 -0.0000000 0.0716964), wk = 0.0023148 k( 398) = ( 0.5000000 -0.0000000 0.0614540), wk = 0.0023148 k( 399) = ( 0.5000000 -0.0000000 0.0512117), wk = 0.0023148 k( 400) = ( 0.5000000 -0.0000000 0.0409694), wk = 0.0023148 k( 401) = ( 0.5000000 -0.0000000 0.0307270), wk = 0.0023148 k( 402) = ( 0.5000000 -0.0000000 0.0204847), wk = 0.0023148 k( 403) = ( 0.5000000 -0.0000000 0.0102423), wk = 0.0023148 k( 404) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0023148 k( 405) = ( 0.5000000 0.3044790 -0.0000000), wk = 0.0023148 k( 406) = ( 0.5000000 0.3044790 0.0102423), wk = 0.0023148 k( 407) = ( 0.5000000 0.3044790 0.0204847), wk = 0.0023148 k( 408) = ( 0.5000000 0.3044790 0.0307270), wk = 0.0023148 k( 409) = ( 0.5000000 0.3044790 0.0409694), wk = 0.0023148 k( 410) = ( 0.5000000 0.3044790 0.0512117), wk = 0.0023148 k( 411) = ( 0.5000000 0.3044790 0.0614540), wk = 0.0023148 k( 412) = ( 0.5000000 0.3044790 0.0716964), wk = 0.0023148 k( 413) = ( 0.5000000 0.3044790 0.0819387), wk = 0.0023148 k( 414) = ( 0.5000000 0.3044790 0.0921811), wk = 0.0023148 k( 415) = ( 0.5000000 0.3044790 0.1024234), wk = 0.0023148 k( 416) = ( 0.5000000 0.3044790 0.1126657), wk = 0.0023148 k( 417) = ( 0.5000000 0.3044790 0.1229081), wk = 0.0023148 k( 418) = ( 0.5000000 0.3044790 0.1331504), wk = 0.0023148 k( 419) = ( 0.5000000 0.3044790 0.1433928), wk = 0.0023148 k( 420) = ( 0.5000000 0.3044790 0.1536351), wk = 0.0023148 k( 421) = ( 0.5000000 0.3044790 0.1638774), wk = 0.0023148 k( 422) = ( 0.5000000 0.3044790 0.1741198), wk = 0.0023148 k( 423) = ( 0.5000000 0.3044790 0.1843621), wk = 0.0023148 k( 424) = ( 0.5000000 0.3044790 0.1946045), wk = 0.0023148 k( 425) = ( 0.5000000 0.3044790 0.2048468), wk = 0.0023148 k( 426) = ( 0.5000000 0.3044790 0.2150891), wk = 0.0023148 k( 427) = ( 0.5000000 0.3044790 0.2253315), wk = 0.0023148 k( 428) = ( 0.5000000 0.3044790 0.2355738), wk = 0.0023148 k( 429) = ( 0.5000000 0.3044790 0.2458161), wk = 0.0023148 k( 430) = ( 0.5000000 0.3044790 0.2560585), wk = 0.0023148 k( 431) = ( 0.5000000 0.3044790 0.2663008), wk = 0.0023148 k( 432) = ( 0.5000000 0.3044790 0.2765432), wk = 0.0023148 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023148 k( 2) = ( 0.0104167 0.0000000 0.0000000), wk = 0.0023148 k( 3) = ( 0.0208333 0.0000000 0.0000000), wk = 0.0023148 k( 4) = ( 0.0312500 0.0000000 0.0000000), wk = 0.0023148 k( 5) = ( 0.0416667 0.0000000 -0.0000000), wk = 0.0023148 k( 6) = ( 0.0520833 0.0000000 0.0000000), wk = 0.0023148 k( 7) = ( 0.0625000 0.0000000 0.0000000), wk = 0.0023148 k( 8) = ( 0.0729167 0.0000000 0.0000000), wk = 0.0023148 k( 9) = ( 0.0833333 0.0000000 0.0000000), wk = 0.0023148 k( 10) = ( 0.0937500 0.0000000 0.0000000), wk = 0.0023148 k( 11) = ( 0.1041667 -0.0000000 0.0000000), wk = 0.0023148 k( 12) = ( 0.1145833 0.0000000 0.0000000), wk = 0.0023148 k( 13) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0023148 k( 14) = ( 0.1354167 0.0000000 0.0000000), wk = 0.0023148 k( 15) = ( 0.1458333 0.0000000 0.0000000), wk = 0.0023148 k( 16) = ( 0.1562500 0.0000000 0.0000000), wk = 0.0023148 k( 17) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0023148 k( 18) = ( 0.1770833 0.0000000 0.0000000), wk = 0.0023148 k( 19) = ( 0.1875000 0.0000000 0.0000000), wk = 0.0023148 k( 20) = ( 0.1979167 0.0000000 0.0000000), wk = 0.0023148 k( 21) = ( 0.2083333 -0.0000000 0.0000000), wk = 0.0023148 k( 22) = ( 0.2187500 0.0000000 -0.0000000), wk = 0.0023148 k( 23) = ( 0.2291667 -0.0000000 0.0000000), wk = 0.0023148 k( 24) = ( 0.2395833 0.0000000 0.0000000), wk = 0.0023148 k( 25) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0023148 k( 26) = ( 0.2604167 0.0000000 0.0000000), wk = 0.0023148 k( 27) = ( 0.2708333 0.0000000 0.0000000), wk = 0.0023148 k( 28) = ( 0.2812500 0.0000000 0.0000000), wk = 0.0023148 k( 29) = ( 0.2916667 -0.0000000 0.0000000), wk = 0.0023148 k( 30) = ( 0.3020833 0.0000000 0.0000000), wk = 0.0023148 k( 31) = ( 0.3125000 0.0000000 0.0000000), wk = 0.0023148 k( 32) = ( 0.3229167 0.0000000 0.0000000), wk = 0.0023148 k( 33) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0023148 k( 34) = ( 0.3437500 0.0000000 0.0000000), wk = 0.0023148 k( 35) = ( 0.3541667 0.0000000 0.0000000), wk = 0.0023148 k( 36) = ( 0.3645833 0.0000000 0.0000000), wk = 0.0023148 k( 37) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0023148 k( 38) = ( 0.3854167 0.0000000 0.0000000), wk = 0.0023148 k( 39) = ( 0.3958333 0.0000000 0.0000000), wk = 0.0023148 k( 40) = ( 0.4062500 -0.0000000 0.0000000), wk = 0.0023148 k( 41) = ( 0.4166667 0.0000000 0.0000000), wk = 0.0023148 k( 42) = ( 0.4270833 0.0000000 0.0000000), wk = 0.0023148 k( 43) = ( 0.4375000 0.0000000 -0.0000000), wk = 0.0023148 k( 44) = ( 0.4479167 0.0000000 0.0000000), wk = 0.0023148 k( 45) = ( 0.4583333 0.0000000 0.0000000), wk = 0.0023148 k( 46) = ( 0.4687500 0.0000000 0.0000000), wk = 0.0023148 k( 47) = ( 0.4791667 0.0000000 0.0000000), wk = 0.0023148 k( 48) = ( 0.4895833 -0.0000000 0.0000000), wk = 0.0023148 k( 49) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023148 k( 50) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023148 k( 51) = ( 0.5000000 0.0166667 0.0000000), wk = 0.0023148 k( 52) = ( 0.5000000 0.0333333 0.0000000), wk = 0.0023148 k( 53) = ( 0.5000000 0.0500000 0.0000000), wk = 0.0023148 k( 54) = ( 0.5000000 0.0666667 0.0000000), wk = 0.0023148 k( 55) = ( 0.5000000 0.0833333 0.0000000), wk = 0.0023148 k( 56) = ( 0.5000000 0.1000000 0.0000000), wk = 0.0023148 k( 57) = ( 0.5000000 0.1166667 0.0000000), wk = 0.0023148 k( 58) = ( 0.5000000 0.1333333 0.0000000), wk = 0.0023148 k( 59) = ( 0.5000000 0.1500000 0.0000000), wk = 0.0023148 k( 60) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0023148 k( 61) = ( 0.5000000 0.1833333 0.0000000), wk = 0.0023148 k( 62) = ( 0.5000000 0.2000000 0.0000000), wk = 0.0023148 k( 63) = ( 0.5000000 0.2166667 -0.0000000), wk = 0.0023148 k( 64) = ( 0.5000000 0.2333333 -0.0000000), wk = 0.0023148 k( 65) = ( 0.5000000 0.2500000 0.0000000), wk = 0.0023148 k( 66) = ( 0.5000000 0.2666667 -0.0000000), wk = 0.0023148 k( 67) = ( 0.5000000 0.2833333 -0.0000000), wk = 0.0023148 k( 68) = ( 0.5000000 0.3000000 0.0000000), wk = 0.0023148 k( 69) = ( 0.5000000 0.3166667 -0.0000000), wk = 0.0023148 k( 70) = ( 0.5000000 0.3333333 -0.0000000), wk = 0.0023148 k( 71) = ( 0.5000000 0.3500000 0.0000000), wk = 0.0023148 k( 72) = ( 0.5000000 0.3666667 0.0000000), wk = 0.0023148 k( 73) = ( 0.5000000 0.3833333 0.0000000), wk = 0.0023148 k( 74) = ( 0.5000000 0.4000000 -0.0000000), wk = 0.0023148 k( 75) = ( 0.5000000 0.4166667 -0.0000000), wk = 0.0023148 k( 76) = ( 0.5000000 0.4333333 0.0000000), wk = 0.0023148 k( 77) = ( 0.5000000 0.4500000 -0.0000000), wk = 0.0023148 k( 78) = ( 0.5000000 0.4666667 -0.0000000), wk = 0.0023148 k( 79) = ( 0.5000000 0.4833333 -0.0000000), wk = 0.0023148 k( 80) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023148 k( 81) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023148 k( 82) = ( 0.4895833 0.5000000 0.0000000), wk = 0.0023148 k( 83) = ( 0.4791667 0.5000000 0.0000000), wk = 0.0023148 k( 84) = ( 0.4687500 0.5000000 -0.0000000), wk = 0.0023148 k( 85) = ( 0.4583333 0.5000000 0.0000000), wk = 0.0023148 k( 86) = ( 0.4479167 0.5000000 -0.0000000), wk = 0.0023148 k( 87) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0023148 k( 88) = ( 0.4270833 0.5000000 -0.0000000), wk = 0.0023148 k( 89) = ( 0.4166667 0.5000000 -0.0000000), wk = 0.0023148 k( 90) = ( 0.4062500 0.5000000 -0.0000000), wk = 0.0023148 k( 91) = ( 0.3958333 0.5000000 -0.0000000), wk = 0.0023148 k( 92) = ( 0.3854167 0.5000000 0.0000000), wk = 0.0023148 k( 93) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0023148 k( 94) = ( 0.3645833 0.5000000 0.0000000), wk = 0.0023148 k( 95) = ( 0.3541667 0.5000000 -0.0000000), wk = 0.0023148 k( 96) = ( 0.3437500 0.5000000 0.0000000), wk = 0.0023148 k( 97) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0023148 k( 98) = ( 0.3229167 0.5000000 -0.0000000), wk = 0.0023148 k( 99) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0023148 k( 100) = ( 0.3020833 0.5000000 -0.0000000), wk = 0.0023148 k( 101) = ( 0.2916667 0.5000000 -0.0000000), wk = 0.0023148 k( 102) = ( 0.2812500 0.5000000 -0.0000000), wk = 0.0023148 k( 103) = ( 0.2708333 0.5000000 -0.0000000), wk = 0.0023148 k( 104) = ( 0.2604167 0.5000000 0.0000000), wk = 0.0023148 k( 105) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0023148 k( 106) = ( 0.2395833 0.5000000 0.0000000), wk = 0.0023148 k( 107) = ( 0.2291667 0.5000000 0.0000000), wk = 0.0023148 k( 108) = ( 0.2187500 0.5000000 0.0000000), wk = 0.0023148 k( 109) = ( 0.2083333 0.5000000 -0.0000000), wk = 0.0023148 k( 110) = ( 0.1979167 0.5000000 -0.0000000), wk = 0.0023148 k( 111) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0023148 k( 112) = ( 0.1770833 0.5000000 -0.0000000), wk = 0.0023148 k( 113) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0023148 k( 114) = ( 0.1562500 0.5000000 -0.0000000), wk = 0.0023148 k( 115) = ( 0.1458333 0.5000000 0.0000000), wk = 0.0023148 k( 116) = ( 0.1354167 0.5000000 -0.0000000), wk = 0.0023148 k( 117) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0023148 k( 118) = ( 0.1145833 0.5000000 0.0000000), wk = 0.0023148 k( 119) = ( 0.1041667 0.5000000 -0.0000000), wk = 0.0023148 k( 120) = ( 0.0937500 0.5000000 -0.0000000), wk = 0.0023148 k( 121) = ( 0.0833333 0.5000000 -0.0000000), wk = 0.0023148 k( 122) = ( 0.0729167 0.5000000 0.0000000), wk = 0.0023148 k( 123) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0023148 k( 124) = ( 0.0520833 0.5000000 -0.0000000), wk = 0.0023148 k( 125) = ( 0.0416667 0.5000000 -0.0000000), wk = 0.0023148 k( 126) = ( 0.0312500 0.5000000 -0.0000000), wk = 0.0023148 k( 127) = ( 0.0208333 0.5000000 0.0000000), wk = 0.0023148 k( 128) = ( 0.0104167 0.5000000 -0.0000000), wk = 0.0023148 k( 129) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0023148 k( 130) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0023148 k( 131) = ( 0.0000000 0.4833333 -0.0000000), wk = 0.0023148 k( 132) = ( 0.0000000 0.4666667 -0.0000000), wk = 0.0023148 k( 133) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0023148 k( 134) = ( 0.0000000 0.4333333 -0.0000000), wk = 0.0023148 k( 135) = ( 0.0000000 0.4166667 -0.0000000), wk = 0.0023148 k( 136) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0023148 k( 137) = ( 0.0000000 0.3833333 -0.0000000), wk = 0.0023148 k( 138) = ( 0.0000000 0.3666667 -0.0000000), wk = 0.0023148 k( 139) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0023148 k( 140) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0023148 k( 141) = ( 0.0000000 0.3166667 -0.0000000), wk = 0.0023148 k( 142) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0023148 k( 143) = ( 0.0000000 0.2833333 -0.0000000), wk = 0.0023148 k( 144) = ( 0.0000000 0.2666667 0.0000000), wk = 0.0023148 k( 145) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0023148 k( 146) = ( 0.0000000 0.2333333 -0.0000000), wk = 0.0023148 k( 147) = ( 0.0000000 0.2166667 -0.0000000), wk = 0.0023148 k( 148) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0023148 k( 149) = ( 0.0000000 0.1833333 -0.0000000), wk = 0.0023148 k( 150) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0023148 k( 151) = ( 0.0000000 0.1500000 0.0000000), wk = 0.0023148 k( 152) = ( 0.0000000 0.1333333 -0.0000000), wk = 0.0023148 k( 153) = ( 0.0000000 0.1166667 -0.0000000), wk = 0.0023148 k( 154) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0023148 k( 155) = ( 0.0000000 0.0833333 -0.0000000), wk = 0.0023148 k( 156) = ( 0.0000000 0.0666667 -0.0000000), wk = 0.0023148 k( 157) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0023148 k( 158) = ( 0.0000000 0.0333333 -0.0000000), wk = 0.0023148 k( 159) = ( 0.0000000 0.0166667 -0.0000000), wk = 0.0023148 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023148 k( 161) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023148 k( 162) = ( 0.0000000 0.0000000 0.0185185), wk = 0.0023148 k( 163) = ( 0.0000000 0.0000000 0.0370370), wk = 0.0023148 k( 164) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0023148 k( 165) = ( 0.0000000 0.0000000 0.0740741), wk = 0.0023148 k( 166) = ( 0.0000000 0.0000000 0.0925926), wk = 0.0023148 k( 167) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0023148 k( 168) = ( 0.0000000 0.0000000 0.1296296), wk = 0.0023148 k( 169) = ( 0.0000000 0.0000000 0.1481482), wk = 0.0023148 k( 170) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0023148 k( 171) = ( 0.0000000 0.0000000 0.1851852), wk = 0.0023148 k( 172) = ( 0.0000000 0.0000000 0.2037037), wk = 0.0023148 k( 173) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0023148 k( 174) = ( 0.0000000 0.0000000 0.2407407), wk = 0.0023148 k( 175) = ( 0.0000000 0.0000000 0.2592593), wk = 0.0023148 k( 176) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0023148 k( 177) = ( 0.0000000 0.0000000 0.2962963), wk = 0.0023148 k( 178) = ( 0.0000000 0.0000000 0.3148148), wk = 0.0023148 k( 179) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0023148 k( 180) = ( 0.0000000 0.0000000 0.3518518), wk = 0.0023148 k( 181) = ( 0.0000000 0.0000000 0.3703704), wk = 0.0023148 k( 182) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0023148 k( 183) = ( 0.0000000 0.0000000 0.4074074), wk = 0.0023148 k( 184) = ( 0.0000000 0.0000000 0.4259259), wk = 0.0023148 k( 185) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0023148 k( 186) = ( 0.0000000 0.0000000 0.4629630), wk = 0.0023148 k( 187) = ( 0.0000000 0.0000000 0.4814815), wk = 0.0023148 k( 188) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023148 k( 189) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023148 k( 190) = ( 0.0104167 0.0000000 0.5000000), wk = 0.0023148 k( 191) = ( 0.0208333 0.0000000 0.5000000), wk = 0.0023148 k( 192) = ( 0.0312500 0.0000000 0.5000000), wk = 0.0023148 k( 193) = ( 0.0416667 0.0000000 0.5000000), wk = 0.0023148 k( 194) = ( 0.0520833 0.0000000 0.5000000), wk = 0.0023148 k( 195) = ( 0.0625000 0.0000000 0.5000000), wk = 0.0023148 k( 196) = ( 0.0729167 0.0000000 0.5000000), wk = 0.0023148 k( 197) = ( 0.0833333 0.0000000 0.5000000), wk = 0.0023148 k( 198) = ( 0.0937500 0.0000000 0.5000000), wk = 0.0023148 k( 199) = ( 0.1041667 -0.0000000 0.5000000), wk = 0.0023148 k( 200) = ( 0.1145833 0.0000000 0.5000000), wk = 0.0023148 k( 201) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0023148 k( 202) = ( 0.1354167 0.0000000 0.5000000), wk = 0.0023148 k( 203) = ( 0.1458333 0.0000000 0.5000000), wk = 0.0023148 k( 204) = ( 0.1562500 0.0000000 0.5000000), wk = 0.0023148 k( 205) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0023148 k( 206) = ( 0.1770833 0.0000000 0.5000000), wk = 0.0023148 k( 207) = ( 0.1875000 0.0000000 0.5000000), wk = 0.0023148 k( 208) = ( 0.1979167 0.0000000 0.5000000), wk = 0.0023148 k( 209) = ( 0.2083333 -0.0000000 0.5000000), wk = 0.0023148 k( 210) = ( 0.2187500 0.0000000 0.5000000), wk = 0.0023148 k( 211) = ( 0.2291667 -0.0000000 0.5000000), wk = 0.0023148 k( 212) = ( 0.2395833 0.0000000 0.5000000), wk = 0.0023148 k( 213) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0023148 k( 214) = ( 0.2604167 0.0000000 0.5000000), wk = 0.0023148 k( 215) = ( 0.2708333 0.0000000 0.5000000), wk = 0.0023148 k( 216) = ( 0.2812500 0.0000000 0.5000000), wk = 0.0023148 k( 217) = ( 0.2916667 -0.0000000 0.5000000), wk = 0.0023148 k( 218) = ( 0.3020833 0.0000000 0.5000000), wk = 0.0023148 k( 219) = ( 0.3125000 0.0000000 0.5000000), wk = 0.0023148 k( 220) = ( 0.3229167 0.0000000 0.5000000), wk = 0.0023148 k( 221) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0023148 k( 222) = ( 0.3437500 0.0000000 0.5000000), wk = 0.0023148 k( 223) = ( 0.3541667 0.0000000 0.5000000), wk = 0.0023148 k( 224) = ( 0.3645833 0.0000000 0.5000000), wk = 0.0023148 k( 225) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0023148 k( 226) = ( 0.3854167 0.0000000 0.5000000), wk = 0.0023148 k( 227) = ( 0.3958333 0.0000000 0.5000000), wk = 0.0023148 k( 228) = ( 0.4062500 -0.0000000 0.5000000), wk = 0.0023148 k( 229) = ( 0.4166667 0.0000000 0.5000000), wk = 0.0023148 k( 230) = ( 0.4270833 0.0000000 0.5000000), wk = 0.0023148 k( 231) = ( 0.4375000 0.0000000 0.5000000), wk = 0.0023148 k( 232) = ( 0.4479167 0.0000000 0.5000000), wk = 0.0023148 k( 233) = ( 0.4583333 0.0000000 0.5000000), wk = 0.0023148 k( 234) = ( 0.4687500 0.0000000 0.5000000), wk = 0.0023148 k( 235) = ( 0.4791667 0.0000000 0.5000000), wk = 0.0023148 k( 236) = ( 0.4895833 -0.0000000 0.5000000), wk = 0.0023148 k( 237) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023148 k( 238) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023148 k( 239) = ( 0.5000000 0.0166667 0.5000000), wk = 0.0023148 k( 240) = ( 0.5000000 0.0333333 0.5000000), wk = 0.0023148 k( 241) = ( 0.5000000 0.0500000 0.5000000), wk = 0.0023148 k( 242) = ( 0.5000000 0.0666667 0.5000000), wk = 0.0023148 k( 243) = ( 0.5000000 0.0833333 0.5000000), wk = 0.0023148 k( 244) = ( 0.5000000 0.1000000 0.5000000), wk = 0.0023148 k( 245) = ( 0.5000000 0.1166667 0.5000000), wk = 0.0023148 k( 246) = ( 0.5000000 0.1333333 0.5000000), wk = 0.0023148 k( 247) = ( 0.5000000 0.1500000 0.5000000), wk = 0.0023148 k( 248) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0023148 k( 249) = ( 0.5000000 0.1833333 0.5000000), wk = 0.0023148 k( 250) = ( 0.5000000 0.2000000 0.5000000), wk = 0.0023148 k( 251) = ( 0.5000000 0.2166667 0.5000000), wk = 0.0023148 k( 252) = ( 0.5000000 0.2333333 0.5000000), wk = 0.0023148 k( 253) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0023148 k( 254) = ( 0.5000000 0.2666667 0.5000000), wk = 0.0023148 k( 255) = ( 0.5000000 0.2833333 0.5000000), wk = 0.0023148 k( 256) = ( 0.5000000 0.3000000 0.5000000), wk = 0.0023148 k( 257) = ( 0.5000000 0.3166667 0.5000000), wk = 0.0023148 k( 258) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0023148 k( 259) = ( 0.5000000 0.3500000 0.5000000), wk = 0.0023148 k( 260) = ( 0.5000000 0.3666667 0.5000000), wk = 0.0023148 k( 261) = ( 0.5000000 0.3833333 0.5000000), wk = 0.0023148 k( 262) = ( 0.5000000 0.4000000 0.5000000), wk = 0.0023148 k( 263) = ( 0.5000000 0.4166667 0.5000000), wk = 0.0023148 k( 264) = ( 0.5000000 0.4333333 0.5000000), wk = 0.0023148 k( 265) = ( 0.5000000 0.4500000 0.5000000), wk = 0.0023148 k( 266) = ( 0.5000000 0.4666667 0.5000000), wk = 0.0023148 k( 267) = ( 0.5000000 0.4833333 0.5000000), wk = 0.0023148 k( 268) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023148 k( 269) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023148 k( 270) = ( 0.4895833 0.5000000 0.5000000), wk = 0.0023148 k( 271) = ( 0.4791667 0.5000000 0.5000000), wk = 0.0023148 k( 272) = ( 0.4687500 0.5000000 0.5000000), wk = 0.0023148 k( 273) = ( 0.4583333 0.5000000 0.5000000), wk = 0.0023148 k( 274) = ( 0.4479167 0.5000000 0.5000000), wk = 0.0023148 k( 275) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0023148 k( 276) = ( 0.4270833 0.5000000 0.5000000), wk = 0.0023148 k( 277) = ( 0.4166667 0.5000000 0.5000000), wk = 0.0023148 k( 278) = ( 0.4062500 0.5000000 0.5000000), wk = 0.0023148 k( 279) = ( 0.3958333 0.5000000 0.5000000), wk = 0.0023148 k( 280) = ( 0.3854167 0.5000000 0.5000000), wk = 0.0023148 k( 281) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0023148 k( 282) = ( 0.3645833 0.5000000 0.5000000), wk = 0.0023148 k( 283) = ( 0.3541667 0.5000000 0.5000000), wk = 0.0023148 k( 284) = ( 0.3437500 0.5000000 0.5000000), wk = 0.0023148 k( 285) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0023148 k( 286) = ( 0.3229167 0.5000000 0.5000000), wk = 0.0023148 k( 287) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0023148 k( 288) = ( 0.3020833 0.5000000 0.5000000), wk = 0.0023148 k( 289) = ( 0.2916667 0.5000000 0.5000000), wk = 0.0023148 k( 290) = ( 0.2812500 0.5000000 0.5000000), wk = 0.0023148 k( 291) = ( 0.2708333 0.5000000 0.5000000), wk = 0.0023148 k( 292) = ( 0.2604167 0.5000000 0.5000000), wk = 0.0023148 k( 293) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0023148 k( 294) = ( 0.2395833 0.5000000 0.5000000), wk = 0.0023148 k( 295) = ( 0.2291667 0.5000000 0.5000000), wk = 0.0023148 k( 296) = ( 0.2187500 0.5000000 0.5000000), wk = 0.0023148 k( 297) = ( 0.2083333 0.5000000 0.5000000), wk = 0.0023148 k( 298) = ( 0.1979167 0.5000000 0.5000000), wk = 0.0023148 k( 299) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0023148 k( 300) = ( 0.1770833 0.5000000 0.5000000), wk = 0.0023148 k( 301) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0023148 k( 302) = ( 0.1562500 0.5000000 0.5000000), wk = 0.0023148 k( 303) = ( 0.1458333 0.5000000 0.5000000), wk = 0.0023148 k( 304) = ( 0.1354167 0.5000000 0.5000000), wk = 0.0023148 k( 305) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0023148 k( 306) = ( 0.1145833 0.5000000 0.5000000), wk = 0.0023148 k( 307) = ( 0.1041667 0.5000000 0.5000000), wk = 0.0023148 k( 308) = ( 0.0937500 0.5000000 0.5000000), wk = 0.0023148 k( 309) = ( 0.0833333 0.5000000 0.5000000), wk = 0.0023148 k( 310) = ( 0.0729167 0.5000000 0.5000000), wk = 0.0023148 k( 311) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0023148 k( 312) = ( 0.0520833 0.5000000 0.5000000), wk = 0.0023148 k( 313) = ( 0.0416667 0.5000000 0.5000000), wk = 0.0023148 k( 314) = ( 0.0312500 0.5000000 0.5000000), wk = 0.0023148 k( 315) = ( 0.0208333 0.5000000 0.5000000), wk = 0.0023148 k( 316) = ( 0.0104167 0.5000000 0.5000000), wk = 0.0023148 k( 317) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023148 k( 318) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023148 k( 319) = ( 0.0000000 0.4833333 0.5000000), wk = 0.0023148 k( 320) = ( 0.0000000 0.4666667 0.5000000), wk = 0.0023148 k( 321) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0023148 k( 322) = ( 0.0000000 0.4333333 0.5000000), wk = 0.0023148 k( 323) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0023148 k( 324) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0023148 k( 325) = ( 0.0000000 0.3833333 0.5000000), wk = 0.0023148 k( 326) = ( 0.0000000 0.3666667 0.5000000), wk = 0.0023148 k( 327) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0023148 k( 328) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0023148 k( 329) = ( 0.0000000 0.3166667 0.5000000), wk = 0.0023148 k( 330) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0023148 k( 331) = ( 0.0000000 0.2833333 0.5000000), wk = 0.0023148 k( 332) = ( 0.0000000 0.2666667 0.5000000), wk = 0.0023148 k( 333) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0023148 k( 334) = ( 0.0000000 0.2333333 0.5000000), wk = 0.0023148 k( 335) = ( 0.0000000 0.2166667 0.5000000), wk = 0.0023148 k( 336) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0023148 k( 337) = ( 0.0000000 0.1833333 0.5000000), wk = 0.0023148 k( 338) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0023148 k( 339) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0023148 k( 340) = ( 0.0000000 0.1333333 0.5000000), wk = 0.0023148 k( 341) = ( 0.0000000 0.1166667 0.5000000), wk = 0.0023148 k( 342) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0023148 k( 343) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0023148 k( 344) = ( 0.0000000 0.0666667 0.5000000), wk = 0.0023148 k( 345) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0023148 k( 346) = ( 0.0000000 0.0333333 0.5000000), wk = 0.0023148 k( 347) = ( 0.0000000 0.0166667 0.5000000), wk = 0.0023148 k( 348) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023148 k( 349) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0023148 k( 350) = ( 0.0000000 0.5000000 0.0185185), wk = 0.0023148 k( 351) = ( 0.0000000 0.5000000 0.0370370), wk = 0.0023148 k( 352) = ( 0.0000000 0.5000000 0.0555556), wk = 0.0023148 k( 353) = ( 0.0000000 0.5000000 0.0740741), wk = 0.0023148 k( 354) = ( 0.0000000 0.5000000 0.0925926), wk = 0.0023148 k( 355) = ( 0.0000000 0.5000000 0.1111111), wk = 0.0023148 k( 356) = ( 0.0000000 0.5000000 0.1296296), wk = 0.0023148 k( 357) = ( 0.0000000 0.5000000 0.1481481), wk = 0.0023148 k( 358) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0023148 k( 359) = ( 0.0000000 0.5000000 0.1851852), wk = 0.0023148 k( 360) = ( 0.0000000 0.5000000 0.2037037), wk = 0.0023148 k( 361) = ( 0.0000000 0.5000000 0.2222222), wk = 0.0023148 k( 362) = ( 0.0000000 0.5000000 0.2407407), wk = 0.0023148 k( 363) = ( 0.0000000 0.5000000 0.2592593), wk = 0.0023148 k( 364) = ( 0.0000000 0.5000000 0.2777778), wk = 0.0023148 k( 365) = ( 0.0000000 0.5000000 0.2962963), wk = 0.0023148 k( 366) = ( 0.0000000 0.5000000 0.3148148), wk = 0.0023148 k( 367) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0023148 k( 368) = ( 0.0000000 0.5000000 0.3518518), wk = 0.0023148 k( 369) = ( 0.0000000 0.5000000 0.3703704), wk = 0.0023148 k( 370) = ( 0.0000000 0.5000000 0.3888889), wk = 0.0023148 k( 371) = ( 0.0000000 0.5000000 0.4074074), wk = 0.0023148 k( 372) = ( 0.0000000 0.5000000 0.4259259), wk = 0.0023148 k( 373) = ( 0.0000000 0.5000000 0.4444444), wk = 0.0023148 k( 374) = ( 0.0000000 0.5000000 0.4629630), wk = 0.0023148 k( 375) = ( 0.0000000 0.5000000 0.4814815), wk = 0.0023148 k( 376) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023148 k( 377) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0023148 k( 378) = ( 0.5000000 0.0000000 0.4814815), wk = 0.0023148 k( 379) = ( 0.5000000 0.0000000 0.4629630), wk = 0.0023148 k( 380) = ( 0.5000000 0.0000000 0.4444444), wk = 0.0023148 k( 381) = ( 0.5000000 0.0000000 0.4259259), wk = 0.0023148 k( 382) = ( 0.5000000 0.0000000 0.4074074), wk = 0.0023148 k( 383) = ( 0.5000000 0.0000000 0.3888889), wk = 0.0023148 k( 384) = ( 0.5000000 0.0000000 0.3703704), wk = 0.0023148 k( 385) = ( 0.5000000 0.0000000 0.3518518), wk = 0.0023148 k( 386) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0023148 k( 387) = ( 0.5000000 0.0000000 0.3148148), wk = 0.0023148 k( 388) = ( 0.5000000 0.0000000 0.2962963), wk = 0.0023148 k( 389) = ( 0.5000000 0.0000000 0.2777778), wk = 0.0023148 k( 390) = ( 0.5000000 0.0000000 0.2592593), wk = 0.0023148 k( 391) = ( 0.5000000 0.0000000 0.2407407), wk = 0.0023148 k( 392) = ( 0.5000000 0.0000000 0.2222222), wk = 0.0023148 k( 393) = ( 0.5000000 0.0000000 0.2037037), wk = 0.0023148 k( 394) = ( 0.5000000 0.0000000 0.1851852), wk = 0.0023148 k( 395) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0023148 k( 396) = ( 0.5000000 0.0000000 0.1481481), wk = 0.0023148 k( 397) = ( 0.5000000 0.0000000 0.1296296), wk = 0.0023148 k( 398) = ( 0.5000000 0.0000000 0.1111111), wk = 0.0023148 k( 399) = ( 0.5000000 0.0000000 0.0925926), wk = 0.0023148 k( 400) = ( 0.5000000 0.0000000 0.0740741), wk = 0.0023148 k( 401) = ( 0.5000000 0.0000000 0.0555556), wk = 0.0023148 k( 402) = ( 0.5000000 0.0000000 0.0370370), wk = 0.0023148 k( 403) = ( 0.5000000 0.0000000 0.0185185), wk = 0.0023148 k( 404) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0023148 k( 405) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0023148 k( 406) = ( 0.5000000 0.5000000 0.0185185), wk = 0.0023148 k( 407) = ( 0.5000000 0.5000000 0.0370370), wk = 0.0023148 k( 408) = ( 0.5000000 0.5000000 0.0555556), wk = 0.0023148 k( 409) = ( 0.5000000 0.5000000 0.0740741), wk = 0.0023148 k( 410) = ( 0.5000000 0.5000000 0.0925926), wk = 0.0023148 k( 411) = ( 0.5000000 0.5000000 0.1111111), wk = 0.0023148 k( 412) = ( 0.5000000 0.5000000 0.1296296), wk = 0.0023148 k( 413) = ( 0.5000000 0.5000000 0.1481481), wk = 0.0023148 k( 414) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0023148 k( 415) = ( 0.5000000 0.5000000 0.1851852), wk = 0.0023148 k( 416) = ( 0.5000000 0.5000000 0.2037037), wk = 0.0023148 k( 417) = ( 0.5000000 0.5000000 0.2222222), wk = 0.0023148 k( 418) = ( 0.5000000 0.5000000 0.2407407), wk = 0.0023148 k( 419) = ( 0.5000000 0.5000000 0.2592593), wk = 0.0023148 k( 420) = ( 0.5000000 0.5000000 0.2777778), wk = 0.0023148 k( 421) = ( 0.5000000 0.5000000 0.2962963), wk = 0.0023148 k( 422) = ( 0.5000000 0.5000000 0.3148148), wk = 0.0023148 k( 423) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0023148 k( 424) = ( 0.5000000 0.5000000 0.3518518), wk = 0.0023148 k( 425) = ( 0.5000000 0.5000000 0.3703704), wk = 0.0023148 k( 426) = ( 0.5000000 0.5000000 0.3888889), wk = 0.0023148 k( 427) = ( 0.5000000 0.5000000 0.4074074), wk = 0.0023148 k( 428) = ( 0.5000000 0.5000000 0.4259259), wk = 0.0023148 k( 429) = ( 0.5000000 0.5000000 0.4444444), wk = 0.0023148 k( 430) = ( 0.5000000 0.5000000 0.4629630), wk = 0.0023148 k( 431) = ( 0.5000000 0.5000000 0.4814815), wk = 0.0023148 k( 432) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023148 Dense grid: 44247 G-vectors FFT dimensions: ( 32, 54, 60) Smooth grid: 30059 G-vectors FFT dimensions: ( 27, 45, 50) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 208, 62) NL pseudopotentials 0.30 Mb ( 104, 192) Each V/rho on FFT grid 0.05 Mb ( 3456) Each G-vector array 0.01 Mb ( 1232) G-vector shells 0.00 Mb ( 633) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.79 Mb ( 208, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.36 Mb ( 192, 2, 62) The potential is recalculated from file : ./FeAs.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.1 secs Computing kpt #: 2 total cpu time spent up to now is 2.8 secs Computing kpt #: 3 total cpu time spent up to now is 3.4 secs Computing kpt #: 4 total cpu time spent up to now is 4.1 secs Computing kpt #: 5 total cpu time spent up to now is 4.7 secs Computing kpt #: 6 total cpu time spent up to now is 5.4 secs Computing kpt #: 7 total cpu time spent up to now is 6.1 secs Computing kpt #: 8 total cpu time spent up to now is 6.9 secs Computing kpt #: 9 total cpu time spent up to now is 7.6 secs Computing kpt #: 10 total cpu time spent up to now is 8.3 secs Computing kpt #: 11 total cpu time spent up to now is 9.0 secs Computing kpt #: 12 total cpu time spent up to now is 9.6 secs Computing kpt #: 13 total cpu time spent up to now is 10.3 secs Computing kpt #: 14 total cpu time spent up to now is 10.9 secs Computing kpt #: 15 total cpu time spent up to now is 11.6 secs Computing kpt #: 16 total cpu time spent up to now is 12.2 secs Computing kpt #: 17 total cpu time spent up to now is 12.8 secs Computing kpt #: 18 total cpu time spent up to now is 13.4 secs Computing kpt #: 19 total cpu time spent up to now is 14.1 secs Computing kpt #: 20 total cpu time spent up to now is 14.7 secs Computing kpt #: 21 total cpu time spent up to now is 15.3 secs Computing kpt #: 22 total cpu time spent up to now is 15.9 secs Computing kpt #: 23 total cpu time spent up to now is 16.5 secs Computing kpt #: 24 total cpu time spent up to now is 17.1 secs Computing kpt #: 25 total cpu time spent up to now is 17.6 secs Computing kpt #: 26 total cpu time spent up to now is 18.2 secs Computing kpt #: 27 total cpu time spent up to now is 18.7 secs Computing kpt #: 28 total cpu time spent up to now is 19.3 secs Computing kpt #: 29 total cpu time spent up to now is 19.8 secs Computing kpt #: 30 total cpu time spent up to now is 20.4 secs Computing kpt #: 31 total cpu time spent up to now is 20.9 secs Computing kpt #: 32 total cpu time spent up to now is 21.5 secs Computing kpt #: 33 total cpu time spent up to now is 22.0 secs Computing kpt #: 34 total cpu time spent up to now is 22.5 secs Computing kpt #: 35 total cpu time spent up to now is 23.1 secs Computing kpt #: 36 total cpu time spent up to now is 23.7 secs Computing kpt #: 37 total cpu time spent up to now is 24.2 secs Computing kpt #: 38 total cpu time spent up to now is 24.9 secs Computing kpt #: 39 total cpu time spent up to now is 25.5 secs Computing kpt #: 40 total cpu time spent up to now is 26.4 secs Computing kpt #: 41 total cpu time spent up to now is 27.0 secs Computing kpt #: 42 total cpu time spent up to now is 27.6 secs Computing kpt #: 43 total cpu time spent up to now is 28.5 secs Computing kpt #: 44 total cpu time spent up to now is 29.3 secs Computing kpt #: 45 total cpu time spent up to now is 30.2 secs Computing kpt #: 46 total cpu time spent up to now is 31.1 secs Computing kpt #: 47 total cpu time spent up to now is 32.2 secs Computing kpt #: 48 total cpu time spent up to now is 33.4 secs Computing kpt #: 49 total cpu time spent up to now is 33.9 secs Computing kpt #: 50 total cpu time spent up to now is 35.3 secs Computing kpt #: 51 total cpu time spent up to now is 35.9 secs Computing kpt #: 52 total cpu time spent up to now is 36.6 secs Computing kpt #: 53 total cpu time spent up to now is 37.1 secs Computing kpt #: 54 total cpu time spent up to now is 37.7 secs Computing kpt #: 55 total cpu time spent up to now is 38.2 secs Computing kpt #: 56 total cpu time spent up to now is 38.8 secs Computing kpt #: 57 total cpu time spent up to now is 39.3 secs Computing kpt #: 58 total cpu time spent up to now is 39.8 secs Computing kpt #: 59 total cpu time spent up to now is 40.4 secs Computing kpt #: 60 total cpu time spent up to now is 40.9 secs Computing kpt #: 61 total cpu time spent up to now is 41.5 secs Computing kpt #: 62 total cpu time spent up to now is 42.0 secs Computing kpt #: 63 total cpu time spent up to now is 42.6 secs Computing kpt #: 64 total cpu time spent up to now is 43.1 secs Computing kpt #: 65 total cpu time spent up to now is 43.7 secs Computing kpt #: 66 total cpu time spent up to now is 44.3 secs Computing kpt #: 67 total cpu time spent up to now is 44.8 secs Computing kpt #: 68 total cpu time spent up to now is 45.4 secs Computing kpt #: 69 total cpu time spent up to now is 46.0 secs Computing kpt #: 70 total cpu time spent up to now is 46.6 secs Computing kpt #: 71 total cpu time spent up to now is 47.2 secs Computing kpt #: 72 total cpu time spent up to now is 47.8 secs Computing kpt #: 73 total cpu time spent up to now is 48.4 secs Computing kpt #: 74 total cpu time spent up to now is 49.0 secs Computing kpt #: 75 total cpu time spent up to now is 49.6 secs Computing kpt #: 76 total cpu time spent up to now is 50.2 secs Computing kpt #: 77 total cpu time spent up to now is 50.9 secs Computing kpt #: 78 total cpu time spent up to now is 51.5 secs Computing kpt #: 79 total cpu time spent up to now is 52.1 secs Computing kpt #: 80 total cpu time spent up to now is 52.6 secs Computing kpt #: 81 total cpu time spent up to now is 53.4 secs Computing kpt #: 82 total cpu time spent up to now is 54.1 secs Computing kpt #: 83 total cpu time spent up to now is 54.8 secs Computing kpt #: 84 total cpu time spent up to now is 55.8 secs Computing kpt #: 85 total cpu time spent up to now is 56.7 secs Computing kpt #: 86 total cpu time spent up to now is 57.6 secs Computing kpt #: 87 total cpu time spent up to now is 58.6 secs Computing kpt #: 88 total cpu time spent up to now is 59.5 secs Computing kpt #: 89 total cpu time spent up to now is 60.4 secs Computing kpt #: 90 total cpu time spent up to now is 61.4 secs Computing kpt #: 91 total cpu time spent up to now is 62.3 secs Computing kpt #: 92 total cpu time spent up to now is 63.3 secs Computing kpt #: 93 total cpu time spent up to now is 64.2 secs Computing kpt #: 94 total cpu time spent up to now is 65.1 secs Computing kpt #: 95 total cpu time spent up to now is 65.7 secs Computing kpt #: 96 total cpu time spent up to now is 66.3 secs Computing kpt #: 97 total cpu time spent up to now is 67.0 secs Computing kpt #: 98 total cpu time spent up to now is 67.6 secs Computing kpt #: 99 total cpu time spent up to now is 68.2 secs Computing kpt #: 100 total cpu time spent up to now is 68.8 secs Computing kpt #: 101 total cpu time spent up to now is 69.5 secs Computing kpt #: 102 total cpu time spent up to now is 70.1 secs Computing kpt #: 103 total cpu time spent up to now is 70.7 secs Computing kpt #: 104 total cpu time spent up to now is 71.4 secs Computing kpt #: 105 total cpu time spent up to now is 72.1 secs Computing kpt #: 106 total cpu time spent up to now is 72.8 secs Computing kpt #: 107 total cpu time spent up to now is 73.4 secs Computing kpt #: 108 total cpu time spent up to now is 74.1 secs Computing kpt #: 109 total cpu time spent up to now is 74.8 secs Computing kpt #: 110 total cpu time spent up to now is 75.5 secs Computing kpt #: 111 total cpu time spent up to now is 76.1 secs Computing kpt #: 112 total cpu time spent up to now is 76.9 secs Computing kpt #: 113 total cpu time spent up to now is 77.6 secs Computing kpt #: 114 total cpu time spent up to now is 78.4 secs Computing kpt #: 115 total cpu time spent up to now is 79.1 secs Computing kpt #: 116 total cpu time spent up to now is 79.9 secs Computing kpt #: 117 total cpu time spent up to now is 80.6 secs Computing kpt #: 118 total cpu time spent up to now is 81.2 secs Computing kpt #: 119 total cpu time spent up to now is 82.0 secs Computing kpt #: 120 total cpu time spent up to now is 82.7 secs Computing kpt #: 121 total cpu time spent up to now is 83.5 secs Computing kpt #: 122 total cpu time spent up to now is 84.2 secs Computing kpt #: 123 total cpu time spent up to now is 85.0 secs Computing kpt #: 124 total cpu time spent up to now is 85.7 secs Computing kpt #: 125 total cpu time spent up to now is 86.5 secs Computing kpt #: 126 total cpu time spent up to now is 87.2 secs Computing kpt #: 127 total cpu time spent up to now is 88.0 secs Computing kpt #: 128 total cpu time spent up to now is 88.7 secs Computing kpt #: 129 total cpu time spent up to now is 89.3 secs Computing kpt #: 130 total cpu time spent up to now is 89.8 secs Computing kpt #: 131 total cpu time spent up to now is 90.5 secs Computing kpt #: 132 total cpu time spent up to now is 91.1 secs Computing kpt #: 133 total cpu time spent up to now is 91.7 secs Computing kpt #: 134 total cpu time spent up to now is 92.3 secs Computing kpt #: 135 total cpu time spent up to now is 92.9 secs Computing kpt #: 136 total cpu time spent up to now is 93.5 secs Computing kpt #: 137 total cpu time spent up to now is 94.2 secs Computing kpt #: 138 total cpu time spent up to now is 94.9 secs Computing kpt #: 139 total cpu time spent up to now is 95.7 secs Computing kpt #: 140 total cpu time spent up to now is 96.9 secs Computing kpt #: 141 total cpu time spent up to now is 97.7 secs Computing kpt #: 142 total cpu time spent up to now is 98.4 secs Computing kpt #: 143 total cpu time spent up to now is 99.2 secs Computing kpt #: 144 total cpu time spent up to now is 99.9 secs Computing kpt #: 145 total cpu time spent up to now is 100.5 secs Computing kpt #: 146 total cpu time spent up to now is 101.2 secs Computing kpt #: 147 total cpu time spent up to now is 101.8 secs Computing kpt #: 148 total cpu time spent up to now is 102.4 secs Computing kpt #: 149 total cpu time spent up to now is 103.0 secs Computing kpt #: 150 total cpu time spent up to now is 103.6 secs Computing kpt #: 151 total cpu time spent up to now is 104.2 secs Computing kpt #: 152 total cpu time spent up to now is 104.8 secs Computing kpt #: 153 total cpu time spent up to now is 105.4 secs Computing kpt #: 154 total cpu time spent up to now is 106.1 secs Computing kpt #: 155 total cpu time spent up to now is 106.8 secs Computing kpt #: 156 total cpu time spent up to now is 107.5 secs Computing kpt #: 157 total cpu time spent up to now is 108.2 secs Computing kpt #: 158 total cpu time spent up to now is 108.9 secs Computing kpt #: 159 total cpu time spent up to now is 109.5 secs Computing kpt #: 160 total cpu time spent up to now is 110.2 secs Computing kpt #: 161 total cpu time spent up to now is 110.9 secs Computing kpt #: 162 total cpu time spent up to now is 111.5 secs Computing kpt #: 163 total cpu time spent up to now is 112.2 secs Computing kpt #: 164 total cpu time spent up to now is 112.9 secs Computing kpt #: 165 total cpu time spent up to now is 113.7 secs Computing kpt #: 166 total cpu time spent up to now is 114.3 secs Computing kpt #: 167 total cpu time spent up to now is 115.0 secs Computing kpt #: 168 total cpu time spent up to now is 115.7 secs Computing kpt #: 169 total cpu time spent up to now is 116.4 secs Computing kpt #: 170 total cpu time spent up to now is 117.0 secs Computing kpt #: 171 total cpu time spent up to now is 117.7 secs Computing kpt #: 172 total cpu time spent up to now is 118.3 secs Computing kpt #: 173 total cpu time spent up to now is 118.9 secs Computing kpt #: 174 total cpu time spent up to now is 119.5 secs Computing kpt #: 175 total cpu time spent up to now is 120.2 secs Computing kpt #: 176 total cpu time spent up to now is 120.8 secs Computing kpt #: 177 total cpu time spent up to now is 121.4 secs Computing kpt #: 178 total cpu time spent up to now is 122.0 secs Computing kpt #: 179 total cpu time spent up to now is 122.6 secs Computing kpt #: 180 total cpu time spent up to now is 123.1 secs Computing kpt #: 181 total cpu time spent up to now is 123.7 secs Computing kpt #: 182 total cpu time spent up to now is 124.3 secs Computing kpt #: 183 total cpu time spent up to now is 124.9 secs Computing kpt #: 184 total cpu time spent up to now is 125.5 secs Computing kpt #: 185 total cpu time spent up to now is 126.1 secs Computing kpt #: 186 total cpu time spent up to now is 126.7 secs Computing kpt #: 187 total cpu time spent up to now is 127.3 secs Computing kpt #: 188 total cpu time spent up to now is 127.9 secs Computing kpt #: 189 total cpu time spent up to now is 128.4 secs Computing kpt #: 190 total cpu time spent up to now is 129.2 secs Computing kpt #: 191 total cpu time spent up to now is 129.9 secs Computing kpt #: 192 total cpu time spent up to now is 130.6 secs Computing kpt #: 193 total cpu time spent up to now is 131.3 secs Computing kpt #: 194 total cpu time spent up to now is 132.0 secs Computing kpt #: 195 total cpu time spent up to now is 132.7 secs Computing kpt #: 196 total cpu time spent up to now is 133.5 secs Computing kpt #: 197 total cpu time spent up to now is 134.2 secs Computing kpt #: 198 total cpu time spent up to now is 135.0 secs Computing kpt #: 199 total cpu time spent up to now is 136.0 secs Computing kpt #: 200 total cpu time spent up to now is 137.0 secs Computing kpt #: 201 total cpu time spent up to now is 138.2 secs Computing kpt #: 202 total cpu time spent up to now is 139.0 secs Computing kpt #: 203 total cpu time spent up to now is 140.6 secs Computing kpt #: 204 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 142.5 secs Computing kpt #: 205 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 144.3 secs Computing kpt #: 206 total cpu time spent up to now is 145.0 secs Computing kpt #: 207 total cpu time spent up to now is 145.7 secs Computing kpt #: 208 total cpu time spent up to now is 146.4 secs Computing kpt #: 209 total cpu time spent up to now is 147.0 secs Computing kpt #: 210 total cpu time spent up to now is 147.7 secs Computing kpt #: 211 total cpu time spent up to now is 148.4 secs Computing kpt #: 212 total cpu time spent up to now is 149.0 secs Computing kpt #: 213 total cpu time spent up to now is 151.2 secs Computing kpt #: 214 total cpu time spent up to now is 152.1 secs Computing kpt #: 215 total cpu time spent up to now is 152.9 secs Computing kpt #: 216 total cpu time spent up to now is 153.5 secs Computing kpt #: 217 total cpu time spent up to now is 154.4 secs Computing kpt #: 218 total cpu time spent up to now is 155.3 secs Computing kpt #: 219 total cpu time spent up to now is 156.2 secs Computing kpt #: 220 total cpu time spent up to now is 157.1 secs Computing kpt #: 221 total cpu time spent up to now is 158.0 secs Computing kpt #: 222 total cpu time spent up to now is 158.9 secs Computing kpt #: 223 total cpu time spent up to now is 159.8 secs Computing kpt #: 224 total cpu time spent up to now is 160.8 secs Computing kpt #: 225 total cpu time spent up to now is 161.7 secs Computing kpt #: 226 total cpu time spent up to now is 162.5 secs Computing kpt #: 227 total cpu time spent up to now is 163.3 secs Computing kpt #: 228 total cpu time spent up to now is 164.2 secs Computing kpt #: 229 total cpu time spent up to now is 165.1 secs Computing kpt #: 230 total cpu time spent up to now is 166.0 secs Computing kpt #: 231 total cpu time spent up to now is 167.2 secs Computing kpt #: 232 total cpu time spent up to now is 168.4 secs Computing kpt #: 233 total cpu time spent up to now is 169.4 secs Computing kpt #: 234 total cpu time spent up to now is 170.3 secs Computing kpt #: 235 total cpu time spent up to now is 171.5 secs Computing kpt #: 236 total cpu time spent up to now is 172.2 secs Computing kpt #: 237 total cpu time spent up to now is 172.7 secs Computing kpt #: 238 total cpu time spent up to now is 173.3 secs Computing kpt #: 239 total cpu time spent up to now is 173.8 secs Computing kpt #: 240 total cpu time spent up to now is 174.4 secs Computing kpt #: 241 total cpu time spent up to now is 175.0 secs Computing kpt #: 242 total cpu time spent up to now is 175.5 secs Computing kpt #: 243 total cpu time spent up to now is 176.1 secs Computing kpt #: 244 total cpu time spent up to now is 176.7 secs Computing kpt #: 245 total cpu time spent up to now is 177.3 secs Computing kpt #: 246 total cpu time spent up to now is 177.9 secs Computing kpt #: 247 total cpu time spent up to now is 178.4 secs Computing kpt #: 248 total cpu time spent up to now is 179.0 secs Computing kpt #: 249 total cpu time spent up to now is 179.6 secs Computing kpt #: 250 total cpu time spent up to now is 180.1 secs Computing kpt #: 251 total cpu time spent up to now is 180.7 secs Computing kpt #: 252 total cpu time spent up to now is 181.2 secs Computing kpt #: 253 total cpu time spent up to now is 181.8 secs Computing kpt #: 254 total cpu time spent up to now is 182.3 secs Computing kpt #: 255 total cpu time spent up to now is 183.0 secs Computing kpt #: 256 total cpu time spent up to now is 183.6 secs Computing kpt #: 257 total cpu time spent up to now is 184.1 secs Computing kpt #: 258 total cpu time spent up to now is 184.7 secs Computing kpt #: 259 total cpu time spent up to now is 185.2 secs Computing kpt #: 260 total cpu time spent up to now is 185.8 secs Computing kpt #: 261 total cpu time spent up to now is 186.4 secs Computing kpt #: 262 total cpu time spent up to now is 187.0 secs Computing kpt #: 263 total cpu time spent up to now is 187.5 secs Computing kpt #: 264 total cpu time spent up to now is 188.1 secs Computing kpt #: 265 total cpu time spent up to now is 188.7 secs Computing kpt #: 266 total cpu time spent up to now is 189.3 secs Computing kpt #: 267 total cpu time spent up to now is 189.9 secs Computing kpt #: 268 total cpu time spent up to now is 190.5 secs Computing kpt #: 269 total cpu time spent up to now is 191.1 secs Computing kpt #: 270 total cpu time spent up to now is 191.8 secs Computing kpt #: 271 total cpu time spent up to now is 192.4 secs Computing kpt #: 272 total cpu time spent up to now is 193.0 secs Computing kpt #: 273 total cpu time spent up to now is 193.6 secs Computing kpt #: 274 total cpu time spent up to now is 194.1 secs Computing kpt #: 275 total cpu time spent up to now is 194.7 secs Computing kpt #: 276 total cpu time spent up to now is 195.3 secs Computing kpt #: 277 total cpu time spent up to now is 195.9 secs Computing kpt #: 278 total cpu time spent up to now is 196.5 secs Computing kpt #: 279 total cpu time spent up to now is 197.0 secs Computing kpt #: 280 total cpu time spent up to now is 197.6 secs Computing kpt #: 281 total cpu time spent up to now is 198.2 secs Computing kpt #: 282 total cpu time spent up to now is 198.8 secs Computing kpt #: 283 total cpu time spent up to now is 199.3 secs Computing kpt #: 284 total cpu time spent up to now is 199.9 secs Computing kpt #: 285 total cpu time spent up to now is 200.5 secs Computing kpt #: 286 total cpu time spent up to now is 201.0 secs Computing kpt #: 287 total cpu time spent up to now is 201.6 secs Computing kpt #: 288 total cpu time spent up to now is 202.1 secs Computing kpt #: 289 total cpu time spent up to now is 202.7 secs Computing kpt #: 290 total cpu time spent up to now is 203.3 secs Computing kpt #: 291 total cpu time spent up to now is 203.8 secs Computing kpt #: 292 total cpu time spent up to now is 204.4 secs Computing kpt #: 293 total cpu time spent up to now is 204.9 secs Computing kpt #: 294 total cpu time spent up to now is 205.5 secs Computing kpt #: 295 total cpu time spent up to now is 206.1 secs Computing kpt #: 296 total cpu time spent up to now is 206.6 secs Computing kpt #: 297 total cpu time spent up to now is 207.2 secs Computing kpt #: 298 total cpu time spent up to now is 207.8 secs Computing kpt #: 299 total cpu time spent up to now is 208.4 secs Computing kpt #: 300 total cpu time spent up to now is 208.9 secs Computing kpt #: 301 total cpu time spent up to now is 209.5 secs Computing kpt #: 302 total cpu time spent up to now is 210.2 secs Computing kpt #: 303 total cpu time spent up to now is 210.8 secs Computing kpt #: 304 total cpu time spent up to now is 211.3 secs Computing kpt #: 305 total cpu time spent up to now is 211.9 secs Computing kpt #: 306 total cpu time spent up to now is 212.5 secs Computing kpt #: 307 total cpu time spent up to now is 213.1 secs Computing kpt #: 308 total cpu time spent up to now is 213.7 secs Computing kpt #: 309 total cpu time spent up to now is 214.3 secs Computing kpt #: 310 total cpu time spent up to now is 214.9 secs Computing kpt #: 311 total cpu time spent up to now is 215.5 secs Computing kpt #: 312 total cpu time spent up to now is 216.1 secs Computing kpt #: 313 total cpu time spent up to now is 216.8 secs Computing kpt #: 314 total cpu time spent up to now is 217.5 secs Computing kpt #: 315 total cpu time spent up to now is 218.3 secs Computing kpt #: 316 total cpu time spent up to now is 219.0 secs Computing kpt #: 317 total cpu time spent up to now is 219.8 secs Computing kpt #: 318 total cpu time spent up to now is 220.5 secs Computing kpt #: 319 total cpu time spent up to now is 221.3 secs Computing kpt #: 320 total cpu time spent up to now is 221.9 secs Computing kpt #: 321 total cpu time spent up to now is 222.6 secs Computing kpt #: 322 total cpu time spent up to now is 223.2 secs Computing kpt #: 323 total cpu time spent up to now is 223.8 secs Computing kpt #: 324 total cpu time spent up to now is 224.4 secs Computing kpt #: 325 total cpu time spent up to now is 225.0 secs Computing kpt #: 326 total cpu time spent up to now is 225.6 secs Computing kpt #: 327 total cpu time spent up to now is 226.2 secs Computing kpt #: 328 total cpu time spent up to now is 226.9 secs Computing kpt #: 329 total cpu time spent up to now is 227.5 secs Computing kpt #: 330 total cpu time spent up to now is 228.2 secs Computing kpt #: 331 total cpu time spent up to now is 229.0 secs Computing kpt #: 332 total cpu time spent up to now is 229.6 secs Computing kpt #: 333 total cpu time spent up to now is 230.3 secs Computing kpt #: 334 total cpu time spent up to now is 230.9 secs Computing kpt #: 335 total cpu time spent up to now is 231.5 secs Computing kpt #: 336 total cpu time spent up to now is 232.1 secs Computing kpt #: 337 total cpu time spent up to now is 232.7 secs Computing kpt #: 338 total cpu time spent up to now is 233.3 secs Computing kpt #: 339 total cpu time spent up to now is 233.9 secs Computing kpt #: 340 total cpu time spent up to now is 234.5 secs Computing kpt #: 341 total cpu time spent up to now is 235.1 secs Computing kpt #: 342 total cpu time spent up to now is 235.6 secs Computing kpt #: 343 total cpu time spent up to now is 236.2 secs Computing kpt #: 344 total cpu time spent up to now is 236.8 secs Computing kpt #: 345 total cpu time spent up to now is 237.3 secs Computing kpt #: 346 total cpu time spent up to now is 237.9 secs Computing kpt #: 347 total cpu time spent up to now is 238.4 secs Computing kpt #: 348 total cpu time spent up to now is 239.0 secs Computing kpt #: 349 total cpu time spent up to now is 239.6 secs Computing kpt #: 350 total cpu time spent up to now is 240.1 secs Computing kpt #: 351 total cpu time spent up to now is 240.7 secs Computing kpt #: 352 total cpu time spent up to now is 241.3 secs Computing kpt #: 353 total cpu time spent up to now is 241.9 secs Computing kpt #: 354 total cpu time spent up to now is 242.5 secs Computing kpt #: 355 total cpu time spent up to now is 243.1 secs Computing kpt #: 356 total cpu time spent up to now is 243.7 secs Computing kpt #: 357 total cpu time spent up to now is 244.3 secs Computing kpt #: 358 total cpu time spent up to now is 245.0 secs Computing kpt #: 359 total cpu time spent up to now is 245.6 secs Computing kpt #: 360 total cpu time spent up to now is 246.4 secs Computing kpt #: 361 total cpu time spent up to now is 247.1 secs Computing kpt #: 362 total cpu time spent up to now is 247.7 secs Computing kpt #: 363 total cpu time spent up to now is 248.3 secs Computing kpt #: 364 total cpu time spent up to now is 248.9 secs Computing kpt #: 365 total cpu time spent up to now is 249.5 secs Computing kpt #: 366 total cpu time spent up to now is 250.0 secs Computing kpt #: 367 total cpu time spent up to now is 250.6 secs Computing kpt #: 368 total cpu time spent up to now is 251.2 secs Computing kpt #: 369 total cpu time spent up to now is 251.8 secs Computing kpt #: 370 total cpu time spent up to now is 252.4 secs Computing kpt #: 371 total cpu time spent up to now is 253.0 secs Computing kpt #: 372 total cpu time spent up to now is 253.8 secs Computing kpt #: 373 total cpu time spent up to now is 254.5 secs Computing kpt #: 374 total cpu time spent up to now is 255.3 secs Computing kpt #: 375 total cpu time spent up to now is 256.0 secs Computing kpt #: 376 total cpu time spent up to now is 256.8 secs Computing kpt #: 377 total cpu time spent up to now is 257.3 secs Computing kpt #: 378 total cpu time spent up to now is 257.9 secs Computing kpt #: 379 total cpu time spent up to now is 258.8 secs Computing kpt #: 380 total cpu time spent up to now is 259.8 secs Computing kpt #: 381 total cpu time spent up to now is 261.2 secs Computing kpt #: 382 total cpu time spent up to now is 261.9 secs Computing kpt #: 383 total cpu time spent up to now is 262.8 secs Computing kpt #: 384 total cpu time spent up to now is 263.5 secs Computing kpt #: 385 total cpu time spent up to now is 264.4 secs Computing kpt #: 386 total cpu time spent up to now is 267.2 secs Computing kpt #: 387 total cpu time spent up to now is 267.8 secs Computing kpt #: 388 total cpu time spent up to now is 268.8 secs Computing kpt #: 389 total cpu time spent up to now is 269.7 secs Computing kpt #: 390 total cpu time spent up to now is 270.7 secs Computing kpt #: 391 total cpu time spent up to now is 271.7 secs Computing kpt #: 392 total cpu time spent up to now is 272.6 secs Computing kpt #: 393 total cpu time spent up to now is 273.5 secs Computing kpt #: 394 total cpu time spent up to now is 274.6 secs Computing kpt #: 395 total cpu time spent up to now is 275.7 secs Computing kpt #: 396 total cpu time spent up to now is 276.7 secs Computing kpt #: 397 total cpu time spent up to now is 277.7 secs Computing kpt #: 398 total cpu time spent up to now is 278.6 secs Computing kpt #: 399 total cpu time spent up to now is 279.6 secs Computing kpt #: 400 total cpu time spent up to now is 280.6 secs Computing kpt #: 401 total cpu time spent up to now is 281.6 secs Computing kpt #: 402 total cpu time spent up to now is 282.6 secs Computing kpt #: 403 total cpu time spent up to now is 283.6 secs Computing kpt #: 404 total cpu time spent up to now is 284.2 secs Computing kpt #: 405 total cpu time spent up to now is 284.8 secs Computing kpt #: 406 total cpu time spent up to now is 285.5 secs Computing kpt #: 407 total cpu time spent up to now is 286.2 secs Computing kpt #: 408 total cpu time spent up to now is 287.0 secs Computing kpt #: 409 total cpu time spent up to now is 287.7 secs Computing kpt #: 410 total cpu time spent up to now is 288.5 secs Computing kpt #: 411 total cpu time spent up to now is 289.4 secs Computing kpt #: 412 total cpu time spent up to now is 290.4 secs Computing kpt #: 413 total cpu time spent up to now is 291.5 secs Computing kpt #: 414 total cpu time spent up to now is 292.6 secs Computing kpt #: 415 total cpu time spent up to now is 293.3 secs Computing kpt #: 416 total cpu time spent up to now is 294.2 secs Computing kpt #: 417 total cpu time spent up to now is 295.1 secs Computing kpt #: 418 total cpu time spent up to now is 296.0 secs Computing kpt #: 419 total cpu time spent up to now is 296.8 secs Computing kpt #: 420 total cpu time spent up to now is 297.7 secs Computing kpt #: 421 total cpu time spent up to now is 298.6 secs Computing kpt #: 422 total cpu time spent up to now is 299.6 secs Computing kpt #: 423 total cpu time spent up to now is 300.5 secs Computing kpt #: 424 total cpu time spent up to now is 301.4 secs Computing kpt #: 425 total cpu time spent up to now is 302.3 secs Computing kpt #: 426 total cpu time spent up to now is 303.2 secs Computing kpt #: 427 total cpu time spent up to now is 304.2 secs Computing kpt #: 428 total cpu time spent up to now is 305.2 secs Computing kpt #: 429 total cpu time spent up to now is 306.1 secs Computing kpt #: 430 total cpu time spent up to now is 307.1 secs Computing kpt #: 431 total cpu time spent up to now is 308.1 secs Computing kpt #: 432 total cpu time spent up to now is 308.7 secs ethr = 1.92E-08, avg # of iterations = 24.6 total cpu time spent up to now is 308.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3747 PWs) bands (ev): -2.2827 -2.2827 0.0405 0.0405 1.3934 1.3934 1.4925 1.4925 5.4102 5.4102 5.5585 5.5585 7.8625 7.8625 7.9515 7.9515 8.3732 8.3732 9.1494 9.1494 9.3414 9.3414 9.4749 9.4749 9.8516 9.8516 10.1561 10.1561 10.5304 10.5304 10.8554 10.8554 11.0604 11.0604 11.2712 11.2712 11.3590 11.3590 11.4406 11.4406 11.5048 11.5048 11.7215 11.7215 11.7559 11.7559 11.9155 11.9155 12.0852 12.0852 12.1979 12.1979 12.3924 12.3924 12.9424 12.9424 13.7101 13.7101 14.0694 14.0694 15.2472 15.2472 k = 0.0104-0.0000-0.0000 ( 3753 PWs) bands (ev): -2.2813 -2.2813 0.0415 0.0415 1.3940 1.3940 1.4933 1.4933 5.4115 5.4115 5.5595 5.5595 7.8626 7.8626 7.9515 7.9515 8.3740 8.3740 9.1477 9.1477 9.3421 9.3421 9.4741 9.4741 9.8392 9.8392 10.1558 10.1558 10.5346 10.5346 10.8543 10.8543 11.0593 11.0593 11.2713 11.2713 11.3560 11.3560 11.4391 11.4391 11.4998 11.4998 11.7266 11.7266 11.7568 11.7568 11.9184 11.9184 12.0851 12.0851 12.1970 12.1970 12.3924 12.3924 12.9428 12.9428 13.7130 13.7130 14.0692 14.0692 15.2436 15.2436 k = 0.0208-0.0000-0.0000 ( 3759 PWs) bands (ev): -2.2771 -2.2771 0.0445 0.0445 1.3958 1.3958 1.4955 1.4955 5.4154 5.4154 5.5624 5.5624 7.8626 7.8626 7.9515 7.9515 8.3764 8.3764 9.1424 9.1424 9.3442 9.3442 9.4718 9.4718 9.8035 9.8035 10.1549 10.1549 10.5461 10.5461 10.8510 10.8510 11.0563 11.0563 11.2718 11.2718 11.3471 11.3471 11.4346 11.4346 11.4872 11.4872 11.7394 11.7394 11.7604 11.7604 11.9266 11.9266 12.0847 12.0847 12.1944 12.1944 12.3923 12.3923 12.9440 12.9440 13.7218 13.7218 14.0685 14.0685 15.2319 15.2319 k = 0.0312-0.0000-0.0000 ( 3755 PWs) bands (ev): -2.2702 -2.2702 0.0495 0.0495 1.3987 1.3987 1.4993 1.4993 5.4220 5.4220 5.5674 5.5674 7.8623 7.8623 7.9519 7.9519 8.3803 8.3803 9.1337 9.1337 9.3477 9.3477 9.4678 9.4678 9.7473 9.7473 10.1534 10.1534 10.5624 10.5624 10.8454 10.8454 11.0517 11.0517 11.2727 11.2727 11.3324 11.3324 11.4258 11.4258 11.4725 11.4725 11.7503 11.7503 11.7730 11.7730 11.9398 11.9398 12.0842 12.0842 12.1900 12.1900 12.3921 12.3921 12.9461 12.9461 13.7358 13.7358 14.0672 14.0672 15.2099 15.2099 k = 0.0417-0.0000-0.0000 ( 3755 PWs) bands (ev): -2.2605 -2.2605 0.0565 0.0565 1.4027 1.4027 1.5046 1.5046 5.4311 5.4311 5.5743 5.5743 7.8613 7.8613 7.9532 7.9532 8.3856 8.3856 9.1217 9.1217 9.3524 9.3524 9.4623 9.4623 9.6742 9.6742 10.1512 10.1512 10.5803 10.5803 10.8373 10.8373 11.0455 11.0455 11.2738 11.2738 11.3121 11.3121 11.4110 11.4110 11.4607 11.4607 11.7547 11.7547 11.7956 11.7956 11.9576 11.9576 12.0835 12.0835 12.1841 12.1841 12.3918 12.3918 12.9490 12.9490 13.7546 13.7546 14.0654 14.0654 15.1750 15.1750 k = 0.0521-0.0000-0.0000 ( 3749 PWs) bands (ev): -2.2480 -2.2480 0.0655 0.0655 1.4080 1.4080 1.5113 1.5113 5.4428 5.4428 5.5831 5.5831 7.8589 7.8589 7.9559 7.9559 8.3921 8.3921 9.1065 9.1065 9.3581 9.3581 9.4552 9.4552 9.5878 9.5878 10.1483 10.1483 10.5973 10.5973 10.8262 10.8262 11.0382 11.0382 11.2748 11.2748 11.2867 11.2867 11.3917 11.3917 11.4530 11.4530 11.7572 11.7572 11.8216 11.8216 11.9795 11.9795 12.0828 12.0828 12.1769 12.1769 12.3915 12.3915 12.9527 12.9527 13.7774 13.7774 14.0629 14.0629 15.1260 15.1260 k = 0.0625-0.0000-0.0000 ( 3749 PWs) bands (ev): -2.2327 -2.2327 0.0765 0.0765 1.4143 1.4143 1.5194 1.5194 5.4571 5.4571 5.5938 5.5938 7.8548 7.8548 7.9605 7.9605 8.3998 8.3998 9.0882 9.0882 9.3639 9.3639 9.4452 9.4452 9.4926 9.4926 10.1445 10.1445 10.6116 10.6116 10.8119 10.8119 11.0301 11.0301 11.2563 11.2563 11.2755 11.2755 11.3720 11.3720 11.4477 11.4477 11.7592 11.7592 11.8483 11.8483 12.0045 12.0045 12.0819 12.0819 12.1687 12.1687 12.3912 12.3912 12.9571 12.9571 13.8031 13.8031 14.0597 14.0597 15.0639 15.0639 k = 0.0729-0.0000-0.0000 ( 3741 PWs) bands (ev): -2.2147 -2.2147 0.0895 0.0895 1.4217 1.4217 1.5289 1.5289 5.4738 5.4738 5.6064 5.6064 7.8486 7.8486 7.9673 7.9673 8.4082 8.4082 9.0671 9.0671 9.3555 9.3555 9.3966 9.3966 9.4408 9.4408 10.1398 10.1398 10.6219 10.6219 10.7941 10.7941 11.0217 11.0217 11.2217 11.2217 11.2748 11.2748 11.3549 11.3549 11.4434 11.4434 11.7609 11.7609 11.8746 11.8746 12.0322 12.0322 12.0811 12.0811 12.1596 12.1596 12.3907 12.3907 12.9622 12.9622 13.8310 13.8310 14.0558 14.0558 14.9913 14.9913 k = 0.0833-0.0000-0.0000 ( 3745 PWs) bands (ev): -2.1939 -2.1939 0.1044 0.1044 1.4302 1.4302 1.5396 1.5396 5.4930 5.4930 5.6208 5.6208 7.8405 7.8405 7.9765 7.9765 8.4170 8.4170 9.0437 9.0437 9.2587 9.2587 9.3887 9.3887 9.4287 9.4287 10.1341 10.1341 10.6274 10.6274 10.7725 10.7725 11.0131 11.0131 11.1832 11.1832 11.2722 11.2722 11.3427 11.3427 11.4395 11.4395 11.7624 11.7624 11.8996 11.8996 12.0611 12.0611 12.0810 12.0810 12.1501 12.1501 12.3903 12.3903 12.9679 12.9679 13.8599 13.8599 14.0511 14.0511 14.9111 14.9111 k = 0.0938-0.0000-0.0000 ( 3745 PWs) bands (ev): -2.1704 -2.1704 0.1213 0.1213 1.4397 1.4397 1.5514 1.5514 5.5146 5.5146 5.6369 5.6369 7.8304 7.8304 7.9878 7.9878 8.4255 8.4255 9.0183 9.0183 9.1394 9.1394 9.3962 9.3962 9.4176 9.4176 10.1271 10.1271 10.6277 10.6277 10.7473 10.7473 11.0044 11.0044 11.1413 11.1413 11.2676 11.2676 11.3363 11.3363 11.4355 11.4355 11.7638 11.7638 11.9229 11.9229 12.0768 12.0768 12.0952 12.0952 12.1410 12.1410 12.3897 12.3897 12.9743 12.9743 13.8890 13.8890 14.0455 14.0455 14.8263 14.8263 k = 0.1042-0.0000-0.0000 ( 3753 PWs) bands (ev): -2.1442 -2.1442 0.1401 0.1401 1.4503 1.4503 1.5643 1.5643 5.5386 5.5386 5.6548 5.6548 7.8187 7.8187 8.0012 8.0012 8.4331 8.4331 8.9918 8.9918 9.0140 9.0140 9.3977 9.3977 9.4133 9.4133 10.1184 10.1184 10.6225 10.6225 10.7184 10.7184 10.9955 10.9955 11.0966 11.0966 11.2620 11.2620 11.3349 11.3349 11.4314 11.4314 11.7652 11.7652 11.9437 11.9437 12.0769 12.0769 12.1196 12.1196 12.1389 12.1389 12.3891 12.3891 12.9811 12.9811 13.9171 13.9171 14.0394 14.0394 14.7392 14.7392 k = 0.1146-0.0000-0.0000 ( 3749 PWs) bands (ev): -2.1152 -2.1152 0.1608 0.1608 1.4617 1.4617 1.5782 1.5782 5.5648 5.5648 5.6742 5.6742 7.8057 7.8057 8.0162 8.0162 8.4386 8.4386 8.8849 8.8849 8.9652 8.9652 9.3861 9.3861 9.4222 9.4222 10.1078 10.1078 10.6121 10.6121 10.6862 10.6862 10.9857 10.9857 11.0506 11.0506 11.2570 11.2570 11.3373 11.3373 11.4271 11.4271 11.7665 11.7665 11.9613 11.9613 12.0762 12.0762 12.1185 12.1185 12.1657 12.1657 12.3885 12.3885 12.9884 12.9884 13.9423 13.9423 14.0339 14.0339 14.6517 14.6517 k = 0.1250-0.0000-0.0000 ( 3751 PWs) bands (ev): -2.0835 -2.0835 0.1833 0.1833 1.4741 1.4741 1.5929 1.5929 5.5931 5.5931 5.6952 5.6952 7.7915 7.7915 8.0328 8.0328 8.4406 8.4406 8.7532 8.7532 8.9398 8.9398 9.3715 9.3715 9.4337 9.4337 10.0947 10.0947 10.5968 10.5968 10.6511 10.6511 10.9709 10.9709 11.0075 11.0075 11.2537 11.2537 11.3421 11.3421 11.4224 11.4224 11.7678 11.7678 11.9748 11.9748 12.0749 12.0749 12.1135 12.1135 12.1994 12.1994 12.3879 12.3879 12.9962 12.9962 13.9608 13.9608 14.0319 14.0319 14.5649 14.5649 k = 0.1354-0.0000-0.0000 ( 3749 PWs) bands (ev): -2.0491 -2.0491 0.2077 0.2077 1.4874 1.4874 1.6083 1.6083 5.6236 5.6236 5.7176 5.7176 7.7765 7.7765 8.0505 8.0505 8.4374 8.4374 8.6204 8.6204 8.9174 8.9174 9.3558 9.3558 9.4460 9.4460 10.0785 10.0785 10.5768 10.5768 10.6134 10.6134 10.9368 10.9368 10.9823 10.9823 11.2524 11.2524 11.3486 11.3486 11.4173 11.4173 11.7692 11.7692 11.9833 11.9833 12.0723 12.0723 12.1121 12.1121 12.2340 12.2340 12.3874 12.3874 13.0042 13.0042 13.9663 13.9663 14.0392 14.0392 14.4795 14.4795 k = 0.1458-0.0000-0.0000 ( 3749 PWs) bands (ev): -2.0121 -2.0121 0.2339 0.2339 1.5014 1.5014 1.6241 1.6241 5.6559 5.6559 5.7413 5.7413 7.7607 7.7607 8.0688 8.0688 8.4270 8.4270 8.4879 8.4879 8.8997 8.8997 9.3393 9.3393 9.4586 9.4586 10.0584 10.0584 10.5523 10.5523 10.5743 10.5743 10.8889 10.8889 10.9702 10.9702 11.2533 11.2533 11.3562 11.3562 11.4120 11.4120 11.7706 11.7706 11.9861 11.9861 12.0685 12.0685 12.1154 12.1154 12.2687 12.2687 12.3869 12.3869 13.0126 13.0126 13.9583 13.9583 14.0553 14.0553 14.3963 14.3963 k = 0.1562-0.0000-0.0000 ( 3745 PWs) bands (ev): -1.9724 -1.9724 0.2619 0.2619 1.5162 1.5162 1.6402 1.6402 5.6901 5.6901 5.7660 5.7660 7.7445 7.7445 8.0865 8.0865 8.3567 8.3567 8.4086 8.4086 8.8886 8.8886 9.3223 9.3223 9.4713 9.4713 10.0335 10.0335 10.5222 10.5222 10.5361 10.5361 10.8387 10.8387 10.9604 10.9604 11.2561 11.2561 11.3647 11.3647 11.4066 11.4066 11.7720 11.7720 11.9835 11.9835 12.0645 12.0645 12.1223 12.1223 12.3028 12.3028 12.3865 12.3865 13.0212 13.0212 13.9420 13.9420 14.0745 14.0745 14.3161 14.3161 k = 0.1667-0.0000-0.0000 ( 3753 PWs) bands (ev): -1.9300 -1.9300 0.2916 0.2916 1.5317 1.5317 1.6565 1.6565 5.7260 5.7260 5.7917 5.7917 7.7279 7.7279 8.0976 8.0976 8.2352 8.2352 8.3796 8.3796 8.8848 8.8848 9.3048 9.3048 9.4840 9.4840 10.0026 10.0026 10.4839 10.4839 10.5020 10.5020 10.7894 10.7894 10.9508 10.9508 11.2605 11.2605 11.3728 11.3728 11.4019 11.4019 11.7734 11.7734 11.9764 11.9764 12.0609 12.0609 12.1313 12.1313 12.3354 12.3354 12.3867 12.3867 13.0299 13.0299 13.9202 13.9202 14.0925 14.0925 14.2409 14.2409 k = 0.1771-0.0000-0.0000 ( 3745 PWs) bands (ev): -1.8850 -1.8850 0.3230 0.3230 1.5477 1.5477 1.6726 1.6726 5.7633 5.7633 5.8181 5.8181 7.7110 7.7110 8.0582 8.0582 8.1675 8.1675 8.3411 8.3411 8.8885 8.8885 9.2870 9.2870 9.4965 9.4965 9.9648 9.9648 10.4414 10.4414 10.4694 10.4694 10.7427 10.7427 10.9410 10.9410 11.2663 11.2663 11.3776 11.3776 11.4010 11.4010 11.7748 11.7748 11.9661 11.9661 12.0576 12.0576 12.1411 12.1411 12.3643 12.3643 12.3896 12.3896 13.0387 13.0387 13.8942 13.8942 14.1023 14.1023 14.1769 14.1769 k = 0.1875-0.0000-0.0000 ( 3741 PWs) bands (ev): -1.8375 -1.8375 0.3561 0.3561 1.5643 1.5643 1.6882 1.6882 5.8018 5.8018 5.8450 5.8450 7.6936 7.6936 7.9500 7.9500 8.1729 8.1729 8.2938 8.2938 8.8989 8.8989 9.2690 9.2690 9.5087 9.5087 9.9191 9.9191 10.3977 10.3977 10.4357 10.4357 10.6996 10.6996 10.9308 10.9308 11.2731 11.2731 11.3753 11.3753 11.4075 11.4075 11.7761 11.7761 11.9537 11.9537 12.0545 12.0545 12.1510 12.1510 12.3781 12.3781 12.4058 12.4058 13.0474 13.0474 13.8649 13.8649 14.0766 14.0766 14.1502 14.1502 k = 0.1979-0.0000-0.0000 ( 3741 PWs) bands (ev): -1.7873 -1.7873 0.3907 0.3907 1.5812 1.5812 1.7032 1.7032 5.8412 5.8412 5.8720 5.8720 7.6741 7.6741 7.8356 7.8356 8.1915 8.1915 8.2388 8.2388 8.9148 8.9148 9.2510 9.2510 9.5204 9.5204 9.8649 9.8649 10.3537 10.3537 10.4011 10.4011 10.6613 10.6613 10.9200 10.9200 11.2806 11.2806 11.3686 11.3686 11.4187 11.4187 11.7775 11.7775 11.9399 11.9399 12.0515 12.0515 12.1603 12.1603 12.3802 12.3802 12.4316 12.4316 13.0561 13.0561 13.8327 13.8327 14.0232 14.0232 14.1490 14.1490 k = 0.2083-0.0000-0.0000 ( 3747 PWs) bands (ev): -1.7346 -1.7346 0.4269 0.4269 1.5985 1.5985 1.7171 1.7171 5.8810 5.8810 5.8991 5.8991 7.6440 7.6440 7.7354 7.7354 8.1766 8.1766 8.2132 8.2132 8.9350 8.9350 9.2328 9.2328 9.5316 9.5316 9.8021 9.8021 10.3098 10.3098 10.3657 10.3657 10.6283 10.6283 10.9086 10.9086 11.2885 11.2885 11.3602 11.3602 11.4319 11.4319 11.7788 11.7788 11.9252 11.9252 12.0481 12.0481 12.1687 12.1687 12.3805 12.3805 12.4566 12.4566 13.0647 13.0647 13.7983 13.7983 13.9706 13.9706 14.1337 14.1337 k = 0.2188-0.0000-0.0000 ( 3747 PWs) bands (ev): -1.6794 -1.6794 0.4646 0.4646 1.6160 1.6160 1.7297 1.7297 5.9181 5.9181 5.9284 5.9284 7.5748 7.5748 7.6811 7.6811 8.1101 8.1101 8.2344 8.2344 8.9584 8.9584 9.2144 9.2144 9.5422 9.5422 9.7313 9.7313 10.2664 10.2664 10.3298 10.3298 10.6007 10.6007 10.8966 10.8966 11.2966 11.2966 11.3509 11.3509 11.4463 11.4463 11.7801 11.7801 11.9100 11.9100 12.0445 12.0445 12.1761 12.1761 12.3804 12.3804 12.4789 12.4789 13.0731 13.0731 13.7624 13.7624 13.9239 13.9239 14.1007 14.1007 k = 0.2292-0.0000-0.0000 ( 3747 PWs) bands (ev): -1.6217 -1.6217 0.5037 0.5037 1.6337 1.6337 1.7405 1.7405 5.9456 5.9456 5.9661 5.9661 7.4810 7.4810 7.6600 7.6600 8.0392 8.0392 8.2553 8.2553 8.9841 8.9841 9.1956 9.1956 9.5520 9.5520 9.6535 9.6535 10.2237 10.2237 10.2936 10.2936 10.5785 10.5785 10.8841 10.8841 11.3043 11.3043 11.3411 11.3411 11.4618 11.4618 11.7812 11.7812 11.8946 11.8946 12.0406 12.0406 12.1824 12.1824 12.3804 12.3804 12.4977 12.4977 13.0812 13.0812 13.7255 13.7255 13.8844 13.8844 14.0612 14.0612 k = 0.2396-0.0000-0.0000 ( 3751 PWs) bands (ev): -1.5616 -1.5616 0.5441 0.5441 1.6512 1.6512 1.7493 1.7493 5.9682 5.9682 6.0063 6.0063 7.3888 7.3888 7.6477 7.6477 7.9649 7.9649 8.2753 8.2753 9.0112 9.0112 9.1755 9.1755 9.5603 9.5603 9.5713 9.5713 10.1819 10.1819 10.2572 10.2572 10.5611 10.5611 10.8712 10.8712 11.3106 11.3106 11.3319 11.3319 11.4781 11.4781 11.7822 11.7822 11.8794 11.8794 12.0361 12.0361 12.1874 12.1874 12.3803 12.3803 12.5126 12.5126 13.0891 13.0891 13.6878 13.6878 13.8526 13.8526 14.0194 14.0194 k = 0.2500-0.0000-0.0000 ( 3755 PWs) bands (ev): -1.4990 -1.4990 0.5859 0.5859 1.6687 1.6687 1.7554 1.7554 5.9875 5.9875 6.0463 6.0463 7.3047 7.3047 7.6396 7.6396 7.8882 7.8882 8.2937 8.2937 9.0389 9.0389 9.1523 9.1523 9.4854 9.4854 9.5696 9.5696 10.1412 10.1412 10.2209 10.2209 10.5481 10.5481 10.8579 10.8579 11.3106 11.3106 11.3280 11.3280 11.4952 11.4952 11.7830 11.7830 11.8646 11.8646 12.0311 12.0311 12.1911 12.1911 12.3803 12.3803 12.5233 12.5233 13.0967 13.0967 13.6494 13.6494 13.8287 13.8287 13.9761 13.9761 k = 0.2604-0.0000-0.0000 ( 3757 PWs) bands (ev): -1.4340 -1.4340 0.6288 0.6288 1.6859 1.6859 1.7587 1.7587 6.0032 6.0032 6.0854 6.0854 7.2310 7.2310 7.6348 7.6348 7.8099 7.8099 8.3101 8.3101 9.0664 9.0664 9.1224 9.1224 9.4040 9.4040 9.5769 9.5769 10.1019 10.1019 10.1849 10.1849 10.5389 10.5389 10.8444 10.8444 11.3017 11.3017 11.3316 11.3316 11.5130 11.5130 11.7833 11.7833 11.8505 11.8505 12.0256 12.0256 12.1937 12.1937 12.3804 12.3804 12.5297 12.5297 13.1041 13.1041 13.6100 13.6100 13.8126 13.8126 13.9320 13.9320 k = 0.2708-0.0000-0.0000 ( 3757 PWs) bands (ev): -1.3668 -1.3668 0.6728 0.6728 1.7026 1.7026 1.7585 1.7585 6.0145 6.0145 6.1230 6.1230 7.1693 7.1693 7.6320 7.6320 7.7322 7.7322 8.3239 8.3239 9.0740 9.0740 9.0975 9.0975 9.3343 9.3343 9.5834 9.5834 10.0640 10.0640 10.1492 10.1492 10.5331 10.5331 10.8308 10.8308 11.2900 11.2900 11.3366 11.3366 11.5315 11.5315 11.7831 11.7831 11.8376 11.8376 12.0196 12.0196 12.1951 12.1951 12.3804 12.3804 12.5318 12.5318 13.1113 13.1113 13.5693 13.5693 13.8040 13.8040 13.8875 13.8875 k = 0.2812-0.0000-0.0000 ( 3753 PWs) bands (ev): -1.2972 -1.2972 0.7178 0.7178 1.7188 1.7188 1.7545 1.7545 6.0212 6.0212 6.1586 6.1586 7.1207 7.1207 7.6192 7.6192 7.6677 7.6677 8.3346 8.3346 9.0100 9.0100 9.1216 9.1216 9.2850 9.2850 9.5890 9.5890 10.0277 10.0277 10.1141 10.1141 10.5301 10.5301 10.8172 10.8172 11.2772 11.2772 11.3410 11.3410 11.5506 11.5506 11.7821 11.7821 11.8264 11.8264 12.0131 12.0131 12.1954 12.1954 12.3805 12.3805 12.5298 12.5298 13.1183 13.1183 13.5263 13.5263 13.8014 13.8014 13.8443 13.8443 k = 0.2917-0.0000-0.0000 ( 3758 PWs) bands (ev): -1.2254 -1.2254 0.7638 0.7638 1.7343 1.7343 1.7463 1.7463 6.0233 6.0233 6.1918 6.1918 7.0858 7.0858 7.5567 7.5567 7.6574 7.6574 8.3417 8.3417 8.9232 8.9232 9.1457 9.1457 9.2564 9.2564 9.5937 9.5937 9.9930 9.9930 10.0795 10.0795 10.5297 10.5297 10.8039 10.8039 11.2637 11.2637 11.3438 11.3438 11.5702 11.5702 11.7795 11.7795 11.8174 11.8174 12.0062 12.0062 12.1945 12.1945 12.3804 12.3804 12.5240 12.5240 13.1252 13.1252 13.4804 13.4804 13.7895 13.7895 13.8179 13.8179 k = 0.3021-0.0000-0.0000 ( 3766 PWs) bands (ev): -1.1514 -1.1514 0.8105 0.8105 1.7334 1.7334 1.7489 1.7489 6.0214 6.0214 6.2222 6.2222 7.0642 7.0642 7.4783 7.4783 7.6680 7.6680 8.3444 8.3444 8.8224 8.8224 9.1673 9.1673 9.2431 9.2431 9.5976 9.5976 9.9601 9.9601 10.0457 10.0457 10.5315 10.5315 10.7911 10.7911 11.2498 11.2498 11.3449 11.3449 11.5903 11.5903 11.7755 11.7755 11.8113 11.8113 11.9990 11.9990 12.1929 12.1929 12.3802 12.3802 12.5149 12.5149 13.1319 13.1319 13.4308 13.4308 13.7513 13.7513 13.8255 13.8255 k = 0.3125-0.0000-0.0000 ( 3764 PWs) bands (ev): -1.0754 -1.0754 0.8579 0.8579 1.7155 1.7155 1.7624 1.7624 6.0166 6.0166 6.2494 6.2494 7.0555 7.0555 7.3988 7.3988 7.6860 7.6860 8.3421 8.3421 8.7141 8.7141 9.1856 9.1856 9.2397 9.2397 9.6006 9.6006 9.9290 9.9290 10.0125 10.0125 10.5356 10.5356 10.7792 10.7792 11.2355 11.2355 11.3440 11.3440 11.6109 11.6109 11.7703 11.7703 11.8078 11.8078 11.9916 11.9916 12.1904 12.1904 12.3798 12.3798 12.5028 12.5028 13.1387 13.1387 13.3771 13.3771 13.7118 13.7118 13.8424 13.8424 k = 0.3229-0.0000-0.0000 ( 3758 PWs) bands (ev): -0.9972 -0.9972 0.9059 0.9059 1.6923 1.6923 1.7746 1.7746 6.0104 6.0104 6.2733 6.2733 7.0581 7.0581 7.3202 7.3202 7.7100 7.7100 8.3331 8.3331 8.6034 8.6034 9.2004 9.2004 9.2431 9.2431 9.6029 9.6029 9.8998 9.8998 9.9803 9.9803 10.5417 10.5417 10.7683 10.7683 11.2207 11.2207 11.3407 11.3407 11.6319 11.6319 11.7649 11.7649 11.8061 11.8061 11.9841 11.9841 12.1872 12.1872 12.3791 12.3791 12.4886 12.4886 13.1455 13.1455 13.3191 13.3191 13.6748 13.6748 13.8644 13.8644 k = 0.3333-0.0000-0.0000 ( 3758 PWs) bands (ev): -0.9171 -0.9171 0.9543 0.9543 1.6635 1.6635 1.7855 1.7855 6.0046 6.0046 6.2938 6.2938 7.0704 7.0704 7.2435 7.2435 7.7398 7.7398 8.3130 8.3130 8.4966 8.4966 9.2124 9.2124 9.2503 9.2503 9.6046 9.6046 9.8722 9.8722 9.9490 9.9490 10.5497 10.5497 10.7587 10.7587 11.2055 11.2055 11.3347 11.3347 11.6531 11.6531 11.7602 11.7602 11.8054 11.8054 11.9768 11.9768 12.1834 12.1834 12.3781 12.3781 12.4725 12.4725 13.1523 13.1523 13.2573 13.2573 13.6408 13.6408 13.8905 13.8905 k = 0.3438-0.0000-0.0000 ( 3752 PWs) bands (ev): -0.8351 -0.8351 1.0030 1.0030 1.6290 1.6290 1.7948 1.7948 6.0008 6.0008 6.3108 6.3108 7.0885 7.0885 7.1713 7.1713 7.7754 7.7754 8.2684 8.2684 8.4087 8.4087 9.2221 9.2221 9.2590 9.2590 9.6056 9.6056 9.8464 9.8464 9.9186 9.9186 10.5597 10.5597 10.7509 10.7509 11.1899 11.1899 11.3259 11.3259 11.6743 11.6743 11.7566 11.7566 11.8053 11.8053 11.9698 11.9698 12.1792 12.1792 12.3766 12.3766 12.4550 12.4550 13.1580 13.1580 13.1937 13.1937 13.6099 13.6099 13.9198 13.9198 k = 0.3542-0.0000-0.0000 ( 3748 PWs) bands (ev): -0.7512 -0.7512 1.0518 1.0518 1.5887 1.5887 1.8023 1.8023 6.0005 6.0005 6.3246 6.3246 7.0794 7.0794 7.1357 7.1357 7.8163 7.8163 8.1843 8.1843 8.3556 8.3556 9.2285 9.2285 9.2691 9.2691 9.6062 9.6062 9.8221 9.8221 9.8894 9.8894 10.5716 10.5716 10.7450 10.7450 11.1740 11.1740 11.3143 11.3143 11.6953 11.6953 11.7547 11.7547 11.8056 11.8056 11.9633 11.9633 12.1748 12.1748 12.3747 12.3747 12.4365 12.4365 13.1219 13.1219 13.1698 13.1698 13.5818 13.5818 13.9517 13.9517 k = 0.3646-0.0000-0.0000 ( 3744 PWs) bands (ev): -0.6656 -0.6656 1.1006 1.1006 1.5427 1.5427 1.8079 1.8079 6.0050 6.0050 6.3354 6.3354 7.0164 7.0164 7.1626 7.1626 7.8619 7.8619 8.0770 8.0770 8.3222 8.3222 9.2296 9.2296 9.2814 9.2814 9.6064 9.6064 9.7991 9.7991 9.8614 9.8614 10.5854 10.5854 10.7415 10.7415 11.1576 11.1576 11.3000 11.3000 11.7156 11.7156 11.7547 11.7547 11.8062 11.8062 11.9575 11.9575 12.1704 12.1704 12.3725 12.3725 12.4173 12.4173 13.0540 13.0540 13.1769 13.1769 13.5560 13.5560 13.9853 13.9853 k = 0.3750-0.0000-0.0000 ( 3750 PWs) bands (ev): -0.5784 -0.5784 1.1492 1.1492 1.4909 1.4909 1.8114 1.8114 6.0152 6.0152 6.3437 6.3437 6.9499 6.9499 7.2005 7.2005 7.9055 7.9055 7.9687 7.9687 8.2934 8.2934 9.2243 9.2243 9.2965 9.2965 9.6063 9.6063 9.7771 9.7771 9.8346 9.8346 10.6011 10.6011 10.7404 10.7404 11.1408 11.1408 11.2829 11.2829 11.7336 11.7336 11.7579 11.7579 11.8069 11.8069 11.9523 11.9523 12.1662 12.1662 12.3697 12.3697 12.3978 12.3978 12.9850 12.9850 13.1852 13.1852 13.5322 13.5322 14.0202 14.0202 k = 0.3854-0.0000-0.0000 ( 3746 PWs) bands (ev): -0.4897 -0.4897 1.1974 1.1974 1.4337 1.4337 1.8126 1.8126 6.0318 6.0318 6.3500 6.3500 6.8859 6.8859 7.2431 7.2431 7.8357 7.8357 7.9762 7.9762 8.2641 8.2641 9.2124 9.2124 9.3137 9.3137 9.6061 9.6061 9.7559 9.7559 9.8094 9.8094 10.6188 10.6188 10.7420 10.7420 11.1236 11.1236 11.2632 11.2632 11.7453 11.7453 11.7678 11.7678 11.8083 11.8083 11.9482 11.9482 12.1623 12.1623 12.3660 12.3660 12.3788 12.3788 12.9166 12.9166 13.1942 13.1942 13.5101 13.5101 14.0558 14.0558 k = 0.3958-0.0000-0.0000 ( 3746 PWs) bands (ev): -0.3996 -0.3996 1.2449 1.2449 1.3714 1.3714 1.8114 1.8114 6.0552 6.0552 6.3548 6.3548 6.8250 6.8250 7.2888 7.2888 7.7195 7.7195 8.0338 8.0338 8.2331 8.2331 9.1942 9.1942 9.3323 9.3323 9.6060 9.6060 9.7351 9.7351 9.7857 9.7857 10.6383 10.6383 10.7464 10.7464 11.1059 11.1059 11.2412 11.2412 11.7509 11.7509 11.7824 11.7824 11.8113 11.8113 11.9451 11.9451 12.1592 12.1592 12.3559 12.3559 12.3662 12.3662 12.8497 12.8497 13.2038 13.2038 13.4895 13.4895 14.0915 14.0915 k = 0.4062-0.0000-0.0000 ( 3760 PWs) bands (ev): -0.3082 -0.3082 1.2905 1.2905 1.3053 1.3053 1.8076 1.8076 6.0855 6.0855 6.3585 6.3585 6.7678 6.7678 7.3368 7.3368 7.6025 7.6025 8.0963 8.0963 8.1999 8.1999 9.1699 9.1699 9.3517 9.3517 9.6060 9.6060 9.7145 9.7145 9.7637 9.7637 10.6595 10.6595 10.7535 10.7535 11.0878 11.0878 11.2169 11.2169 11.7549 11.7549 11.7937 11.7937 11.8190 11.8190 11.9428 11.9428 12.1567 12.1567 12.3376 12.3376 12.3619 12.3619 12.7851 12.7851 13.2138 13.2138 13.4699 13.4699 14.1268 14.1268 k = 0.4167-0.0000-0.0000 ( 3764 PWs) bands (ev): -0.2157 -0.2157 1.2317 1.2317 1.3382 1.3382 1.8013 1.8013 6.1230 6.1230 6.3619 6.3619 6.7144 6.7144 7.3857 7.3857 7.4877 7.4877 8.1574 8.1574 8.1690 8.1690 9.1398 9.1398 9.3717 9.3717 9.6062 9.6062 9.6940 9.6940 9.7435 9.7435 10.6825 10.6825 10.7633 10.7633 11.0692 11.0692 11.1908 11.1908 11.7587 11.7587 11.7983 11.7983 11.8333 11.8333 11.9416 11.9416 12.1553 12.1553 12.3186 12.3186 12.3587 12.3587 12.7234 12.7234 13.2244 13.2244 13.4514 13.4514 14.1612 14.1612 k = 0.4271-0.0000-0.0000 ( 3766 PWs) bands (ev): -0.1222 -0.1222 1.1557 1.1557 1.3829 1.3829 1.7921 1.7921 6.1674 6.1674 6.3653 6.3653 6.6651 6.6651 7.3684 7.3684 7.4422 7.4422 8.1257 8.1257 8.2311 8.2311 9.1040 9.1040 9.3918 9.3918 9.6069 9.6069 9.6735 9.6735 9.7248 9.7248 10.7071 10.7071 10.7756 10.7756 11.0503 11.0503 11.1630 11.1630 11.7626 11.7626 11.7996 11.7996 11.8500 11.8500 11.9412 11.9412 12.1551 12.1551 12.2999 12.2999 12.3563 12.3563 12.6656 12.6656 13.2355 13.2355 13.4338 13.4338 14.1943 14.1943 k = 0.4375-0.0000-0.0000 ( 3762 PWs) bands (ev): -0.0280 -0.0280 1.0759 1.0759 1.4264 1.4264 1.7801 1.7801 6.2186 6.2186 6.3695 6.3695 6.6200 6.6200 7.2583 7.2583 7.4926 7.4926 8.0857 8.0857 8.3008 8.3008 9.0629 9.0629 9.4121 9.4121 9.6080 9.6080 9.6532 9.6532 9.7078 9.7078 10.7330 10.7330 10.7903 10.7903 11.0309 11.0309 11.1338 11.1338 11.7666 11.7666 11.7996 11.7996 11.8668 11.8668 11.9414 11.9414 12.1563 12.1563 12.2821 12.2821 12.3548 12.3548 12.6122 12.6122 13.2471 13.2471 13.4168 13.4168 14.2254 14.2255 k = 0.4479-0.0000-0.0000 ( 3770 PWs) bands (ev): 0.0669 0.0669 0.9928 0.9928 1.4683 1.4683 1.7653 1.7653 6.2764 6.2764 6.3748 6.3748 6.5790 6.5790 7.1494 7.1494 7.5451 7.5451 8.0436 8.0436 8.3718 8.3718 9.0166 9.0166 9.4322 9.4322 9.6092 9.6092 9.6335 9.6335 9.6923 9.6923 10.7599 10.7599 10.8070 10.8070 11.0112 11.0112 11.1036 11.1036 11.7706 11.7706 11.7987 11.7987 11.8825 11.8825 11.9419 11.9419 12.1589 12.1589 12.2649 12.2649 12.3548 12.3548 12.5632 12.5632 13.2590 13.2590 13.4002 13.4002 14.2543 14.2543 k = 0.4583-0.0000-0.0000 ( 3764 PWs) bands (ev): 0.1622 0.1622 0.9068 0.9068 1.5085 1.5085 1.7476 1.7476 6.3404 6.3404 6.3818 6.3818 6.5423 6.5423 7.0431 7.0431 7.5981 7.5981 7.9995 7.9995 8.4433 8.4433 8.9656 8.9656 9.4523 9.4523 9.6064 9.6064 9.6189 9.6189 9.6783 9.6783 10.7872 10.7872 10.8256 10.8256 10.9915 10.9915 11.0726 11.0726 11.7745 11.7745 11.7975 11.7975 11.8969 11.8969 11.9426 11.9426 12.1631 12.1631 12.2487 12.2487 12.3569 12.3569 12.5194 12.5194 13.2716 13.2716 13.3844 13.3844 14.2803 14.2803 k = 0.4688-0.0000-0.0000 ( 3764 PWs) bands (ev): 0.2576 0.2576 0.8184 0.8184 1.5468 1.5468 1.7269 1.7269 6.3908 6.3908 6.4101 6.4101 6.5101 6.5101 6.9402 6.9402 7.6511 7.6511 7.9536 7.9536 8.5148 8.5148 8.9103 8.9103 9.4722 9.4722 9.5899 9.5899 9.6190 9.6190 9.6657 9.6657 10.8141 10.8141 10.8458 10.8458 10.9723 10.9723 11.0412 11.0412 11.7783 11.7783 11.7958 11.7958 11.9095 11.9095 11.9426 11.9426 12.1687 12.1687 12.2335 12.2335 12.3616 12.3616 12.4809 12.4809 13.2843 13.2843 13.3690 13.3690 14.3033 14.3033 k = 0.4792-0.0000-0.0000 ( 3760 PWs) bands (ev): 0.3530 0.3530 0.7279 0.7279 1.5830 1.5830 1.7035 1.7035 6.4023 6.4023 6.4732 6.4732 6.4942 6.4942 6.8410 6.8410 7.7037 7.7037 7.9062 7.9062 8.5856 8.5856 8.8511 8.8511 9.4920 9.4920 9.5706 9.5706 9.6233 9.6233 9.6545 9.6545 10.8393 10.8393 10.8660 10.8660 10.9555 10.9555 11.0103 11.0103 11.7819 11.7819 11.7937 11.7937 11.9202 11.9202 11.9417 11.9417 12.1759 12.1759 12.2195 12.2195 12.3696 12.3696 12.4480 12.4480 13.2976 13.2976 13.3540 13.3540 14.3230 14.3230 k = 0.4896-0.0000-0.0000 ( 3758 PWs) bands (ev): 0.4480 0.4480 0.6358 0.6358 1.6169 1.6169 1.6773 1.6773 6.4166 6.4166 6.4547 6.4547 6.5691 6.5691 6.7458 6.7458 7.7558 7.7558 7.8572 7.8572 8.6552 8.6552 8.7885 8.7885 9.5117 9.5117 9.5510 9.5510 9.6291 9.6291 9.6447 9.6447 10.8615 10.8615 10.8804 10.8804 10.9470 10.9470 10.9811 10.9811 11.7854 11.7854 11.7913 11.7913 11.9287 11.9287 11.9393 11.9393 12.1847 12.1847 12.2065 12.2065 12.3818 12.3818 12.4205 12.4205 13.3111 13.3111 13.3394 13.3394 14.3394 14.3395 k = 0.5000-0.0000-0.0000 ( 3770 PWs) bands (ev): 0.5423 0.5423 0.5423 0.5423 1.6484 1.6484 1.6484 1.6484 6.4341 6.4341 6.4341 6.4341 6.6550 6.6550 6.6550 6.6550 7.8070 7.8070 7.8070 7.8070 8.7230 8.7230 8.7230 8.7230 9.5314 9.5314 9.5314 9.5314 9.6362 9.6362 9.6362 9.6362 10.8777 10.8777 10.8777 10.8777 10.9569 10.9569 10.9569 10.9569 11.7884 11.7884 11.7884 11.7884 11.9350 11.9350 11.9350 11.9350 12.1948 12.1948 12.1948 12.1948 12.3985 12.3985 12.3985 12.3985 13.3250 13.3250 13.3250 13.3250 14.3524 14.3524 k = 0.5000-0.0000-0.0000 ( 3770 PWs) bands (ev): 0.5423 0.5423 0.5423 0.5423 1.6484 1.6484 1.6484 1.6484 6.4341 6.4341 6.4341 6.4341 6.6550 6.6550 6.6550 6.6550 7.8070 7.8070 7.8070 7.8070 8.7230 8.7230 8.7230 8.7230 9.5314 9.5314 9.5314 9.5314 9.6362 9.6362 9.6362 9.6362 10.8777 10.8777 10.8777 10.8777 10.9569 10.9569 10.9569 10.9569 11.7884 11.7884 11.7884 11.7884 11.9350 11.9350 11.9350 11.9350 12.1948 12.1948 12.1948 12.1948 12.3985 12.3985 12.3985 12.3985 13.3250 13.3250 13.3250 13.3250 14.3524 14.3524 k = 0.5000 0.0101-0.0000 ( 3760 PWs) bands (ev): 0.5431 0.5431 0.5431 0.5431 1.6477 1.6477 1.6477 1.6477 6.4331 6.4331 6.4331 6.4331 6.6546 6.6546 6.6546 6.6546 7.8072 7.8072 7.8072 7.8072 8.7239 8.7239 8.7239 8.7239 9.5310 9.5310 9.5310 9.5310 9.6361 9.6361 9.6361 9.6361 10.8771 10.8771 10.8771 10.8771 10.9567 10.9567 10.9567 10.9567 11.7893 11.7893 11.7893 11.7893 11.9365 11.9365 11.9365 11.9365 12.1950 12.1950 12.1950 12.1950 12.3983 12.3983 12.3983 12.3983 13.3254 13.3254 13.3254 13.3254 14.3489 14.3489 k = 0.5000 0.0203-0.0000 ( 3772 PWs) bands (ev): 0.5453 0.5453 0.5453 0.5453 1.6455 1.6455 1.6455 1.6455 6.4299 6.4299 6.4299 6.4299 6.6535 6.6535 6.6535 6.6535 7.8075 7.8075 7.8075 7.8075 8.7263 8.7263 8.7263 8.7263 9.5298 9.5298 9.5298 9.5298 9.6356 9.6356 9.6356 9.6356 10.8748 10.8748 10.8748 10.8748 10.9560 10.9560 10.9560 10.9560 11.7914 11.7914 11.7914 11.7914 11.9408 11.9408 11.9408 11.9408 12.1954 12.1954 12.1954 12.1954 12.3976 12.3976 12.3976 12.3976 13.3266 13.3266 13.3266 13.3266 14.3384 14.3384 k = 0.5000 0.0304-0.0000 ( 3776 PWs) bands (ev): 0.5490 0.5490 0.5490 0.5490 1.6419 1.6419 1.6419 1.6419 6.4249 6.4249 6.4249 6.4249 6.6516 6.6516 6.6516 6.6516 7.8081 7.8081 7.8081 7.8081 8.7303 8.7303 8.7303 8.7303 9.5279 9.5279 9.5279 9.5279 9.6348 9.6348 9.6348 9.6348 10.8709 10.8709 10.8709 10.8709 10.9553 10.9553 10.9553 10.9553 11.7953 11.7953 11.7953 11.7953 11.9478 11.9478 11.9478 11.9478 12.1962 12.1962 12.1962 12.1962 12.3965 12.3965 12.3965 12.3965 13.3284 13.3284 13.3284 13.3284 14.3218 14.3218 k = 0.5000 0.0406-0.0000 ( 3772 PWs) bands (ev): 0.5541 0.5541 0.5541 0.5541 1.6369 1.6369 1.6369 1.6369 6.4180 6.4180 6.4180 6.4180 6.6489 6.6489 6.6489 6.6489 7.8092 7.8092 7.8092 7.8092 8.7355 8.7355 8.7355 8.7355 9.5254 9.5254 9.5254 9.5254 9.6336 9.6336 9.6336 9.6336 10.8650 10.8650 10.8650 10.8650 10.9550 10.9550 10.9550 10.9550 11.8006 11.8006 11.8006 11.8006 11.9573 11.9573 11.9573 11.9573 12.1974 12.1974 12.1974 12.1974 12.3950 12.3950 12.3950 12.3950 13.3311 13.3311 13.3311 13.3311 14.3003 14.3003 k = 0.5000 0.0507-0.0000 ( 3776 PWs) bands (ev): 0.5608 0.5608 0.5608 0.5608 1.6305 1.6305 1.6305 1.6305 6.4094 6.4094 6.4094 6.4094 6.6454 6.6454 6.6454 6.6454 7.8107 7.8107 7.8107 7.8107 8.7417 8.7417 8.7417 8.7417 9.5223 9.5223 9.5223 9.5223 9.6321 9.6321 9.6321 9.6321 10.8571 10.8571 10.8571 10.8571 10.9553 10.9553 10.9553 10.9553 11.8074 11.8074 11.8074 11.8074 11.9691 11.9691 11.9691 11.9691 12.1988 12.1988 12.1988 12.1988 12.3932 12.3932 12.3932 12.3932 13.3347 13.3347 13.3347 13.3347 14.2751 14.2751 k = 0.5000 0.0609-0.0000 ( 3776 PWs) bands (ev): 0.5688 0.5688 0.5688 0.5688 1.6227 1.6227 1.6227 1.6227 6.3995 6.3995 6.3995 6.3995 6.6409 6.6409 6.6409 6.6409 7.8129 7.8129 7.8129 7.8129 8.7485 8.7485 8.7485 8.7485 9.5187 9.5187 9.5187 9.5187 9.6301 9.6301 9.6301 9.6301 10.8473 10.8473 10.8473 10.8473 10.9563 10.9563 10.9563 10.9563 11.8157 11.8157 11.8157 11.8157 11.9828 11.9828 11.9828 11.9828 12.2006 12.2006 12.2006 12.2006 12.3909 12.3909 12.3909 12.3909 13.3391 13.3391 13.3391 13.3391 14.2471 14.2471 k = 0.5000 0.0710-0.0000 ( 3772 PWs) bands (ev): 0.5783 0.5783 0.5783 0.5783 1.6134 1.6134 1.6134 1.6134 6.3883 6.3883 6.3883 6.3883 6.6355 6.6355 6.6355 6.6355 7.8160 7.8160 7.8160 7.8160 8.7555 8.7555 8.7555 8.7555 9.5148 9.5148 9.5148 9.5148 9.6278 9.6278 9.6278 9.6278 10.8360 10.8360 10.8360 10.8360 10.9578 10.9578 10.9578 10.9578 11.8255 11.8255 11.8255 11.8255 11.9981 11.9981 11.9981 11.9981 12.2027 12.2027 12.2027 12.2027 12.3885 12.3885 12.3885 12.3885 13.3446 13.3446 13.3446 13.3446 14.2174 14.2174 k = 0.5000 0.0812-0.0000 ( 3768 PWs) bands (ev): 0.5891 0.5891 0.5891 0.5891 1.6028 1.6028 1.6028 1.6028 6.3762 6.3762 6.3762 6.3762 6.6290 6.6290 6.6290 6.6290 7.8201 7.8201 7.8201 7.8201 8.7623 8.7623 8.7623 8.7623 9.5105 9.5105 9.5105 9.5105 9.6250 9.6250 9.6250 9.6250 10.8236 10.8236 10.8236 10.8236 10.9598 10.9598 10.9598 10.9598 11.8369 11.8369 11.8369 11.8369 12.0146 12.0146 12.0146 12.0146 12.2051 12.2051 12.2051 12.2051 12.3857 12.3857 12.3857 12.3857 13.3509 13.3509 13.3509 13.3509 14.1865 14.1865 k = 0.5000 0.0913-0.0000 ( 3764 PWs) bands (ev): 0.6014 0.6014 0.6014 0.6014 1.5908 1.5908 1.5908 1.5908 6.3635 6.3635 6.3635 6.3635 6.6214 6.6214 6.6214 6.6214 7.8254 7.8254 7.8254 7.8254 8.7685 8.7685 8.7685 8.7685 9.5062 9.5062 9.5062 9.5062 9.6217 9.6217 9.6217 9.6217 10.8108 10.8108 10.8108 10.8108 10.9618 10.9618 10.9618 10.9618 11.8497 11.8497 11.8497 11.8497 12.0320 12.0320 12.0320 12.0320 12.2079 12.2079 12.2079 12.2079 12.3827 12.3827 12.3827 12.3827 13.3582 13.3582 13.3582 13.3582 14.1551 14.1551 k = 0.5000 0.1015-0.0000 ( 3764 PWs) bands (ev): 0.6150 0.6150 0.6150 0.6150 1.5775 1.5775 1.5775 1.5775 6.3504 6.3504 6.3504 6.3504 6.6126 6.6126 6.6126 6.6126 7.8321 7.8321 7.8321 7.8321 8.7735 8.7735 8.7735 8.7735 9.5017 9.5017 9.5017 9.5017 9.6179 9.6179 9.6179 9.6179 10.7979 10.7979 10.7979 10.7979 10.9636 10.9636 10.9636 10.9636 11.8639 11.8639 11.8639 11.8639 12.0498 12.0498 12.0498 12.0498 12.2110 12.2110 12.2110 12.2110 12.3796 12.3796 12.3796 12.3796 13.3664 13.3664 13.3664 13.3664 14.1236 14.1236 k = 0.5000 0.1116-0.0000 ( 3758 PWs) bands (ev): 0.6299 0.6299 0.6299 0.6299 1.5628 1.5628 1.5628 1.5628 6.3372 6.3372 6.3372 6.3372 6.6027 6.6027 6.6027 6.6027 7.8403 7.8403 7.8403 7.8403 8.7769 8.7769 8.7769 8.7769 9.4973 9.4973 9.4973 9.4973 9.6136 9.6136 9.6136 9.6136 10.7856 10.7856 10.7856 10.7856 10.9649 10.9649 10.9649 10.9649 11.8795 11.8795 11.8795 11.8795 12.0678 12.0678 12.0678 12.0678 12.2145 12.2145 12.2145 12.2145 12.3764 12.3764 12.3764 12.3764 13.3756 13.3756 13.3756 13.3756 14.0922 14.0922 k = 0.5000 0.1218-0.0000 ( 3738 PWs) bands (ev): 0.6461 0.6461 0.6461 0.6461 1.5469 1.5469 1.5469 1.5469 6.3242 6.3242 6.3242 6.3242 6.5917 6.5917 6.5917 6.5917 7.8503 7.8503 7.8503 7.8503 8.7783 8.7783 8.7783 8.7783 9.4931 9.4931 9.4931 9.4931 9.6087 9.6087 9.6087 9.6087 10.7743 10.7743 10.7743 10.7743 10.9657 10.9657 10.9657 10.9657 11.8964 11.8964 11.8964 11.8964 12.0856 12.0856 12.0856 12.0856 12.2184 12.2184 12.2184 12.2184 12.3733 12.3733 12.3733 12.3733 13.3856 13.3856 13.3856 13.3856 14.0612 14.0612 k = 0.5000 0.1319-0.0000 ( 3738 PWs) bands (ev): 0.6635 0.6635 0.6635 0.6635 1.5297 1.5297 1.5297 1.5297 6.3116 6.3116 6.3116 6.3116 6.5794 6.5794 6.5794 6.5794 7.8622 7.8622 7.8622 7.8622 8.7773 8.7773 8.7773 8.7773 9.4891 9.4891 9.4891 9.4891 9.6034 9.6034 9.6034 9.6034 10.7642 10.7642 10.7642 10.7642 10.9656 10.9656 10.9656 10.9656 11.9142 11.9142 11.9142 11.9142 12.1028 12.1028 12.1028 12.1028 12.2226 12.2226 12.2226 12.2226 12.3702 12.3702 12.3702 12.3702 13.3964 13.3964 13.3964 13.3964 14.0307 14.0307 k = 0.5000 0.1421-0.0000 ( 3732 PWs) bands (ev): 0.6822 0.6822 0.6822 0.6822 1.5112 1.5112 1.5112 1.5112 6.2996 6.2996 6.2996 6.2996 6.5660 6.5660 6.5660 6.5660 7.8761 7.8761 7.8761 7.8761 8.7737 8.7737 8.7737 8.7737 9.4854 9.4854 9.4854 9.4854 9.5975 9.5975 9.5975 9.5975 10.7556 10.7556 10.7556 10.7556 10.9646 10.9646 10.9646 10.9646 11.9331 11.9331 11.9331 11.9331 12.1193 12.1193 12.1193 12.1193 12.2271 12.2271 12.2271 12.2271 12.3673 12.3673 12.3673 12.3673 13.4078 13.4078 13.4078 13.4078 14.0007 14.0007 k = 0.5000 0.1522-0.0000 ( 3728 PWs) bands (ev): 0.7019 0.7019 0.7019 0.7019 1.4916 1.4916 1.4916 1.4916 6.2885 6.2885 6.2885 6.2885 6.5515 6.5515 6.5515 6.5515 7.8920 7.8920 7.8920 7.8920 8.7672 8.7672 8.7672 8.7672 9.4821 9.4821 9.4821 9.4821 9.5912 9.5912 9.5912 9.5912 10.7488 10.7488 10.7488 10.7488 10.9625 10.9625 10.9625 10.9625 11.9527 11.9527 11.9527 11.9527 12.1349 12.1349 12.1349 12.1349 12.2321 12.2321 12.2321 12.2321 12.3646 12.3646 12.3646 12.3646 13.4197 13.4197 13.4197 13.4197 13.9714 13.9714 k = 0.5000 0.1624-0.0000 ( 3732 PWs) bands (ev): 0.7228 0.7228 0.7228 0.7228 1.4708 1.4708 1.4708 1.4708 6.2784 6.2784 6.2784 6.2784 6.5361 6.5361 6.5361 6.5361 7.9100 7.9100 7.9100 7.9100 8.7575 8.7575 8.7575 8.7575 9.4791 9.4791 9.4791 9.4791 9.5845 9.5845 9.5845 9.5845 10.7438 10.7438 10.7438 10.7438 10.9594 10.9594 10.9594 10.9594 11.9729 11.9729 11.9729 11.9729 12.1492 12.1492 12.1492 12.1492 12.2374 12.2374 12.2374 12.2374 12.3621 12.3621 12.3621 12.3621 13.4320 13.4320 13.4320 13.4320 13.9428 13.9428 k = 0.5000 0.1725-0.0000 ( 3732 PWs) bands (ev): 0.7448 0.7448 0.7448 0.7448 1.4489 1.4489 1.4489 1.4489 6.2696 6.2696 6.2696 6.2696 6.5198 6.5198 6.5198 6.5198 7.9302 7.9302 7.9302 7.9302 8.7447 8.7447 8.7447 8.7447 9.4767 9.4767 9.4767 9.4767 9.5775 9.5775 9.5775 9.5775 10.7408 10.7408 10.7408 10.7408 10.9553 10.9553 10.9553 10.9553 11.9932 11.9932 11.9932 11.9932 12.1622 12.1622 12.1622 12.1622 12.2431 12.2431 12.2431 12.2431 12.3601 12.3601 12.3601 12.3601 13.4447 13.4447 13.4447 13.4447 13.9150 13.9150 k = 0.5000 0.1827-0.0000 ( 3744 PWs) bands (ev): 0.7677 0.7677 0.7677 0.7677 1.4260 1.4260 1.4260 1.4260 6.2621 6.2621 6.2621 6.2621 6.5027 6.5027 6.5027 6.5027 7.9525 7.9525 7.9525 7.9525 8.7286 8.7286 8.7286 8.7286 9.4746 9.4746 9.4746 9.4746 9.5702 9.5702 9.5702 9.5702 10.7397 10.7397 10.7397 10.7397 10.9502 10.9502 10.9502 10.9502 12.0136 12.0136 12.0136 12.0136 12.1736 12.1736 12.1736 12.1736 12.2491 12.2491 12.2491 12.2491 12.3584 12.3584 12.3584 12.3584 13.4575 13.4575 13.4575 13.4575 13.8880 13.8880 k = 0.5000 0.1928-0.0000 ( 3746 PWs) bands (ev): 0.7916 0.7916 0.7916 0.7916 1.4021 1.4021 1.4021 1.4021 6.2561 6.2561 6.2561 6.2561 6.4850 6.4850 6.4850 6.4850 7.9769 7.9769 7.9769 7.9769 8.7094 8.7094 8.7094 8.7094 9.4731 9.4731 9.4731 9.4731 9.5627 9.5627 9.5627 9.5627 10.7406 10.7406 10.7406 10.7406 10.9441 10.9441 10.9441 10.9441 12.0338 12.0338 12.0338 12.0338 12.1835 12.1835 12.1835 12.1835 12.2555 12.2555 12.2555 12.2555 12.3571 12.3571 12.3571 12.3571 13.4705 13.4705 13.4705 13.4705 13.8617 13.8617 k = 0.5000 0.2030-0.0000 ( 3746 PWs) bands (ev): 0.8164 0.8164 0.8164 0.8164 1.3773 1.3773 1.3773 1.3773 6.2516 6.2516 6.2516 6.2516 6.4669 6.4669 6.4669 6.4669 8.0033 8.0033 8.0033 8.0033 8.6871 8.6871 8.6871 8.6871 9.4722 9.4722 9.4722 9.4722 9.5553 9.5553 9.5553 9.5553 10.7433 10.7433 10.7433 10.7433 10.9370 10.9370 10.9370 10.9370 12.0535 12.0535 12.0535 12.0535 12.1917 12.1917 12.1917 12.1917 12.2621 12.2621 12.2621 12.2621 12.3563 12.3563 12.3563 12.3563 13.4836 13.4836 13.4836 13.4836 13.8362 13.8362 k = 0.5000 0.2131-0.0000 ( 3750 PWs) bands (ev): 0.8420 0.8420 0.8420 0.8420 1.3517 1.3517 1.3517 1.3517 6.2488 6.2488 6.2488 6.2488 6.4485 6.4485 6.4485 6.4485 8.0316 8.0316 8.0316 8.0316 8.6619 8.6619 8.6619 8.6619 9.4717 9.4717 9.4717 9.4717 9.5478 9.5478 9.5478 9.5478 10.7475 10.7475 10.7475 10.7475 10.9291 10.9291 10.9291 10.9291 12.0725 12.0725 12.0725 12.0725 12.1982 12.1982 12.1982 12.1982 12.2691 12.2691 12.2691 12.2691 12.3558 12.3558 12.3558 12.3558 13.4967 13.4967 13.4967 13.4967 13.8116 13.8116 k = 0.5000 0.2233-0.0000 ( 3754 PWs) bands (ev): 0.8683 0.8683 0.8683 0.8683 1.3253 1.3253 1.3253 1.3253 6.2477 6.2477 6.2477 6.2477 6.4300 6.4300 6.4300 6.4300 8.0617 8.0617 8.0617 8.0617 8.6342 8.6342 8.6342 8.6342 9.4718 9.4718 9.4718 9.4718 9.5404 9.5404 9.5404 9.5404 10.7534 10.7534 10.7534 10.7534 10.9204 10.9204 10.9204 10.9204 12.0905 12.0905 12.0905 12.0905 12.2031 12.2031 12.2031 12.2031 12.2763 12.2763 12.2763 12.2763 12.3554 12.3554 12.3554 12.3554 13.5100 13.5100 13.5100 13.5100 13.7878 13.7878 k = 0.5000 0.2334-0.0000 ( 3750 PWs) bands (ev): 0.8953 0.8953 0.8953 0.8953 1.2982 1.2982 1.2982 1.2982 6.2483 6.2483 6.2483 6.2483 6.4116 6.4116 6.4116 6.4116 8.0935 8.0935 8.0935 8.0935 8.6041 8.6041 8.6041 8.6041 9.4724 9.4724 9.4724 9.4724 9.5333 9.5333 9.5333 9.5333 10.7606 10.7606 10.7606 10.7606 10.9110 10.9110 10.9110 10.9110 12.1074 12.1074 12.1074 12.1074 12.2062 12.2062 12.2062 12.2062 12.2837 12.2837 12.2837 12.2837 12.3551 12.3551 12.3551 12.3551 13.5234 13.5234 13.5234 13.5234 13.7648 13.7648 k = 0.5000 0.2436-0.0000 ( 3742 PWs) bands (ev): 0.9229 0.9229 0.9229 0.9229 1.2706 1.2706 1.2706 1.2706 6.2506 6.2506 6.2506 6.2506 6.3935 6.3935 6.3935 6.3935 8.1268 8.1268 8.1268 8.1268 8.5719 8.5719 8.5719 8.5719 9.4735 9.4735 9.4735 9.4735 9.5264 9.5264 9.5264 9.5264 10.7689 10.7689 10.7689 10.7689 10.9011 10.9011 10.9011 10.9011 12.1230 12.1230 12.1230 12.1230 12.2078 12.2078 12.2078 12.2078 12.2915 12.2915 12.2915 12.2915 12.3546 12.3546 12.3546 12.3546 13.5370 13.5370 13.5370 13.5370 13.7427 13.7427 k = 0.5000 0.2537-0.0000 ( 3744 PWs) bands (ev): 0.9510 0.9510 0.9510 0.9510 1.2424 1.2424 1.2424 1.2424 6.2547 6.2547 6.2547 6.2547 6.3758 6.3758 6.3758 6.3758 8.1613 8.1613 8.1613 8.1613 8.5379 8.5379 8.5379 8.5379 9.4751 9.4751 9.4751 9.4751 9.5198 9.5198 9.5198 9.5198 10.7782 10.7782 10.7782 10.7782 10.8906 10.8906 10.8906 10.8906 12.1372 12.1372 12.1372 12.1372 12.2078 12.2078 12.2078 12.2078 12.2993 12.2993 12.2993 12.2993 12.3535 12.3535 12.3535 12.3535 13.5509 13.5509 13.5509 13.5509 13.7214 13.7214 k = 0.5000 0.2639-0.0000 ( 3748 PWs) bands (ev): 0.9795 0.9795 0.9795 0.9795 1.2137 1.2137 1.2137 1.2137 6.2604 6.2604 6.2604 6.2604 6.3587 6.3587 6.3587 6.3587 8.1970 8.1970 8.1970 8.1970 8.5026 8.5026 8.5026 8.5026 9.4772 9.4772 9.4772 9.4772 9.5136 9.5136 9.5136 9.5136 10.7882 10.7882 10.7882 10.7882 10.8796 10.8796 10.8796 10.8796 12.1500 12.1500 12.1500 12.1500 12.2064 12.2064 12.2064 12.2064 12.3072 12.3072 12.3072 12.3072 12.3519 12.3519 12.3519 12.3519 13.5651 13.5651 13.5651 13.5651 13.7009 13.7009 k = 0.5000 0.2740-0.0000 ( 3748 PWs) bands (ev): 1.0084 1.0084 1.0084 1.0084 1.1848 1.1848 1.1848 1.1848 6.2678 6.2678 6.2678 6.2678 6.3423 6.3423 6.3423 6.3423 8.2335 8.2335 8.2335 8.2335 8.4662 8.4662 8.4662 8.4662 9.4797 9.4797 9.4797 9.4797 9.5079 9.5079 9.5079 9.5079 10.7988 10.7988 10.7988 10.7988 10.8683 10.8683 10.8683 10.8683 12.1614 12.1614 12.1614 12.1614 12.2036 12.2036 12.2036 12.2036 12.3148 12.3148 12.3148 12.3148 12.3496 12.3496 12.3496 12.3496 13.5798 13.5798 13.5798 13.5798 13.6813 13.6813 k = 0.5000 0.2842-0.0000 ( 3752 PWs) bands (ev): 1.0376 1.0376 1.0376 1.0376 1.1556 1.1556 1.1556 1.1556 6.2767 6.2767 6.2767 6.2767 6.3269 6.3269 6.3269 6.3269 8.2702 8.2702 8.2702 8.2702 8.4295 8.4295 8.4295 8.4295 9.4826 9.4826 9.4826 9.4826 9.5027 9.5027 9.5027 9.5027 10.8099 10.8099 10.8099 10.8099 10.8568 10.8568 10.8568 10.8568 12.1715 12.1715 12.1715 12.1715 12.1996 12.1996 12.1996 12.1996 12.3218 12.3218 12.3218 12.3218 12.3465 12.3465 12.3465 12.3465 13.5950 13.5950 13.5950 13.5950 13.6625 13.6625 k = 0.5000 0.2943-0.0000 ( 3752 PWs) bands (ev): 1.0669 1.0669 1.0669 1.0669 1.1262 1.1262 1.1262 1.1262 6.2871 6.2871 6.2871 6.2871 6.3127 6.3127 6.3127 6.3127 8.3058 8.3058 8.3058 8.3058 8.3939 8.3939 8.3939 8.3939 9.4854 9.4854 9.4854 9.4854 9.4985 9.4985 9.4985 9.4985 10.8212 10.8212 10.8212 10.8212 10.8453 10.8453 10.8453 10.8453 12.1802 12.1802 12.1802 12.1802 12.1945 12.1945 12.1945 12.1945 12.3278 12.3278 12.3278 12.3278 12.3430 12.3430 12.3430 12.3430 13.6108 13.6108 13.6108 13.6108 13.6445 13.6445 k = 0.5000 0.3045-0.0000 ( 3752 PWs) bands (ev): 1.0932 1.0932 1.0932 1.0932 1.0999 1.0999 1.0999 1.0999 6.2966 6.2966 6.2966 6.2966 6.3018 6.3018 6.3018 6.3018 8.3284 8.3284 8.3284 8.3284 8.3713 8.3713 8.3713 8.3713 9.4868 9.4868 9.4868 9.4868 9.4966 9.4966 9.4966 9.4966 10.8305 10.8305 10.8305 10.8305 10.8360 10.8360 10.8360 10.8360 12.1863 12.1863 12.1863 12.1863 12.1896 12.1896 12.1896 12.1896 12.3308 12.3308 12.3308 12.3308 12.3409 12.3409 12.3409 12.3409 13.6269 13.6269 13.6269 13.6271 13.6277 13.6277 k = 0.5000 0.3045-0.0000 ( 3752 PWs) bands (ev): 1.0932 1.0932 1.0932 1.0932 1.0999 1.0999 1.0999 1.0999 6.2966 6.2966 6.2966 6.2966 6.3018 6.3018 6.3018 6.3018 8.3284 8.3284 8.3284 8.3284 8.3713 8.3713 8.3713 8.3713 9.4868 9.4868 9.4868 9.4868 9.4966 9.4966 9.4966 9.4966 10.8305 10.8305 10.8305 10.8305 10.8360 10.8360 10.8360 10.8360 12.1863 12.1863 12.1863 12.1863 12.1896 12.1896 12.1896 12.1896 12.3308 12.3308 12.3308 12.3308 12.3409 12.3409 12.3409 12.3409 13.6269 13.6269 13.6269 13.6269 13.6277 13.6277 k = 0.4896 0.3045-0.0000 ( 3760 PWs) bands (ev): 1.0288 1.0288 1.0353 1.0353 1.1550 1.1550 1.1621 1.1621 6.2577 6.2577 6.2640 6.2640 6.3407 6.3407 6.3449 6.3449 8.2571 8.2571 8.3024 8.3024 8.3982 8.3982 8.4386 8.4386 9.4738 9.4738 9.4854 9.4854 9.5015 9.5015 9.5091 9.5091 10.8121 10.8121 10.8169 10.8169 10.8492 10.8492 10.8553 10.8553 12.1604 12.1604 12.1628 12.1628 12.2101 12.2101 12.2133 12.2133 12.3115 12.3115 12.3185 12.3185 12.3535 12.3535 12.3657 12.3657 13.6214 13.6214 13.6239 13.6239 13.6326 13.6330 k = 0.4792 0.3045-0.0000 ( 3760 PWs) bands (ev): 0.9624 0.9624 0.9685 0.9685 1.2140 1.2140 1.2214 1.2214 6.2242 6.2242 6.2316 6.2316 6.3895 6.3895 6.3927 6.3927 8.1846 8.1846 8.2323 8.2323 8.4664 8.4664 8.5040 8.5040 9.4624 9.4624 9.4757 9.4757 9.5177 9.5177 9.5230 9.5230 10.7942 10.7942 10.7982 10.7982 10.8681 10.8681 10.8749 10.8749 12.1339 12.1339 12.1350 12.1350 12.2274 12.2274 12.2274 12.2274 12.3021 12.3021 12.3030 12.3030 12.3777 12.3777 12.3917 12.3917 13.6171 13.6171 13.6214 13.6214 13.6381 13.6385 k = 0.4688 0.3045-0.0000 ( 3764 PWs) bands (ev): 0.8940 0.8940 0.8998 0.8998 1.2699 1.2699 1.2776 1.2776 6.1964 6.1964 6.2051 6.2051 6.4427 6.4427 6.4450 6.4450 8.1113 8.1113 8.1612 8.1612 8.5325 8.5325 8.5673 8.5673 9.4527 9.4527 9.4676 9.4676 9.5354 9.5354 9.5382 9.5382 10.7770 10.7770 10.7803 10.7803 10.8871 10.8871 10.8945 10.8945 12.1071 12.1071 12.1075 12.1075 12.2237 12.2237 12.2286 12.2286 12.3037 12.3037 12.3106 12.3106 12.4024 12.4024 12.4182 12.4182 13.6143 13.6143 13.6206 13.6206 13.6444 13.6444 k = 0.4583 0.3045-0.0000 ( 3766 PWs) bands (ev): 0.8242 0.8242 0.8297 0.8297 1.3224 1.3224 1.3304 1.3304 6.1747 6.1747 6.1847 6.1847 6.4999 6.4999 6.5014 6.5014 8.0375 8.0375 8.0896 8.0896 8.5963 8.5963 8.6281 8.6281 9.4446 9.4446 9.4610 9.4610 9.5544 9.5544 9.5545 9.5545 10.7606 10.7606 10.7631 10.7631 10.9060 10.9060 10.9140 10.9140 12.0796 12.0796 12.0815 12.0815 12.2077 12.2077 12.2141 12.2141 12.3202 12.3202 12.3315 12.3315 12.4272 12.4272 12.4448 12.4448 13.6134 13.6134 13.6217 13.6217 13.6511 13.6511 k = 0.4479 0.3045-0.0000 ( 3766 PWs) bands (ev): 0.7531 0.7531 0.7583 0.7583 1.3712 1.3712 1.3795 1.3795 6.1591 6.1591 6.1707 6.1707 6.5608 6.5608 6.5614 6.5614 7.9635 7.9635 8.0178 8.0178 8.6576 8.6576 8.6862 8.6862 9.4384 9.4384 9.4561 9.4561 9.5717 9.5717 9.5748 9.5748 10.7452 10.7452 10.7468 10.7468 10.9247 10.9247 10.9332 10.9332 12.0526 12.0526 12.0561 12.0561 12.1877 12.1877 12.1937 12.1937 12.3425 12.3425 12.3563 12.3563 12.4519 12.4519 12.4713 12.4713 13.6146 13.6146 13.6252 13.6252 13.6581 13.6581 k = 0.4375 0.3045-0.0000 ( 3770 PWs) bands (ev): 0.6810 0.6810 0.6859 0.6859 1.4161 1.4161 1.4245 1.4245 6.1498 6.1498 6.1632 6.1632 6.6246 6.6246 6.6249 6.6249 7.8896 7.8896 7.9462 7.9462 8.7161 8.7161 8.7416 8.7416 9.4339 9.4339 9.4530 9.4530 9.5898 9.5898 9.5962 9.5962 10.7310 10.7310 10.7318 10.7318 10.9430 10.9430 10.9520 10.9520 12.0261 12.0261 12.0312 12.0312 12.1667 12.1667 12.1719 12.1719 12.3661 12.3661 12.3819 12.3819 12.4760 12.4760 12.4973 12.4973 13.6182 13.6182 13.6314 13.6314 13.6654 13.6654 k = 0.4271 0.3045-0.0000 ( 3770 PWs) bands (ev): 0.6083 0.6083 0.6129 0.6129 1.4568 1.4568 1.4655 1.4655 6.1468 6.1468 6.1622 6.1622 6.6907 6.6907 6.6919 6.6919 7.8163 7.8163 7.8753 7.8753 8.7718 8.7718 8.7939 8.7939 9.4312 9.4312 9.4517 9.4517 9.6086 9.6086 9.6184 9.6184 10.7180 10.7180 10.7181 10.7181 10.9609 10.9609 10.9703 10.9703 12.0004 12.0004 12.0071 12.0071 12.1460 12.1460 12.1502 12.1502 12.3895 12.3895 12.4073 12.4073 12.4993 12.4993 12.5227 12.5227 13.6246 13.6246 13.6405 13.6405 13.6728 13.6728 k = 0.4167 0.3045-0.0000 ( 3764 PWs) bands (ev): 0.5352 0.5352 0.5395 0.5395 1.4931 1.4931 1.5020 1.5020 6.1501 6.1501 6.1677 6.1677 6.7593 6.7593 6.7613 6.7613 7.7440 7.7440 7.8055 7.8055 8.8244 8.8244 8.8432 8.8432 9.4303 9.4303 9.4522 9.4522 9.6277 9.6277 9.6411 9.6411 10.7058 10.7058 10.7068 10.7068 10.9780 10.9780 10.9878 10.9878 11.9753 11.9753 11.9837 11.9837 12.1262 12.1262 12.1294 12.1294 12.4122 12.4122 12.4319 12.4319 12.5216 12.5216 12.5470 12.5470 13.6340 13.6340 13.6529 13.6529 13.6806 13.6806 k = 0.4062 0.3045-0.0000 ( 3764 PWs) bands (ev): 0.4619 0.4619 0.4659 0.4659 1.5251 1.5251 1.5341 1.5341 6.1594 6.1594 6.1796 6.1796 6.8298 6.8298 6.8328 6.8328 7.6732 7.6732 7.7373 7.7373 8.8737 8.8737 8.8893 8.8893 9.4312 9.4312 9.4546 9.4546 9.6471 9.6471 9.6642 9.6642 10.6953 10.6953 10.6971 10.6971 10.9943 10.9943 11.0044 11.0044 11.9509 11.9509 11.9609 11.9609 12.1077 12.1077 12.1098 12.1098 12.4336 12.4336 12.4553 12.4553 12.5424 12.5424 12.5700 12.5700 13.6463 13.6463 13.6680 13.6680 13.6893 13.6893 k = 0.3958 0.3045-0.0000 ( 3774 PWs) bands (ev): 0.3886 0.3886 0.3924 0.3924 1.5525 1.5525 1.5617 1.5617 6.1744 6.1744 6.1975 6.1975 6.9020 6.9020 6.9059 6.9059 7.6044 7.6044 7.6714 7.6714 8.9196 8.9196 8.9322 8.9322 9.4341 9.4341 9.4591 9.4591 9.6664 9.6664 9.6871 9.6871 10.6867 10.6867 10.6894 10.6894 11.0097 11.0097 11.0199 11.0199 11.9269 11.9269 11.9384 11.9384 12.0907 12.0907 12.0919 12.0919 12.4536 12.4536 12.4772 12.4772 12.5616 12.5616 12.5914 12.5914 13.6610 13.6610 13.6830 13.6830 13.7017 13.7017 k = 0.3854 0.3045-0.0000 ( 3782 PWs) bands (ev): 0.3155 0.3155 0.3191 0.3191 1.5755 1.5755 1.5847 1.5847 6.1944 6.1944 6.2208 6.2208 6.9754 6.9754 6.9802 6.9802 7.5383 7.5383 7.6085 7.6085 8.9622 8.9622 8.9720 8.9720 9.4389 9.4389 9.4656 9.4656 9.6854 9.6854 9.7096 9.7096 10.6803 10.6803 10.6837 10.6837 11.0239 11.0239 11.0343 11.0343 11.9033 11.9033 11.9163 11.9163 12.0758 12.0758 12.0761 12.0761 12.4718 12.4718 12.4973 12.4973 12.5792 12.5792 12.6111 12.6111 13.6767 13.6767 13.6935 13.6935 13.7228 13.7228 k = 0.3750 0.3045-0.0000 ( 3786 PWs) bands (ev): 0.2429 0.2429 0.2463 0.2463 1.5940 1.5940 1.6033 1.6033 6.2187 6.2187 6.2489 6.2489 7.0495 7.0495 7.0554 7.0554 7.4759 7.4759 7.5495 7.5495 9.0014 9.0014 9.0087 9.0087 9.4458 9.4458 9.4743 9.4743 9.7038 9.7038 9.7313 9.7313 10.6762 10.6762 10.6802 10.6802 11.0370 11.0370 11.0475 11.0475 11.8801 11.8801 11.8942 11.8942 12.0625 12.0625 12.0630 12.0630 12.4879 12.4879 12.5151 12.5151 12.5955 12.5955 12.6293 12.6293 13.6911 13.6911 13.7007 13.7007 13.7465 13.7465 k = 0.3646 0.3045-0.0000 ( 3766 PWs) bands (ev): 0.1709 0.1709 0.1740 0.1740 1.6082 1.6082 1.6175 1.6175 6.2462 6.2462 6.2807 6.2807 7.1238 7.1238 7.1309 7.1309 7.4184 7.4184 7.4957 7.4957 9.0374 9.0374 9.0425 9.0425 9.4548 9.4548 9.4853 9.4853 9.7215 9.7215 9.7520 9.7520 10.6746 10.6746 10.6792 10.6792 11.0489 11.0489 11.0593 11.0593 11.8573 11.8573 11.8725 11.8725 12.0515 12.0515 12.0527 12.0527 12.5018 12.5018 12.5302 12.5302 12.6110 12.6110 12.6460 12.6460 13.7026 13.7026 13.7065 13.7065 13.7731 13.7731 k = 0.3542 0.3045-0.0000 ( 3772 PWs) bands (ev): 0.0997 0.0997 0.1026 0.1026 1.6182 1.6182 1.6276 1.6276 6.2754 6.2754 6.3144 6.3144 7.1972 7.1972 7.2062 7.2062 7.3679 7.3679 7.4485 7.4485 9.0700 9.0700 9.0734 9.0734 9.4657 9.4657 9.4982 9.4982 9.7382 9.7382 9.7714 9.7714 10.6756 10.6756 10.6805 10.6805 11.0594 11.0594 11.0696 11.0696 11.8347 11.8347 11.8507 11.8507 12.0430 12.0430 12.0447 12.0447 12.5129 12.5129 12.5416 12.5416 12.6260 12.6260 12.6614 12.6614 13.7112 13.7112 13.7113 13.7113 13.8064 13.8064 k = 0.3438 0.3045-0.0000 ( 3766 PWs) bands (ev): 0.0294 0.0294 0.0321 0.0321 1.6242 1.6242 1.6336 1.6336 6.3046 6.3046 6.3483 6.3483 7.2641 7.2641 7.2801 7.2801 7.3317 7.3317 7.4104 7.4104 9.0996 9.0996 9.1016 9.1016 9.4786 9.4786 9.5131 9.5131 9.7540 9.7540 9.7893 9.7893 10.6792 10.6792 10.6843 10.6843 11.0685 11.0685 11.0784 11.0784 11.8123 11.8123 11.8289 11.8289 12.0371 12.0371 12.0393 12.0393 12.5211 12.5211 12.5491 12.5491 12.6415 12.6415 12.6761 12.6761 13.7152 13.7152 13.7177 13.7177 13.8453 13.8453 k = 0.3333 0.3045-0.0000 ( 3770 PWs) bands (ev): -0.0398 -0.0398 -0.0373 -0.0373 1.6266 1.6266 1.6359 1.6359 6.3313 6.3313 6.3795 6.3795 7.2769 7.2769 7.3443 7.3443 7.3591 7.3591 7.3913 7.3913 9.1264 9.1264 9.1274 9.1274 9.4933 9.4933 9.5298 9.5298 9.7688 9.7688 9.8057 9.8057 10.6854 10.6854 10.6907 10.6907 11.0761 11.0761 11.0855 11.0855 11.7902 11.7902 11.8073 11.8073 12.0336 12.0336 12.0364 12.0364 12.5261 12.5261 12.5526 12.5526 12.6573 12.6573 12.6901 12.6901 13.7181 13.7181 13.7225 13.7225 13.8888 13.8889 k = 0.3229 0.3045-0.0000 ( 3774 PWs) bands (ev): -0.1079 -0.1079 -0.1055 -0.1055 1.6255 1.6255 1.6347 1.6347 6.3534 6.3534 6.4052 6.4052 7.2611 7.2611 7.3532 7.3532 7.4273 7.4273 7.4386 7.4386 9.1507 9.1507 9.1510 9.1510 9.5096 9.5096 9.5479 9.5479 9.7827 9.7827 9.8205 9.8205 10.6943 10.6943 10.6994 10.6994 11.0821 11.0821 11.0910 11.0910 11.7685 11.7685 11.7860 11.7860 12.0325 12.0325 12.0358 12.0358 12.5278 12.5278 12.5522 12.5522 12.6738 12.6738 12.7041 12.7041 13.7199 13.7199 13.7259 13.7259 13.9365 13.9365 k = 0.3125 0.3045-0.0000 ( 3770 PWs) bands (ev): -0.1746 -0.1746 -0.1724 -0.1724 1.6212 1.6212 1.6303 1.6303 6.3684 6.3684 6.4221 6.4221 7.2575 7.2575 7.3525 7.3525 7.4976 7.4976 7.5082 7.5082 9.1727 9.1727 9.1728 9.1728 9.5275 9.5275 9.5669 9.5669 9.7959 9.7959 9.8340 9.8340 10.7057 10.7057 10.7106 10.7106 11.0867 11.0867 11.0949 11.0949 11.7474 11.7474 11.7651 11.7651 12.0335 12.0335 12.0374 12.0374 12.5266 12.5266 12.5485 12.5485 12.6907 12.6907 12.7181 12.7181 13.7207 13.7207 13.7279 13.7279 13.9879 13.9879 k = 0.3021 0.3045-0.0000 ( 3766 PWs) bands (ev): -0.2399 -0.2399 -0.2379 -0.2379 1.6141 1.6141 1.6230 1.6230 6.3746 6.3746 6.4280 6.4280 7.2710 7.2710 7.3654 7.3654 7.5670 7.5670 7.5780 7.5780 9.1927 9.1927 9.1931 9.1931 9.5465 9.5465 9.5865 9.5865 9.8088 9.8088 9.8462 9.8462 10.7195 10.7195 10.7240 10.7240 11.0899 11.0899 11.0973 11.0973 11.7268 11.7268 11.7446 11.7446 12.0364 12.0364 12.0411 12.0411 12.5225 12.5225 12.5418 12.5418 12.7078 12.7078 12.7322 12.7322 13.7201 13.7201 13.7286 13.7286 14.0424 14.0424 k = 0.2917 0.3045-0.0000 ( 3764 PWs) bands (ev): -0.3037 -0.3037 -0.3018 -0.3018 1.6045 1.6045 1.6132 1.6132 6.3712 6.3712 6.4221 6.4221 7.3025 7.3025 7.3938 7.3938 7.6345 7.6345 7.6462 7.6462 9.2114 9.2114 9.2119 9.2119 9.5664 9.5664 9.6061 9.6061 9.8218 9.8218 9.8575 9.8575 10.7353 10.7353 10.7394 10.7394 11.0917 11.0917 11.0982 11.0982 11.7069 11.7069 11.7249 11.7249 12.0409 12.0409 12.0465 12.0465 12.5158 12.5158 12.5328 12.5328 12.7251 12.7251 12.7465 12.7465 13.7182 13.7182 13.7279 13.7279 14.0999 14.0999 k = 0.2812 0.3045-0.0000 ( 3756 PWs) bands (ev): -0.3659 -0.3659 -0.3641 -0.3641 1.5926 1.5926 1.6012 1.6012 6.3584 6.3584 6.4053 6.4053 7.3508 7.3508 7.4372 7.4372 7.6997 7.6997 7.7121 7.7121 9.2290 9.2290 9.2295 9.2295 9.5869 9.5869 9.6252 9.6252 9.8353 9.8353 9.8683 9.8683 10.7531 10.7531 10.7567 10.7567 11.0921 11.0921 11.0976 11.0976 11.6878 11.6878 11.7059 11.7059 12.0468 12.0468 12.0534 12.0534 12.5070 12.5070 12.5217 12.5217 12.7425 12.7425 12.7609 12.7609 13.7150 13.7150 13.7258 13.7258 14.1602 14.1602 k = 0.2708 0.3045-0.0000 ( 3754 PWs) bands (ev): -0.4263 -0.4263 -0.4248 -0.4248 1.5789 1.5789 1.5872 1.5872 6.3375 6.3375 6.3795 6.3795 7.4135 7.4135 7.4941 7.4941 7.7623 7.7623 7.7755 7.7755 9.2456 9.2456 9.2462 9.2462 9.6077 9.6077 9.6432 9.6432 9.8499 9.8499 9.8788 9.8788 10.7726 10.7726 10.7756 10.7756 11.0912 11.0912 11.0957 11.0957 11.6696 11.6696 11.6878 11.6878 12.0536 12.0536 12.0615 12.0615 12.4965 12.4965 12.5090 12.5090 12.7600 12.7600 12.7755 12.7755 13.7104 13.7104 13.7223 13.7223 14.2230 14.2230 k = 0.2604 0.3045-0.0000 ( 3762 PWs) bands (ev): -0.4851 -0.4851 -0.4836 -0.4836 1.5634 1.5634 1.5715 1.5715 6.3101 6.3101 6.3469 6.3469 7.4880 7.4880 7.5624 7.5624 7.8220 7.8220 7.8360 7.8360 9.2615 9.2615 9.2623 9.2623 9.6283 9.6283 9.6597 9.6597 9.8658 9.8658 9.8895 9.8895 10.7934 10.7934 10.7960 10.7960 11.0890 11.0890 11.0925 11.0925 11.6524 11.6524 11.6706 11.6706 12.0610 12.0610 12.0704 12.0704 12.4844 12.4844 12.4949 12.4949 12.7775 12.7775 12.7903 12.7903 13.7045 13.7045 13.7176 13.7176 14.2884 14.2884 k = 0.2500 0.3045-0.0000 ( 3762 PWs) bands (ev): -0.5419 -0.5419 -0.5406 -0.5406 1.5467 1.5467 1.5545 1.5545 6.2777 6.2777 6.3097 6.3097 7.5717 7.5717 7.6397 7.6397 7.8786 7.8786 7.8936 7.8936 9.2768 9.2768 9.2779 9.2779 9.6484 9.6484 9.6745 9.6745 9.8834 9.8834 9.9008 9.9008 10.8154 10.8154 10.8177 10.8177 11.0857 11.0857 11.0881 11.0881 11.6362 11.6362 11.6545 11.6545 12.0689 12.0689 12.0801 12.0801 12.4714 12.4714 12.4798 12.4798 12.7954 12.7954 12.8055 12.8055 13.6976 13.6976 13.7118 13.7118 14.3563 14.3563 k = 0.2396 0.3045-0.0000 ( 3758 PWs) bands (ev): -0.5969 -0.5969 -0.5956 -0.5956 1.5289 1.5289 1.5365 1.5365 6.2419 6.2419 6.2696 6.2696 7.6623 7.6623 7.7241 7.7241 7.9320 7.9320 7.9484 7.9484 9.2917 9.2917 9.2931 9.2931 9.6680 9.6680 9.6876 9.6876 9.9026 9.9026 9.9131 9.9131 10.8382 10.8382 10.8404 10.8404 11.0812 11.0812 11.0826 11.0826 11.6212 11.6212 11.6395 11.6395 12.0769 12.0769 12.0901 12.0901 12.4576 12.4576 12.4639 12.4639 12.8136 12.8136 12.8210 12.8210 13.6897 13.6897 13.7052 13.7052 14.4269 14.4269 k = 0.2292 0.3045-0.0000 ( 3766 PWs) bands (ev): -0.6499 -0.6499 -0.6487 -0.6487 1.5103 1.5103 1.5176 1.5176 6.2040 6.2040 6.2277 6.2277 7.7579 7.7579 7.8129 7.8129 7.9822 7.9822 8.0008 8.0008 9.3061 9.3061 9.3081 9.3081 9.6867 9.6867 9.6991 9.6991 9.9233 9.9233 9.9264 9.9264 10.8616 10.8616 10.8640 10.8640 11.0756 11.0756 11.0762 11.0762 11.6072 11.6072 11.6256 11.6256 12.0846 12.0846 12.1001 12.1001 12.4432 12.4432 12.4475 12.4475 12.8324 12.8324 12.8372 12.8372 13.6813 13.6813 13.6979 13.6979 14.5002 14.5002 k = 0.2188 0.3045-0.0000 ( 3758 PWs) bands (ev): -0.7008 -0.7008 -0.6998 -0.6998 1.4911 1.4911 1.4981 1.4981 6.1647 6.1647 6.1852 6.1852 7.8564 7.8564 7.9034 7.9034 8.0297 8.0297 8.0524 8.0524 9.3201 9.3201 9.3229 9.3229 9.7044 9.7044 9.7095 9.7095 9.9411 9.9411 9.9453 9.9453 10.8854 10.8854 10.8884 10.8884 11.0689 11.0689 11.0692 11.0692 11.5945 11.5945 11.6129 11.6129 12.0920 12.0920 12.1100 12.1100 12.4287 12.4287 12.4307 12.4307 12.8519 12.8519 12.8540 12.8540 13.6726 13.6726 13.6904 13.6904 14.5763 14.5763 k = 0.2083 0.3045-0.0000 ( 3754 PWs) bands (ev): -0.7497 -0.7497 -0.7487 -0.7487 1.4715 1.4715 1.4783 1.4783 6.1250 6.1250 6.1426 6.1426 7.9552 7.9552 7.9900 7.9900 8.0759 8.0759 8.1071 8.1071 9.3336 9.3336 9.3373 9.3373 9.7190 9.7190 9.7213 9.7213 9.9571 9.9571 9.9681 9.9681 10.9089 10.9089 10.9133 10.9133 11.0613 11.0613 11.0618 11.0618 11.5829 11.5829 11.6013 11.6013 12.0986 12.0986 12.1195 12.1195 12.4137 12.4137 12.4142 12.4142 12.8717 12.8717 12.8723 12.8723 13.6641 13.6641 13.6831 13.6831 14.6552 14.6552 k = 0.1979 0.3045-0.0000 ( 3742 PWs) bands (ev): -0.7964 -0.7964 -0.7955 -0.7955 1.4519 1.4519 1.4583 1.4583 6.0855 6.0855 6.1006 6.1006 8.0472 8.0472 8.0631 8.0631 8.1269 8.1269 8.1736 8.1736 9.3465 9.3465 9.3515 9.3515 9.7281 9.7281 9.7373 9.7373 9.9744 9.9744 9.9914 9.9914 10.9314 10.9314 10.9385 10.9385 11.0529 11.0529 11.0548 11.0548 11.5725 11.5725 11.5908 11.5908 12.1045 12.1045 12.1284 12.1284 12.3968 12.3968 12.3999 12.3999 12.8904 12.8904 12.8936 12.8936 13.6563 13.6563 13.6764 13.6764 14.7368 14.7368 k = 0.1875 0.3045-0.0000 ( 3734 PWs) bands (ev): -0.8410 -0.8410 -0.8402 -0.8402 1.4322 1.4322 1.4384 1.4384 6.0465 6.0465 6.0595 6.0595 8.1137 8.1137 8.1165 8.1165 8.2003 8.2003 8.2572 8.2572 9.3589 9.3589 9.3652 9.3652 9.7372 9.7372 9.7528 9.7528 9.9926 9.9926 10.0147 10.0147 10.9513 10.9513 10.9636 10.9636 11.0440 11.0440 11.0496 11.0496 11.5631 11.5631 11.5814 11.5814 12.1094 12.1094 12.1366 12.1366 12.3801 12.3801 12.3859 12.3859 12.9102 12.9102 12.9159 12.9159 13.6498 13.6498 13.6708 13.6708 14.8209 14.8210 k = 0.1771 0.3045-0.0000 ( 3732 PWs) bands (ev): -0.8834 -0.8834 -0.8826 -0.8826 1.4128 1.4128 1.4187 1.4187 6.0085 6.0085 6.0197 6.0197 8.1551 8.1551 8.1560 8.1560 8.2950 8.2950 8.3511 8.3511 9.3704 9.3704 9.3784 9.3784 9.7465 9.7465 9.7677 9.7677 10.0115 10.0115 10.0376 10.0376 10.9656 10.9656 10.9869 10.9869 11.0359 11.0359 11.0491 11.0491 11.5547 11.5547 11.5729 11.5729 12.1133 12.1133 12.1439 12.1439 12.3635 12.3635 12.3722 12.3722 12.9310 12.9310 12.9392 12.9392 13.6452 13.6452 13.6670 13.6670 14.9004 14.9004 k = 0.1667 0.3045-0.0000 ( 3728 PWs) bands (ev): -0.9235 -0.9235 -0.9228 -0.9228 1.3938 1.3938 1.3993 1.3993 5.9717 5.9717 5.9814 5.9814 8.1864 8.1864 8.1876 8.1876 8.3955 8.3955 8.4488 8.4488 9.3812 9.3812 9.3910 9.3910 9.7563 9.7563 9.7823 9.7823 10.0310 10.0310 10.0600 10.0600 10.9706 10.9706 11.0013 11.0013 11.0359 11.0359 11.0570 11.0570 11.5471 11.5471 11.5651 11.5651 12.1163 12.1163 12.1503 12.1503 12.3474 12.3474 12.3591 12.3591 12.9527 12.9527 12.9634 12.9634 13.6432 13.6432 13.6657 13.6657 14.9793 14.9793 k = 0.1562 0.3045-0.0000 ( 3732 PWs) bands (ev): -0.9613 -0.9613 -0.9607 -0.9607 1.3753 1.3753 1.3805 1.3805 5.9365 5.9365 5.9448 5.9448 8.2124 8.2124 8.2140 8.2140 8.4961 8.4961 8.5468 8.5468 9.3911 9.3911 9.4027 9.4027 9.7667 9.7667 9.7967 9.7967 10.0505 10.0505 10.0817 10.0817 10.9665 10.9665 10.9974 10.9974 11.0532 11.0532 11.0730 11.0730 11.5402 11.5402 11.5580 11.5580 12.1183 12.1183 12.1558 12.1558 12.3316 12.3316 12.3464 12.3464 12.9752 12.9752 12.9879 12.9879 13.6448 13.6448 13.6677 13.6677 15.0552 15.0552 k = 0.1458 0.3045-0.0000 ( 3748 PWs) bands (ev): -0.9969 -0.9969 -0.9963 -0.9963 1.3574 1.3574 1.3623 1.3623 5.9029 5.9029 5.9101 5.9101 8.2346 8.2346 8.2365 8.2365 8.5949 8.5949 8.6435 8.6435 9.4001 9.4001 9.4136 9.4136 9.7779 9.7779 9.8110 9.8110 10.0701 10.0701 10.1023 10.1023 10.9566 10.9566 10.9855 10.9855 11.0773 11.0773 11.0937 11.0937 11.5338 11.5338 11.5513 11.5513 12.1196 12.1196 12.1604 12.1604 12.3162 12.3162 12.3342 12.3342 12.9979 12.9979 13.0124 13.0124 13.6508 13.6508 13.6737 13.6737 15.1241 15.1241 k = 0.1354 0.3045-0.0000 ( 3756 PWs) bands (ev): -1.0301 -1.0301 -1.0296 -1.0296 1.3404 1.3404 1.3449 1.3449 5.8711 5.8711 5.8773 5.8773 8.2537 8.2537 8.2556 8.2556 8.6910 8.6910 8.7377 8.7377 9.4081 9.4081 9.4237 9.4237 9.7897 9.7897 9.8252 9.8252 10.0895 10.0895 10.1220 10.1220 10.9436 10.9436 10.9713 10.9713 11.1026 11.1026 11.1165 11.1165 11.5279 11.5279 11.5451 11.5451 12.1204 12.1204 12.1643 12.1643 12.3013 12.3013 12.3224 12.3224 13.0204 13.0204 13.0363 13.0363 13.6624 13.6624 13.6847 13.6847 15.1802 15.1802 k = 0.1250 0.3045-0.0000 ( 3762 PWs) bands (ev): -1.0609 -1.0609 -1.0605 -1.0605 1.3242 1.3242 1.3284 1.3284 5.8414 5.8414 5.8467 5.8467 8.2701 8.2701 8.2720 8.2720 8.7832 8.7832 8.8285 8.8285 9.4151 9.4151 9.4328 9.4328 9.8022 9.8022 9.8392 9.8392 10.1085 10.1085 10.1405 10.1405 10.9286 10.9286 10.9556 10.9556 11.1282 11.1282 11.1401 11.1401 11.5222 11.5222 11.5389 11.5389 12.1209 12.1209 12.1675 12.1675 12.2870 12.2870 12.3111 12.3111 13.0421 13.0421 13.0587 13.0587 13.6804 13.6804 13.7016 13.7016 15.2172 15.2172 k = 0.1146 0.3045-0.0000 ( 3766 PWs) bands (ev): -1.0894 -1.0894 -1.0890 -1.0890 1.3090 1.3090 1.3128 1.3128 5.8137 5.8137 5.8183 5.8183 8.2841 8.2841 8.2858 8.2858 8.8710 8.8710 8.9151 8.9151 9.4211 9.4211 9.4409 9.4409 9.8153 9.8153 9.8528 9.8528 10.1272 10.1272 10.1580 10.1580 10.9124 10.9124 10.9389 10.9389 11.1534 11.1534 11.1639 11.1639 11.5167 11.5167 11.5329 11.5329 12.1212 12.1212 12.1703 12.1703 12.2733 12.2733 12.3002 12.3002 13.0623 13.0623 13.0790 13.0790 13.7057 13.7057 13.7253 13.7253 15.2321 15.2321 k = 0.1042 0.3045-0.0000 ( 3766 PWs) bands (ev): -1.1154 -1.1154 -1.1150 -1.1150 1.2948 1.2948 1.2984 1.2984 5.7882 5.7882 5.7921 5.7921 8.2959 8.2959 8.2975 8.2975 8.9536 8.9536 8.9968 8.9968 9.4261 9.4261 9.4482 9.4482 9.8287 9.8287 9.8660 9.8660 10.1454 10.1454 10.1743 10.1743 10.8954 10.8954 10.9214 10.9214 11.1781 11.1781 11.1874 11.1874 11.5114 11.5114 11.5269 11.5269 12.1217 12.1217 12.1728 12.1728 12.2601 12.2601 12.2898 12.2898 13.0803 13.0803 13.0965 13.0965 13.7389 13.7389 13.7561 13.7561 15.2272 15.2272 k = 0.0938 0.3045-0.0000 ( 3766 PWs) bands (ev): -1.1390 -1.1390 -1.1387 -1.1387 1.2819 1.2819 1.2850 1.2850 5.7649 5.7649 5.7682 5.7682 8.3059 8.3059 8.3073 8.3073 9.0304 9.0304 9.0731 9.0731 9.4302 9.4302 9.4545 9.4545 9.8423 9.8423 9.8785 9.8785 10.1631 10.1631 10.1896 10.1896 10.8780 10.8780 10.9033 10.9033 11.2021 11.2021 11.2104 11.2104 11.5059 11.5059 11.5206 11.5206 12.1225 12.1225 12.1751 12.1751 12.2475 12.2475 12.2797 12.2797 13.0959 13.0959 13.1110 13.1110 13.7800 13.7800 13.7944 13.7944 15.2068 15.2068 k = 0.0833 0.3045-0.0000 ( 3766 PWs) bands (ev): -1.1602 -1.1602 -1.1599 -1.1599 1.2701 1.2701 1.2729 1.2729 5.7440 5.7440 5.7468 5.7468 8.3142 8.3142 8.3155 8.3155 9.1008 9.1008 9.1432 9.1432 9.4333 9.4333 9.4600 9.4600 9.8557 9.8557 9.8901 9.8901 10.1802 10.1802 10.2039 10.2039 10.8605 10.8605 10.8850 10.8850 11.2251 11.2251 11.2325 11.2325 11.5001 11.5001 11.5140 11.5140 12.1237 12.1237 12.1774 12.1774 12.2354 12.2354 12.2700 12.2700 13.1089 13.1089 13.1224 13.1224 13.8286 13.8286 13.8399 13.8399 15.1745 15.1745 k = 0.0729 0.3045-0.0000 ( 3760 PWs) bands (ev): -1.1789 -1.1789 -1.1786 -1.1786 1.2596 1.2596 1.2621 1.2621 5.7254 5.7254 5.7277 5.7277 8.3211 8.3211 8.3222 8.3222 9.1643 9.1643 9.2068 9.2068 9.4354 9.4354 9.4646 9.4646 9.8688 9.8688 9.9006 9.9006 10.1966 10.1966 10.2171 10.2171 10.8435 10.8435 10.8666 10.8666 11.2470 11.2470 11.2537 11.2537 11.4941 11.4941 11.5070 11.5070 12.1255 12.1255 12.1798 12.1798 12.2239 12.2239 12.2607 12.2607 13.1192 13.1192 13.1310 13.1310 13.8837 13.8837 13.8918 13.8918 15.1331 15.1331 k = 0.0625 0.3045-0.0000 ( 3760 PWs) bands (ev): -1.1951 -1.1951 -1.1949 -1.1949 1.2504 1.2504 1.2525 1.2525 5.7092 5.7092 5.7111 5.7111 8.3267 8.3267 8.3276 8.3276 9.2205 9.2205 9.2634 9.2634 9.4365 9.4365 9.4684 9.4684 9.8813 9.8813 9.9098 9.9098 10.2121 10.2121 10.2293 10.2293 10.8271 10.8271 10.8485 10.8485 11.2675 11.2675 11.2736 11.2736 11.4879 11.4879 11.4997 11.4997 12.1280 12.1280 12.1823 12.1823 12.2130 12.2130 12.2518 12.2518 13.1272 13.1272 13.1372 13.1372 13.9439 13.9439 13.9489 13.9489 15.0848 15.0848 k = 0.0521 0.3045-0.0000 ( 3760 PWs) bands (ev): -1.2089 -1.2089 -1.2087 -1.2087 1.2426 1.2426 1.2444 1.2444 5.6955 5.6955 5.6970 5.6970 8.3311 8.3311 8.3319 8.3319 9.2691 9.2691 9.3126 9.3126 9.4366 9.4366 9.4713 9.4713 9.8928 9.8928 9.9174 9.9174 10.2264 10.2264 10.2402 10.2402 10.8122 10.8122 10.8313 10.8313 11.2864 11.2864 11.2919 11.2919 11.4815 11.4815 11.4921 11.4921 12.1312 12.1312 12.1850 12.1850 12.2029 12.2029 12.2433 12.2433 13.1333 13.1333 13.1413 13.1413 14.0072 14.0072 14.0094 14.0094 15.0319 15.0319 k = 0.0417 0.3045-0.0000 ( 3760 PWs) bands (ev): -1.2201 -1.2201 -1.2200 -1.2200 1.2362 1.2362 1.2376 1.2376 5.6842 5.6842 5.6854 5.6854 8.3346 8.3346 8.3353 8.3353 9.3101 9.3101 9.3542 9.3542 9.4356 9.4356 9.4729 9.4729 9.9031 9.9031 9.9234 9.9234 10.2392 10.2392 10.2497 10.2497 10.7991 10.7991 10.8154 10.8154 11.3034 11.3034 11.3083 11.3083 11.4753 11.4753 11.4844 11.4844 12.1351 12.1351 12.1867 12.1867 12.1947 12.1947 12.2353 12.2353 13.1377 13.1377 13.1440 13.1440 14.0707 14.0707 14.0708 14.0708 14.9774 14.9774 k = 0.0312 0.3045-0.0000 ( 3754 PWs) bands (ev): -1.2289 -1.2289 -1.2288 -1.2288 1.2312 1.2312 1.2323 1.2323 5.6755 5.6755 5.6763 5.6763 8.3373 8.3373 8.3378 8.3378 9.3435 9.3435 9.3876 9.3876 9.4340 9.4340 9.4730 9.4730 9.9120 9.9120 9.9276 9.9276 10.2501 10.2501 10.2576 10.2576 10.7887 10.7887 10.8016 10.8016 11.3181 11.3181 11.3222 11.3222 11.4695 11.4695 11.4769 11.4769 12.1398 12.1398 12.1816 12.1816 12.1945 12.1945 12.2279 12.2279 13.1409 13.1409 13.1455 13.1455 14.1293 14.1293 14.1308 14.1308 14.9248 14.9248 k = 0.0208 0.3045-0.0000 ( 3754 PWs) bands (ev): -1.2352 -1.2352 -1.2351 -1.2351 1.2277 1.2277 1.2284 1.2284 5.6692 5.6692 5.6698 5.6698 8.3391 8.3391 8.3394 8.3394 9.3699 9.3699 9.4098 9.4098 9.4342 9.4342 9.4709 9.4709 9.9193 9.9193 9.9298 9.9298 10.2586 10.2586 10.2634 10.2634 10.7815 10.7815 10.7904 10.7904 11.3298 11.3298 11.3329 11.3329 11.4649 11.4649 11.4702 11.4702 12.1452 12.1452 12.1734 12.1734 12.1983 12.1983 12.2209 12.2209 13.1432 13.1432 13.1462 13.1462 14.1799 14.1799 14.1820 14.1820 14.8795 14.8795 k = 0.0104 0.3045-0.0000 ( 3750 PWs) bands (ev): -1.2389 -1.2389 -1.2389 -1.2389 1.2257 1.2257 1.2260 1.2260 5.6656 5.6656 5.6658 5.6658 8.3403 8.3403 8.3404 8.3404 9.3899 9.3899 9.4129 9.4129 9.4444 9.4444 9.4658 9.4658 9.9249 9.9249 9.9302 9.9302 10.2643 10.2643 10.2666 10.2666 10.7778 10.7778 10.7824 10.7824 11.3377 11.3377 11.3394 11.3394 11.4623 11.4623 11.4651 11.4651 12.1513 12.1513 12.1655 12.1655 12.2031 12.2031 12.2144 12.2144 13.1448 13.1448 13.1463 13.1463 14.2156 14.2156 14.2171 14.2171 14.8486 14.8486 k = 0.0000 0.3045-0.0000 ( 3754 PWs) bands (ev): -1.2401 -1.2401 -1.2401 -1.2401 1.2251 1.2251 1.2251 1.2251 5.6644 5.6644 5.6644 5.6644 8.3407 8.3407 8.3407 8.3407 9.4043 9.4043 9.4043 9.4043 9.4569 9.4569 9.4569 9.4569 9.9285 9.9285 9.9285 9.9285 10.2670 10.2670 10.2670 10.2670 10.7781 10.7781 10.7781 10.7781 11.3411 11.3411 11.3411 11.3411 11.4622 11.4622 11.4622 11.4622 12.1581 12.1581 12.1581 12.1581 12.2084 12.2084 12.2084 12.2084 13.1458 13.1458 13.1458 13.1458 14.2293 14.2293 14.2293 14.2293 14.8390 14.8390 k = 0.0000 0.3045-0.0000 ( 3754 PWs) bands (ev): -1.2401 -1.2401 -1.2401 -1.2401 1.2251 1.2251 1.2251 1.2251 5.6644 5.6644 5.6644 5.6644 8.3407 8.3407 8.3407 8.3407 9.4043 9.4043 9.4043 9.4043 9.4569 9.4569 9.4569 9.4569 9.9285 9.9285 9.9285 9.9285 10.2670 10.2670 10.2670 10.2670 10.7781 10.7781 10.7781 10.7781 11.3411 11.3411 11.3411 11.3411 11.4622 11.4622 11.4622 11.4622 12.1581 12.1581 12.1581 12.1581 12.2084 12.2084 12.2084 12.2084 13.1458 13.1458 13.1458 13.1458 14.2293 14.2293 14.2293 14.2293 14.8390 14.8390 k = 0.0000 0.2943-0.0000 ( 3754 PWs) bands (ev): -1.3028 -1.3028 -1.1764 -1.1764 1.2094 1.2094 1.2412 1.2412 5.6209 5.6209 5.7114 5.7114 8.2480 8.2480 8.4231 8.4231 9.3902 9.3902 9.4056 9.4056 9.4485 9.4485 9.4830 9.4830 9.8805 9.8805 9.9776 9.9776 10.2212 10.2212 10.3131 10.3131 10.7478 10.7478 10.8074 10.8074 11.3355 11.3355 11.3468 11.3468 11.4411 11.4411 11.4835 11.4835 12.1453 12.1453 12.1687 12.1687 12.1987 12.1987 12.2199 12.2199 13.1173 13.1173 13.1780 13.1780 14.1239 14.1239 14.3351 14.3351 14.7830 14.7830 k = 0.0000 0.2842-0.0000 ( 3760 PWs) bands (ev): -1.3643 -1.3643 -1.1117 -1.1117 1.1941 1.1941 1.2574 1.2574 5.5811 5.5811 5.7619 5.7619 8.1466 8.1466 8.4938 8.4938 9.3742 9.3742 9.3877 9.3877 9.4661 9.4661 9.5136 9.5136 9.8340 9.8340 10.0275 10.0275 10.1759 10.1759 10.3595 10.3595 10.7164 10.7164 10.8355 10.8355 11.3300 11.3300 11.3525 11.3525 11.4200 11.4200 11.5048 11.5048 12.1305 12.1305 12.1771 12.1771 12.1905 12.1905 12.2327 12.2327 13.0923 13.0923 13.2143 13.2143 14.0189 14.0189 14.4409 14.4409 14.7277 14.7277 k = 0.0000 0.2740-0.0000 ( 3756 PWs) bands (ev): -1.4245 -1.4245 -1.0463 -1.0463 1.1795 1.1795 1.2737 1.2737 5.5448 5.5448 5.8156 5.8156 8.0379 8.0379 8.5518 8.5518 9.3547 9.3547 9.3699 9.3699 9.4938 9.4938 9.5465 9.5465 9.7898 9.7898 10.0777 10.0777 10.1312 10.1312 10.4061 10.4061 10.6841 10.6841 10.8625 10.8625 11.3248 11.3248 11.3581 11.3581 11.3992 11.3992 11.5260 11.5260 12.1144 12.1144 12.1805 12.1805 12.1867 12.1867 12.2465 12.2465 13.0705 13.0705 13.2549 13.2549 13.9146 13.9146 14.5467 14.5467 14.6739 14.6739 k = 0.0000 0.2639-0.0000 ( 3756 PWs) bands (ev): -1.4831 -1.4831 -0.9803 -0.9803 1.1657 1.1657 1.2899 1.2899 5.5124 5.5124 5.8725 5.8725 7.9234 7.9234 8.5962 8.5962 9.3322 9.3322 9.3561 9.3561 9.5266 9.5266 9.5812 9.5812 9.7486 9.7486 10.0867 10.0867 10.1283 10.1283 10.4527 10.4527 10.6512 10.6512 10.8883 10.8883 11.3199 11.3199 11.3633 11.3633 11.3792 11.3792 11.5471 11.5471 12.0973 12.0973 12.1750 12.1750 12.1912 12.1912 12.2608 12.2608 13.0515 13.0515 13.2997 13.2997 13.8110 13.8110 14.6216 14.6216 14.6525 14.6525 k = 0.0000 0.2537-0.0000 ( 3758 PWs) bands (ev): -1.5402 -1.5402 -0.9141 -0.9141 1.1530 1.1530 1.3058 1.3058 5.4836 5.4836 5.9324 5.9324 7.8043 7.8043 8.6270 8.6270 9.3096 9.3096 9.3435 9.3435 9.5618 9.5618 9.6174 9.6174 9.7124 9.7124 10.0432 10.0432 10.1783 10.1783 10.4988 10.4988 10.6179 10.6179 10.9128 10.9128 11.3155 11.3155 11.3565 11.3565 11.3713 11.3713 11.5681 11.5681 12.0795 12.0795 12.1688 12.1688 12.1958 12.1958 12.2752 12.2752 13.0350 13.0350 13.3489 13.3489 13.7083 13.7083 14.5722 14.5722 14.7572 14.7572 k = 0.0000 0.2436-0.0000 ( 3752 PWs) bands (ev): -1.5956 -1.5956 -0.8477 -0.8477 1.1415 1.1415 1.3213 1.3213 5.4587 5.4587 5.9950 5.9950 7.6818 7.6818 8.6448 8.6448 9.2878 9.2878 9.3310 9.3310 9.5925 9.5925 9.6553 9.6553 9.6869 9.6869 10.0004 10.0004 10.2280 10.2280 10.5404 10.5404 10.5884 10.5884 10.9360 10.9360 11.3115 11.3115 11.3373 11.3373 11.3765 11.3765 11.5889 11.5889 12.0612 12.0612 12.1629 12.1629 12.1998 12.1998 12.2894 12.2894 13.0206 13.0206 13.4022 13.4022 13.6065 13.6065 14.5258 14.5258 14.8610 14.8610 k = 0.0000 0.2334-0.0000 ( 3758 PWs) bands (ev): -1.6493 -1.6493 -0.7816 -0.7816 1.1314 1.1314 1.3365 1.3365 5.4375 5.4375 6.0602 6.0602 7.5570 7.5570 8.6505 8.6505 9.2673 9.2673 9.3179 9.3179 9.5998 9.5998 9.6897 9.6897 9.6946 9.6946 9.9582 9.9582 10.2770 10.2770 10.5380 10.5380 10.6020 10.6020 10.9580 10.9580 11.3081 11.3081 11.3176 11.3176 11.3821 11.3821 11.6094 11.6094 12.0426 12.0426 12.1571 12.1571 12.2030 12.2030 12.3034 12.3034 13.0083 13.0083 13.4589 13.4589 13.5058 13.5058 14.4832 14.4832 14.9634 14.9634 k = 0.0000 0.2233-0.0000 ( 3758 PWs) bands (ev): -1.7011 -1.7011 -0.7160 -0.7160 1.1231 1.1231 1.3511 1.3511 5.4200 5.4200 6.1276 6.1276 7.4309 7.4309 8.6455 8.6455 9.2481 9.2481 9.3035 9.3035 9.5824 9.5824 9.7210 9.7210 9.7354 9.7354 9.9169 9.9169 10.3251 10.3251 10.5048 10.5048 10.6457 10.6457 10.9786 10.9786 11.2984 11.2984 11.3054 11.3054 11.3880 11.3880 11.6296 11.6296 12.0237 12.0237 12.1514 12.1514 12.2057 12.2057 12.3168 12.3168 12.9976 12.9976 13.4063 13.4063 13.5184 13.5184 14.4457 14.4457 15.0637 15.0637 k = 0.0000 0.2131-0.0000 ( 3766 PWs) bands (ev): -1.7510 -1.7510 -0.6513 -0.6513 1.1166 1.1166 1.3650 1.3650 5.4062 5.4062 6.1967 6.1967 7.3047 7.3047 8.6310 8.6310 9.2303 9.2303 9.2875 9.2875 9.5595 9.5595 9.7605 9.7605 9.7773 9.7773 9.8764 9.8764 10.3721 10.3721 10.4687 10.4687 10.6916 10.6916 10.9980 10.9980 11.2797 11.2797 11.3034 11.3034 11.3939 11.3939 11.6495 11.6495 12.0048 12.0048 12.1459 12.1459 12.2077 12.2077 12.3295 12.3295 12.9883 12.9883 13.3080 13.3080 13.5791 13.5791 14.4143 14.4143 15.1603 15.1603 k = 0.0000 0.2030-0.0000 ( 3760 PWs) bands (ev): -1.7990 -1.7990 -0.5877 -0.5877 1.1123 1.1123 1.3784 1.3784 5.3960 5.3960 6.2665 6.2665 7.1798 7.1798 8.6084 8.6084 9.2140 9.2140 9.2696 9.2696 9.5376 9.5376 9.8013 9.8013 9.8199 9.8199 9.8370 9.8370 10.4176 10.4176 10.4319 10.4319 10.7377 10.7377 11.0161 11.0161 11.2617 11.2617 11.3022 11.3022 11.3999 11.3999 11.6689 11.6689 11.9860 11.9860 12.1405 12.1405 12.2092 12.2092 12.3415 12.3415 12.9803 12.9803 13.2112 13.2112 13.6390 13.6390 14.3912 14.3912 15.1903 15.1903 k = 0.0000 0.1928-0.0000 ( 3758 PWs) bands (ev): -1.8449 -1.8449 -0.5257 -0.5257 1.1104 1.1104 1.3909 1.3909 5.3893 5.3893 6.3356 6.3356 7.0584 7.0584 8.5789 8.5789 9.1991 9.1991 9.2493 9.2493 9.5180 9.5180 9.7981 9.7981 9.8417 9.8417 9.8624 9.8624 10.3943 10.3943 10.4622 10.4622 10.7835 10.7835 11.0332 11.0332 11.2441 11.2441 11.3019 11.3019 11.4060 11.4060 11.6880 11.6880 11.9671 11.9671 12.1353 12.1353 12.2100 12.2100 12.3527 12.3527 12.9734 12.9734 13.1158 13.1158 13.6954 13.6954 14.3786 14.3786 15.0914 15.0914 k = 0.0000 0.1827-0.0000 ( 3754 PWs) bands (ev): -1.8887 -1.8887 -0.4656 -0.4656 1.1110 1.1110 1.4027 1.4027 5.3860 5.3860 6.4002 6.4002 6.9446 6.9446 8.5438 8.5438 9.1856 9.1856 9.2265 9.2265 9.5012 9.5012 9.7605 9.7605 9.8798 9.8798 9.9049 9.9049 10.3571 10.3571 10.5048 10.5048 10.8289 10.8289 11.0493 11.0493 11.2273 11.2273 11.3025 11.3025 11.4120 11.4120 11.7066 11.7066 11.9484 11.9484 12.1303 12.1303 12.2101 12.2101 12.3628 12.3628 12.9668 12.9668 13.0227 13.0227 13.7447 13.7447 14.3796 14.3796 14.9934 14.9934 k = 0.0000 0.1725-0.0000 ( 3764 PWs) bands (ev): -1.9304 -1.9304 -0.4079 -0.4079 1.1145 1.1145 1.4137 1.4137 5.3858 5.3858 6.4508 6.4508 6.8483 6.8483 8.5041 8.5041 9.1731 9.1731 9.2011 9.2011 9.4870 9.4870 9.7239 9.7239 9.9147 9.9147 9.9478 9.9478 10.3203 10.3203 10.5454 10.5454 10.8736 10.8736 11.0645 11.0645 11.2110 11.2110 11.3040 11.3040 11.4180 11.4180 11.7246 11.7246 11.9300 11.9300 12.1254 12.1254 12.2094 12.2094 12.3718 12.3718 12.9274 12.9274 12.9650 12.9650 13.7834 13.7834 14.3970 14.3970 14.8982 14.8982 k = 0.0000 0.1624-0.0000 ( 3768 PWs) bands (ev): -1.9699 -1.9699 -0.3529 -0.3529 1.1208 1.1208 1.4239 1.4239 5.3885 5.3885 6.4643 6.4643 6.7932 6.7932 8.4609 8.4609 9.1596 9.1596 9.1750 9.1750 9.4755 9.4755 9.6884 9.6884 9.9456 9.9456 9.9912 9.9912 10.2844 10.2844 10.5840 10.5840 10.9174 10.9174 11.0791 11.0791 11.1957 11.1957 11.3063 11.3063 11.4239 11.4239 11.7421 11.7421 11.9118 11.9118 12.1206 12.1206 12.2079 12.2079 12.3798 12.3798 12.8385 12.8385 12.9593 12.9593 13.8095 13.8095 14.4321 14.4321 14.8064 14.8064 k = 0.0000 0.1522-0.0000 ( 3764 PWs) bands (ev): -2.0072 -2.0072 -0.3010 -0.3010 1.1302 1.1302 1.4333 1.4333 5.3941 5.3941 6.4188 6.4188 6.8015 6.8015 8.4151 8.4151 9.1346 9.1346 9.1585 9.1585 9.4663 9.4663 9.6541 9.6541 9.9721 9.9721 10.0348 10.0348 10.2502 10.2502 10.6203 10.6203 10.9600 10.9600 11.0934 11.0934 11.1814 11.1814 11.3095 11.3095 11.4298 11.4298 11.7589 11.7589 11.8940 11.8940 12.1161 12.1161 12.2055 12.2055 12.3866 12.3866 12.7506 12.7506 12.9555 12.9555 13.8232 13.8232 14.4836 14.4836 14.7192 14.7192 k = 0.0000 0.1421-0.0000 ( 3762 PWs) bands (ev): -2.0422 -2.0422 -0.2526 -0.2526 1.1427 1.1427 1.4419 1.4419 5.4021 5.4021 6.3337 6.3337 6.8542 6.8542 8.3675 8.3675 9.0997 9.0997 9.1497 9.1497 9.4592 9.4592 9.6210 9.6210 9.9937 9.9937 10.0778 10.0778 10.2192 10.2192 10.6542 10.6542 11.0011 11.0011 11.1078 11.1078 11.1683 11.1683 11.3135 11.3135 11.4353 11.4353 11.7750 11.7750 11.8769 11.8769 12.1117 12.1117 12.2020 12.2020 12.3922 12.3922 12.6651 12.6651 12.9525 12.9525 13.8266 13.8266 14.5469 14.5469 14.6382 14.6382 k = 0.0000 0.1319-0.0000 ( 3758 PWs) bands (ev): -2.0750 -2.0750 -0.2079 -0.2079 1.1581 1.1581 1.4497 1.4497 5.4122 5.4122 6.2344 6.2344 6.9263 6.9263 8.3190 8.3190 9.0600 9.0600 9.1434 9.1434 9.4541 9.4541 9.5893 9.5893 10.0094 10.0094 10.1169 10.1169 10.1954 10.1954 10.6854 10.6854 11.0396 11.0396 11.1228 11.1228 11.1570 11.1570 11.3181 11.3181 11.4405 11.4405 11.7901 11.7901 11.8604 11.8604 12.1074 12.1074 12.1971 12.1971 12.3965 12.3965 12.5823 12.5823 12.9500 12.9500 13.8227 13.8227 14.5521 14.5521 14.6298 14.6298 k = 0.0000 0.1218-0.0000 ( 3766 PWs) bands (ev): -2.1054 -2.1054 -0.1671 -0.1671 1.1762 1.1762 1.4567 1.4567 5.4242 5.4242 6.1323 6.1323 7.0068 7.0068 8.2704 8.2704 9.0163 9.0163 9.1386 9.1386 9.4506 9.4506 9.5589 9.5589 10.0177 10.0177 10.1374 10.1374 10.1956 10.1956 10.7139 10.7139 11.0731 11.0731 11.1393 11.1393 11.1490 11.1490 11.3233 11.3233 11.4452 11.4452 11.8036 11.8036 11.8454 11.8454 12.1033 12.1033 12.1902 12.1902 12.3997 12.3997 12.5033 12.5033 12.9480 12.9480 13.8141 13.8141 14.4822 14.4822 14.7074 14.7074 k = 0.0000 0.1116-0.0000 ( 3762 PWs) bands (ev): -2.1335 -2.1335 -0.1303 -0.1303 1.1968 1.1968 1.4630 1.4630 5.4377 5.4377 6.0317 6.0317 7.0918 7.0918 8.2223 8.2223 8.9686 8.9686 9.1353 9.1353 9.4486 9.4486 9.5302 9.5302 10.0162 10.0162 10.1337 10.1337 10.2277 10.2277 10.7395 10.7395 11.0953 11.0953 11.1475 11.1475 11.1608 11.1608 11.3291 11.3291 11.4494 11.4494 11.8117 11.8117 11.8357 11.8357 12.0991 12.0991 12.1804 12.1804 12.4018 12.4018 12.4294 12.4294 12.9464 12.9464 13.8028 13.8028 14.4157 14.4157 14.7896 14.7896 k = 0.0000 0.1015-0.0000 ( 3754 PWs) bands (ev): -2.1592 -2.1592 -0.0976 -0.0976 1.2194 1.2194 1.4686 1.4686 5.4522 5.4522 5.9350 5.9350 7.1792 7.1792 8.1754 8.1754 8.9171 8.9171 9.1333 9.1333 9.4476 9.4476 9.5032 9.5032 10.0048 10.0048 10.1302 10.1302 10.2679 10.2679 10.7622 10.7622 11.1006 11.1006 11.1575 11.1575 11.1879 11.1879 11.3355 11.3355 11.4529 11.4529 11.8059 11.8059 11.8400 11.8400 12.0946 12.0946 12.1658 12.1658 12.3629 12.3629 12.4030 12.4030 12.9452 12.9452 13.7902 13.7902 14.3547 14.3547 14.8714 14.8714 k = 0.0000 0.0913-0.0000 ( 3762 PWs) bands (ev): -2.1826 -2.1826 -0.0689 -0.0689 1.2433 1.2433 1.4735 1.4735 5.4673 5.4673 5.8437 5.8437 7.2678 7.2678 8.1305 8.1305 8.8620 8.8620 9.1325 9.1325 9.4466 9.4466 9.4790 9.4790 9.9862 9.9862 10.1311 10.1311 10.3088 10.3088 10.7819 10.7819 11.0966 11.0966 11.1722 11.1722 11.2193 11.2193 11.3423 11.3423 11.4558 11.4558 11.7937 11.7937 11.8504 11.8504 12.0886 12.0886 12.1436 12.1436 12.3081 12.3081 12.4030 12.4030 12.9441 12.9441 13.7772 13.7772 14.2996 14.2996 14.9498 14.9498 k = 0.0000 0.0812-0.0000 ( 3746 PWs) bands (ev): -2.2035 -2.2035 -0.0440 -0.0440 1.2679 1.2679 1.4777 1.4777 5.4826 5.4826 5.7589 5.7589 7.3569 7.3569 8.0883 8.0883 8.8036 8.8036 9.1329 9.1329 9.4406 9.4406 9.4626 9.4626 9.9645 9.9645 10.1346 10.1346 10.3486 10.3486 10.7990 10.7990 11.0904 11.0904 11.1877 11.1877 11.2519 11.2519 11.3497 11.3497 11.4580 11.4580 11.7811 11.7811 11.8612 11.8612 12.0752 12.0752 12.1165 12.1165 12.2689 12.2689 12.4024 12.4024 12.9437 12.9437 13.7645 13.7645 14.2505 14.2505 15.0223 15.0223 k = 0.0000 0.0710-0.0000 ( 3756 PWs) bands (ev): -2.2220 -2.2220 -0.0228 -0.0228 1.2923 1.2923 1.4814 1.4814 5.4976 5.4976 5.6816 5.6816 7.4456 7.4456 8.0493 8.0493 8.7421 8.7421 9.1341 9.1341 9.4239 9.4239 9.4593 9.4593 9.9421 9.9421 10.1390 10.1390 10.3863 10.3863 10.8133 10.8133 11.0839 11.0839 11.2029 11.2029 11.2831 11.2831 11.3583 11.3583 11.4595 11.4595 11.7691 11.7691 11.8710 11.8710 12.0402 12.0402 12.1003 12.1003 12.2438 12.2438 12.4013 12.4013 12.9433 12.9433 13.7527 13.7527 14.2074 14.2074 15.0863 15.0863 k = 0.0000 0.0609-0.0000 ( 3754 PWs) bands (ev): -2.2381 -2.2381 -0.0051 -0.0051 1.3158 1.3158 1.4844 1.4844 5.5118 5.5118 5.6126 5.6126 7.5330 7.5330 8.0144 8.0144 8.6783 8.6783 9.1362 9.1362 9.4048 9.4048 9.4611 9.4611 9.9206 9.9206 10.1434 10.1434 10.4211 10.4211 10.8253 10.8253 11.0778 11.0778 11.2179 11.2179 11.3109 11.3109 11.3693 11.3693 11.4608 11.4608 11.7581 11.7581 11.8793 11.8793 11.9909 11.9909 12.0941 12.0941 12.2281 12.2281 12.3997 12.3997 12.9430 12.9430 13.7419 13.7419 14.1704 14.1704 15.1395 15.1395 k = 0.0000 0.0507-0.0000 ( 3750 PWs) bands (ev): -2.2517 -2.2517 0.0094 0.0094 1.3375 1.3375 1.4870 1.4870 5.5242 5.5242 5.5533 5.5533 7.6178 7.6178 7.9843 7.9843 8.6131 8.6131 9.1388 9.1388 9.3871 9.3871 9.4641 9.4641 9.9010 9.9010 10.1472 10.1472 10.4523 10.4523 10.8349 10.8349 11.0726 11.0726 11.2319 11.2319 11.3319 11.3319 11.3850 11.3850 11.4622 11.4622 11.7483 11.7483 11.8833 11.8833 11.9416 11.9416 12.0908 12.0908 12.2175 12.2175 12.3980 12.3980 12.9428 12.9428 13.7326 13.7326 14.1393 14.1393 15.1806 15.1806 k = 0.0000 0.0406-0.0000 ( 3754 PWs) bands (ev): -2.2628 -2.2628 0.0209 0.0209 1.3565 1.3565 1.4890 1.4890 5.5015 5.5015 5.5372 5.5372 7.6979 7.6979 7.9599 7.9599 8.5479 8.5479 9.1417 9.1417 9.3715 9.3715 9.4673 9.4673 9.8841 9.8841 10.1504 10.1504 10.4792 10.4792 10.8425 10.8425 11.0682 11.0682 11.2447 11.2447 11.3449 11.3449 11.4052 11.4052 11.4651 11.4651 11.7399 11.7399 11.8677 11.8677 11.9124 11.9124 12.0886 12.0886 12.2099 12.2099 12.3963 12.3963 12.9427 12.9427 13.7246 13.7246 14.1139 14.1139 15.2097 15.2097 k = 0.0000 0.0304-0.0000 ( 3748 PWs) bands (ev): -2.2715 -2.2715 0.0296 0.0296 1.3721 1.3721 1.4905 1.4905 5.4622 5.4622 5.5460 5.5460 7.7697 7.7697 7.9431 7.9431 8.4852 8.4852 9.1447 9.1447 9.3588 9.3588 9.4703 9.4703 9.8702 9.8702 10.1529 10.1529 10.5011 10.5011 10.8482 10.8482 11.0648 11.0648 11.2556 11.2556 11.3522 11.3522 11.4240 11.4240 11.4720 11.4720 11.7330 11.7330 11.8282 11.8282 11.9104 11.9104 12.0870 12.0870 12.2046 12.2046 12.3948 12.3948 12.9426 12.9426 13.7183 13.7183 14.0944 14.0944 15.2286 15.2286 k = 0.0000 0.0203-0.0000 ( 3750 PWs) bands (ev): -2.2777 -2.2777 0.0357 0.0357 1.3838 1.3838 1.4916 1.4916 5.4334 5.4334 5.5529 5.5529 7.8255 7.8255 7.9371 7.9371 8.4296 8.4296 9.1471 9.1471 9.3493 9.3493 9.4728 9.4728 9.8600 9.8600 10.1547 10.1547 10.5172 10.5172 10.8522 10.8522 11.0623 11.0623 11.2640 11.2640 11.3563 11.3563 11.4351 11.4351 11.4850 11.4850 11.7275 11.7275 11.7909 11.7909 11.9128 11.9128 12.0859 12.0859 12.2009 12.2009 12.3935 12.3935 12.9425 12.9425 13.7138 13.7138 14.0804 14.0804 15.2397 15.2397 k = 0.0000 0.0101-0.0000 ( 3751 PWs) bands (ev): -2.2815 -2.2815 0.0393 0.0393 1.3910 1.3910 1.4923 1.4923 5.4160 5.4160 5.5571 5.5571 7.8552 7.8552 7.9445 7.9445 8.3887 8.3887 9.1488 9.1488 9.3434 9.3434 9.4744 9.4744 9.8537 9.8537 10.1558 10.1558 10.5271 10.5271 10.8546 10.8546 11.0608 11.0608 11.2692 11.2692 11.3584 11.3584 11.4395 11.4395 11.4988 11.4988 11.7233 11.7233 11.7650 11.7650 11.9148 11.9148 12.0854 12.0854 12.1986 12.1986 12.3927 12.3927 12.9424 12.9424 13.7110 13.7110 14.0721 14.0721 15.2454 15.2454 k = 0.0000 0.0000 0.0000 ( 3747 PWs) bands (ev): -2.2827 -2.2827 0.0405 0.0405 1.3934 1.3934 1.4925 1.4925 5.4102 5.4102 5.5585 5.5585 7.8625 7.8625 7.9515 7.9515 8.3732 8.3732 9.1494 9.1494 9.3414 9.3414 9.4749 9.4749 9.8516 9.8516 10.1561 10.1561 10.5304 10.5304 10.8554 10.8554 11.0604 11.0604 11.2712 11.2712 11.3590 11.3590 11.4406 11.4406 11.5048 11.5048 11.7215 11.7215 11.7559 11.7559 11.9155 11.9155 12.0852 12.0852 12.1979 12.1979 12.3924 12.3924 12.9424 12.9424 13.7101 13.7101 14.0694 14.0694 15.2472 15.2472 k = 0.0000 0.0000 0.0000 ( 3747 PWs) bands (ev): -2.2827 -2.2827 0.0405 0.0405 1.3934 1.3934 1.4925 1.4925 5.4102 5.4102 5.5585 5.5585 7.8625 7.8625 7.9515 7.9515 8.3732 8.3732 9.1494 9.1494 9.3414 9.3414 9.4749 9.4749 9.8516 9.8516 10.1561 10.1561 10.5304 10.5304 10.8554 10.8554 11.0604 11.0604 11.2712 11.2712 11.3590 11.3590 11.4406 11.4406 11.5048 11.5048 11.7215 11.7215 11.7559 11.7559 11.9155 11.9155 12.0852 12.0852 12.1979 12.1979 12.3924 12.3924 12.9424 12.9424 13.7101 13.7101 14.0694 14.0694 15.2472 15.2472 k = 0.0000 0.0000 0.0102 ( 3747 PWs) bands (ev): -2.2815 -2.2815 0.0362 0.0362 1.3939 1.3939 1.4944 1.4944 5.3948 5.3948 5.5786 5.5786 7.8551 7.8551 7.9452 7.9452 8.3849 8.3849 9.1499 9.1499 9.3417 9.3417 9.4750 9.4750 9.8525 9.8525 10.1561 10.1561 10.5309 10.5309 10.8540 10.8540 11.0590 11.0590 11.2687 11.2687 11.3619 11.3619 11.4384 11.4384 11.5000 11.5000 11.7220 11.7220 11.7566 11.7566 11.9144 11.9144 12.0894 12.0894 12.2001 12.2001 12.3912 12.3912 12.9429 12.9429 13.7110 13.7110 14.0690 14.0690 15.2465 15.2465 k = 0.0000 0.0000 0.0205 ( 3747 PWs) bands (ev): -2.2777 -2.2777 0.0236 0.0236 1.3953 1.3953 1.5001 1.5001 5.3624 5.3624 5.6252 5.6252 7.8276 7.8276 7.9352 7.9352 8.4159 8.4159 9.1513 9.1513 9.3426 9.3426 9.4753 9.4753 9.8551 9.8551 10.1560 10.1560 10.5324 10.5324 10.8498 10.8498 11.0548 11.0548 11.2624 11.2624 11.3686 11.3686 11.4325 11.4325 11.4864 11.4864 11.7234 11.7234 11.7586 11.7586 11.9112 11.9112 12.1006 12.1006 12.2076 12.2076 12.3874 12.3874 12.9445 12.9445 13.7135 13.7135 14.0678 14.0678 15.2440 15.2440 k = 0.0000 0.0000 0.0307 ( 3751 PWs) bands (ev): -2.2715 -2.2715 0.0030 0.0030 1.3977 1.3977 1.5093 1.5093 5.3270 5.3270 5.6844 5.6844 7.7771 7.7771 7.9327 7.9327 8.4580 8.4580 9.1537 9.1537 9.3441 9.3441 9.4760 9.4760 9.8596 9.8596 10.1556 10.1556 10.5349 10.5349 10.8418 10.8418 11.0481 11.0481 11.2551 11.2551 11.3733 11.3733 11.4261 11.4261 11.4667 11.4667 11.7255 11.7255 11.7613 11.7613 11.9059 11.9059 12.1144 12.1144 12.2231 12.2231 12.3810 12.3810 12.9471 12.9471 13.7178 13.7178 14.0655 14.0655 15.2387 15.2387 k = 0.0000 0.0000 0.0410 ( 3757 PWs) bands (ev): -2.2628 -2.2628 -0.0252 -0.0252 1.4010 1.4010 1.5214 1.5214 5.2934 5.2934 5.7512 5.7512 7.7102 7.7102 7.9374 7.9374 8.5045 8.5045 9.1569 9.1569 9.3461 9.3461 9.4775 9.4775 9.8657 9.8657 10.1550 10.1550 10.5384 10.5384 10.8295 10.8295 11.0388 11.0388 11.2492 11.2492 11.3675 11.3675 11.4228 11.4228 11.4466 11.4466 11.7277 11.7277 11.7645 11.7645 11.8988 11.8988 12.1259 12.1259 12.2496 12.2496 12.3723 12.3723 12.9509 12.9509 13.7238 13.7238 14.0619 14.0619 15.2290 15.2290 k = 0.0000 0.0000 0.0512 ( 3759 PWs) bands (ev): -2.2516 -2.2516 -0.0601 -0.0601 1.4053 1.4053 1.5359 1.5359 5.2633 5.2633 5.8239 5.8239 7.6336 7.6336 7.9470 7.9470 8.5510 8.5510 9.1611 9.1611 9.3487 9.3487 9.4804 9.4804 9.8734 9.8734 10.1542 10.1542 10.5427 10.5427 10.8119 10.8119 11.0271 11.0271 11.2462 11.2462 11.3490 11.3490 11.4072 11.4072 11.4455 11.4455 11.7297 11.7297 11.7676 11.7676 11.8905 11.8905 12.1330 12.1330 12.2873 12.2873 12.3614 12.3614 12.9558 12.9558 13.7314 13.7314 14.0566 14.0566 15.2134 15.2134 k = 0.0000 0.0000 0.0615 ( 3751 PWs) bands (ev): -2.2380 -2.2380 -0.1012 -0.1012 1.4104 1.4104 1.5520 1.5520 5.2373 5.2373 5.9017 5.9017 7.5508 7.5508 7.9603 7.9603 8.5948 8.5948 9.1662 9.1662 9.3517 9.3517 9.4851 9.4851 9.8827 9.8827 10.1527 10.1527 10.5478 10.5478 10.7883 10.7883 11.0133 11.0133 11.2465 11.2465 11.3229 11.3229 11.3804 11.3804 11.4589 11.4589 11.7312 11.7312 11.7698 11.7698 11.8817 11.8817 12.1365 12.1365 12.3343 12.3343 12.3486 12.3486 12.9620 12.9620 13.7407 13.7407 14.0493 14.0493 15.1911 15.1911 k = 0.0000 0.0000 0.0717 ( 3751 PWs) bands (ev): -2.2219 -2.2219 -0.1477 -0.1477 1.4165 1.4165 1.5692 1.5692 5.2158 5.2158 5.9842 5.9842 7.4640 7.4640 7.9766 7.9766 8.6339 8.6339 9.1722 9.1722 9.3552 9.3552 9.4924 9.4924 9.8935 9.8935 10.1505 10.1505 10.5536 10.5536 10.7583 10.7583 10.9977 10.9977 11.2488 11.2488 11.2941 11.2941 11.3514 11.3514 11.4757 11.4757 11.7317 11.7317 11.7700 11.7700 11.8736 11.8736 12.1375 12.1375 12.3339 12.3339 12.3878 12.3878 12.9694 12.9694 13.7516 13.7516 14.0395 14.0395 15.1620 15.1620 k = 0.0000 0.0000 0.0819 ( 3752 PWs) bands (ev): -2.2034 -2.2034 -0.1988 -0.1988 1.4234 1.4234 1.5869 1.5869 5.1990 5.1990 6.0712 6.0712 7.3745 7.3745 7.9958 7.9958 8.6669 8.6669 9.1791 9.1791 9.3591 9.3591 9.5029 9.5029 9.9055 9.9055 10.1471 10.1471 10.5599 10.5599 10.7224 10.7224 10.9803 10.9803 11.2442 11.2442 11.2719 11.2719 11.3227 11.3227 11.4938 11.4938 11.7313 11.7313 11.7665 11.7665 11.8679 11.8679 12.1368 12.1368 12.3176 12.3176 12.4463 12.4463 12.9781 12.9781 13.7641 13.7641 14.0268 14.0268 15.1265 15.1265 k = 0.0000 0.0000 0.0922 ( 3740 PWs) bands (ev): -2.1825 -2.1825 -0.2538 -0.2538 1.4311 1.4311 1.6043 1.6043 5.1870 5.1870 6.1623 6.1623 7.2832 7.2832 8.0176 8.0176 8.6931 8.6931 9.1868 9.1868 9.3633 9.3633 9.5172 9.5172 9.9187 9.9187 10.1419 10.1419 10.5665 10.5665 10.6811 10.6811 10.9615 10.9615 11.2188 11.2188 11.2628 11.2628 11.3029 11.3029 11.5128 11.5128 11.7299 11.7299 11.7582 11.7582 11.8660 11.8660 12.1349 12.1349 12.3001 12.3001 12.5086 12.5086 12.9882 12.9882 13.7779 13.7779 14.0110 14.0110 15.0854 15.0854 k = 0.0000 0.0000 0.1024 ( 3730 PWs) bands (ev): -2.1591 -2.1591 -0.3122 -0.3122 1.4397 1.4397 1.6212 1.6212 5.1797 5.1797 6.2574 6.2574 7.1908 7.1908 8.0419 8.0419 8.7117 8.7117 9.1954 9.1954 9.3679 9.3679 9.5357 9.5357 9.9328 9.9328 10.1341 10.1341 10.5731 10.5731 10.6358 10.6358 10.9416 10.9416 11.1872 11.1872 11.2391 11.2391 11.3054 11.3054 11.5319 11.5319 11.7271 11.7271 11.7452 11.7452 11.8681 11.8681 12.1321 12.1321 12.2816 12.2816 12.5737 12.5737 12.9996 12.9996 13.7928 13.7928 13.9921 13.9921 15.0395 15.0395 k = 0.0000 0.0000 0.1127 ( 3724 PWs) bands (ev): -2.1334 -2.1334 -0.3732 -0.3732 1.4490 1.4490 1.6369 1.6369 5.1773 5.1773 6.3561 6.3561 7.0978 7.0978 8.0687 8.0687 8.7227 8.7227 9.2046 9.2046 9.3724 9.3724 9.5584 9.5584 9.9478 9.9478 10.1225 10.1225 10.5763 10.5763 10.5911 10.5911 10.9208 10.9208 11.1547 11.1547 11.2072 11.2072 11.3186 11.3186 11.5509 11.5509 11.7198 11.7198 11.7315 11.7315 11.8734 11.8734 12.1285 12.1285 12.2620 12.2620 12.6413 12.6413 13.0124 13.0124 13.8079 13.8079 13.9708 13.9708 14.9893 14.9893 k = 0.0000 0.0000 0.1229 ( 3736 PWs) bands (ev): -2.1052 -2.1052 -0.4365 -0.4365 1.4590 1.4590 1.6513 1.6513 5.1798 5.1798 6.4580 6.4580 7.0047 7.0047 8.0979 8.0979 8.7260 8.7260 9.2144 9.2144 9.3770 9.3770 9.5853 9.5853 9.9633 9.9633 10.1053 10.1053 10.5369 10.5369 10.5881 10.5881 10.8991 10.8991 11.1212 11.1212 11.1748 11.1748 11.3348 11.3348 11.5692 11.5692 11.7011 11.7011 11.7252 11.7252 11.8809 11.8809 12.1242 12.1242 12.2419 12.2419 12.7107 12.7107 13.0266 13.0266 13.8213 13.8213 13.9493 13.9493 14.9351 14.9351 k = 0.0000 0.0000 0.1332 ( 3744 PWs) bands (ev): -2.0748 -2.0748 -0.5015 -0.5015 1.4697 1.4697 1.6640 1.6640 5.1870 5.1870 6.5625 6.5625 6.9124 6.9124 8.1294 8.1294 8.7221 8.7221 9.2248 9.2248 9.3815 9.3815 9.6159 9.6159 9.9791 9.9791 10.0802 10.0802 10.4904 10.4904 10.5937 10.5937 10.8770 10.8770 11.0855 11.0855 11.1455 11.1455 11.3521 11.3521 11.5864 11.5864 11.6773 11.6773 11.7221 11.7221 11.8900 11.8900 12.1190 12.1190 12.2215 12.2215 12.7819 12.7819 13.0422 13.0422 13.8278 13.8278 13.9333 13.9333 14.8775 14.8775 k = 0.0000 0.0000 0.1434 ( 3748 PWs) bands (ev): -2.0420 -2.0420 -0.5678 -0.5678 1.4810 1.4810 1.6749 1.6749 5.1990 5.1990 6.6670 6.6670 6.8234 6.8234 8.1634 8.1634 8.7116 8.7116 9.2356 9.2356 9.3858 9.3858 9.6497 9.6497 9.9950 9.9950 10.0450 10.0450 10.4488 10.4488 10.5988 10.5988 10.8546 10.8546 11.0465 11.0465 11.1215 11.1215 11.3696 11.3696 11.6015 11.6015 11.6514 11.6514 11.7206 11.7206 11.9000 11.9000 12.1130 12.1130 12.2010 12.2010 12.8544 12.8544 13.0593 13.0593 13.8191 13.8191 13.9318 13.9318 14.8168 14.8168 k = 0.0000 0.0000 0.1536 ( 3748 PWs) bands (ev): -2.0070 -2.0070 -0.6351 -0.6351 1.4928 1.4928 1.6838 1.6838 5.2157 5.2157 6.7098 6.7098 6.7992 6.7992 8.1997 8.1997 8.6949 8.6949 9.2468 9.2468 9.3898 9.3898 9.6859 9.6859 9.9945 9.9945 10.0139 10.0139 10.4145 10.4145 10.6029 10.6029 10.8322 10.8322 11.0044 11.0044 11.1035 11.1035 11.3869 11.3869 11.6107 11.6107 11.6268 11.6268 11.7214 11.7214 11.9105 11.9105 12.1059 12.1059 12.1809 12.1809 12.9282 12.9282 13.0777 13.0777 13.7950 13.7950 13.9459 13.9459 14.7535 14.7535 k = 0.0000 0.0000 0.1639 ( 3752 PWs) bands (ev): -1.9697 -1.9697 -0.7030 -0.7030 1.5051 1.5051 1.6907 1.6907 5.2371 5.2371 6.6285 6.6285 6.9022 6.9022 8.2385 8.2385 8.6725 8.6725 9.2584 9.2584 9.3934 9.3934 9.7233 9.7233 9.9363 9.9363 10.0282 10.0282 10.3886 10.3886 10.6059 10.6059 10.8099 10.8099 10.9598 10.9598 11.0912 11.0912 11.4034 11.4034 11.5916 11.5916 11.6252 11.6252 11.7256 11.7256 11.9214 11.9214 12.0973 12.0973 12.1617 12.1617 13.0026 13.0026 13.0977 13.0977 13.7622 13.7622 13.9697 13.9697 14.6877 14.6877 k = 0.0000 0.0000 0.1741 ( 3754 PWs) bands (ev): -1.9301 -1.9301 -0.7712 -0.7712 1.5179 1.5179 1.6955 1.6955 5.2631 5.2631 6.5400 6.5400 7.0153 7.0153 8.2798 8.2798 8.6451 8.6451 9.2701 9.2701 9.3964 9.3964 9.7582 9.7582 9.8690 9.8690 10.0435 10.0435 10.3707 10.3707 10.6076 10.6076 10.7880 10.7880 10.9136 10.9136 11.0846 11.0846 11.4188 11.4188 11.5628 11.5628 11.6281 11.6281 11.7339 11.7339 11.9324 11.9324 12.0867 12.0867 12.1440 12.1440 13.0762 13.0762 13.1205 13.1205 13.7256 13.7256 13.9990 13.9990 14.6199 14.6199 k = 0.0000 0.0000 0.1844 ( 3756 PWs) bands (ev): -1.8884 -1.8884 -0.8395 -0.8395 1.5310 1.5310 1.6983 1.6983 5.2935 5.2935 6.4519 6.4519 7.1306 7.1306 8.3239 8.3239 8.6128 8.6128 9.2820 9.2820 9.3986 9.3986 9.7547 9.7547 9.8310 9.8310 10.0582 10.0582 10.3592 10.3592 10.6083 10.6083 10.7668 10.7668 10.8661 10.8661 11.0831 11.0831 11.4323 11.4323 11.5340 11.5340 11.6275 11.6275 11.7457 11.7457 11.9436 11.9436 12.0736 12.0736 12.1284 12.1284 13.1316 13.1316 13.1635 13.1635 13.6875 13.6875 14.0324 14.0324 14.5503 14.5503 k = 0.0000 0.0000 0.1946 ( 3750 PWs) bands (ev): -1.8446 -1.8446 -0.9076 -0.9076 1.5443 1.5443 1.6992 1.6992 5.3282 5.3282 6.3650 6.3650 7.2466 7.2466 8.3707 8.3707 8.5759 8.5759 9.2939 9.2939 9.4002 9.4002 9.6775 9.6775 9.8595 9.8595 10.0719 10.0719 10.3530 10.3530 10.6081 10.6081 10.7462 10.7462 10.8180 10.8180 11.0866 11.0866 11.4413 11.4413 11.5084 11.5084 11.6239 11.6239 11.7601 11.7601 11.9548 11.9548 12.0580 12.0580 12.1151 12.1151 13.1585 13.1585 13.2367 13.2367 13.6490 13.6490 14.0693 14.0693 14.4792 14.4792 k = 0.0000 0.0000 0.2048 ( 3754 PWs) bands (ev): -1.7987 -1.7987 -0.9752 -0.9752 1.5578 1.5578 1.6981 1.6981 5.3672 5.3672 6.2799 6.2799 7.3626 7.3626 8.4205 8.4205 8.5345 8.5345 9.3057 9.3057 9.4007 9.4007 9.5842 9.5842 9.8984 9.8984 10.0843 10.0843 10.3511 10.3511 10.6075 10.6075 10.7266 10.7266 10.7697 10.7697 11.0947 11.0947 11.4378 11.4378 11.4940 11.4940 11.6182 11.6182 11.7759 11.7759 11.9658 11.9658 12.0403 12.0403 12.1037 12.1037 13.1829 13.1829 13.3139 13.3139 13.6109 13.6109 14.1090 14.1090 14.4069 14.4069 k = 0.0000 0.0000 0.2151 ( 3756 PWs) bands (ev): -1.7507 -1.7507 -1.0423 -1.0423 1.5714 1.5714 1.6952 1.6952 5.4103 5.4103 6.1966 6.1966 7.4776 7.4776 8.4706 8.4706 8.4919 8.4919 9.3173 9.3173 9.3999 9.3999 9.4859 9.4859 9.9378 9.9378 10.0952 10.0952 10.3529 10.3529 10.6067 10.6067 10.7080 10.7080 10.7219 10.7219 11.1068 11.1068 11.4172 11.4172 11.4959 11.4959 11.6113 11.6113 11.7927 11.7927 11.9766 11.9766 12.0212 12.0212 12.0935 12.0935 13.2078 13.2078 13.3920 13.3920 13.5736 13.5736 14.1511 14.1511 14.3343 14.3343 k = 0.0000 0.0000 0.2253 ( 3756 PWs) bands (ev): -1.7008 -1.7008 -1.1086 -1.1086 1.5849 1.5849 1.6907 1.6907 5.4574 5.4574 6.1154 6.1154 7.5908 7.5908 8.4357 8.4357 8.5332 8.5332 9.3286 9.3286 9.3801 9.3801 9.4031 9.4031 9.9757 9.9757 10.1041 10.1041 10.3585 10.3585 10.6055 10.6055 10.6750 10.6750 10.6909 10.6909 11.1225 11.1225 11.3890 11.3890 11.5047 11.5047 11.6034 11.6034 11.8100 11.8100 11.9873 11.9873 12.0016 12.0016 12.0839 12.0839 13.2334 13.2334 13.4705 13.4705 13.5375 13.5375 14.1908 14.1908 14.2660 14.2660 k = 0.0000 0.0000 0.2356 ( 3758 PWs) bands (ev): -1.6489 -1.6489 -1.1740 -1.1740 1.5983 1.5983 1.6846 1.6846 5.5083 5.5083 6.0366 6.0366 7.7011 7.7011 8.3796 8.3796 8.5950 8.5950 9.2812 9.2812 9.3394 9.3394 9.3975 9.3975 10.0109 10.0109 10.1107 10.1107 10.3682 10.3682 10.6009 10.6009 10.6337 10.6337 10.6752 10.6752 11.1412 11.1412 11.3587 11.3587 11.5153 11.5153 11.5950 11.5950 11.8278 11.8278 11.9814 11.9814 11.9980 11.9980 12.0747 12.0747 13.2597 13.2597 13.5012 13.5012 13.5506 13.5506 14.1702 14.1702 14.2600 14.2600 k = 0.0000 0.0000 0.2458 ( 3752 PWs) bands (ev): -1.5952 -1.5952 -1.2384 -1.2384 1.6114 1.6114 1.6772 1.6772 5.5630 5.5630 5.9602 5.9602 7.8073 7.8073 8.3177 8.3177 8.6621 8.6621 9.1806 9.1806 9.3497 9.3497 9.3937 9.3937 10.0421 10.0421 10.1145 10.1145 10.3827 10.3827 10.5739 10.5739 10.6175 10.6175 10.6610 10.6610 11.1628 11.1628 11.3281 11.3281 11.5262 11.5262 11.5861 11.5861 11.8459 11.8459 11.9615 11.9615 12.0083 12.0083 12.0657 12.0657 13.2868 13.2868 13.4678 13.4678 13.6292 13.6292 14.0984 14.0984 14.3075 14.3075 k = 0.0000 0.0000 0.2561 ( 3752 PWs) bands (ev): -1.5397 -1.5397 -1.3015 -1.3015 1.6242 1.6242 1.6685 1.6685 5.6212 5.6212 5.8865 5.8865 7.9086 7.9086 8.2494 8.2494 8.7347 8.7347 9.0821 9.0821 9.3593 9.3593 9.3888 9.3888 10.0681 10.0681 10.1149 10.1149 10.4024 10.4024 10.5336 10.5336 10.6181 10.6181 10.6486 10.6486 11.1865 11.1865 11.2978 11.2978 11.5370 11.5370 11.5769 11.5769 11.8643 11.8643 11.9416 11.9416 12.0183 12.0183 12.0566 12.0566 13.3146 13.3146 13.4351 13.4351 13.7083 13.7083 14.0221 14.0221 14.3616 14.3616 k = 0.0000 0.0000 0.2663 ( 3760 PWs) bands (ev): -1.4825 -1.4825 -1.3633 -1.3633 1.6364 1.6364 1.6587 1.6587 5.6828 5.6828 5.8156 5.8156 8.0039 8.0039 8.1745 8.1745 8.8132 8.8132 8.9874 8.9874 9.3682 9.3682 9.3830 9.3830 10.0882 10.0882 10.1111 10.1111 10.4278 10.4278 10.4943 10.4943 10.6226 10.6226 10.6380 10.6380 11.2122 11.2122 11.2681 11.2681 11.5473 11.5473 11.5673 11.5673 11.8831 11.8831 11.9217 11.9217 12.0282 12.0282 12.0473 12.0473 13.3432 13.3432 13.4035 13.4035 13.7873 13.7873 13.9444 13.9444 14.4190 14.4190 k = 0.0000 0.0000 0.2765 ( 3760 PWs) bands (ev): -1.4236 -1.4236 -1.4236 -1.4236 1.6479 1.6479 1.6479 1.6479 5.7476 5.7476 5.7476 5.7476 8.0927 8.0927 8.0927 8.0927 8.8975 8.8975 8.8975 8.8975 9.3761 9.3761 9.3761 9.3761 10.1025 10.1025 10.1025 10.1025 10.4587 10.4587 10.4587 10.4587 10.6293 10.6293 10.6293 10.6293 11.2395 11.2395 11.2395 11.2395 11.5575 11.5575 11.5575 11.5575 11.9022 11.9022 11.9022 11.9022 12.0378 12.0378 12.0378 12.0378 13.3729 13.3729 13.3729 13.3729 13.8661 13.8661 13.8661 13.8661 14.4790 14.4790 k = 0.0000 0.0000 0.2765 ( 3760 PWs) bands (ev): -1.4236 -1.4236 -1.4236 -1.4236 1.6479 1.6479 1.6479 1.6479 5.7476 5.7476 5.7476 5.7476 8.0927 8.0927 8.0927 8.0927 8.8975 8.8975 8.8975 8.8975 9.3761 9.3761 9.3761 9.3761 10.1025 10.1025 10.1025 10.1025 10.4587 10.4587 10.4587 10.4587 10.6293 10.6293 10.6293 10.6293 11.2395 11.2395 11.2395 11.2395 11.5575 11.5575 11.5575 11.5575 11.9022 11.9022 11.9022 11.9022 12.0378 12.0378 12.0378 12.0378 13.3729 13.3729 13.3729 13.3729 13.8661 13.8661 13.8661 13.8661 14.4790 14.4790 k = 0.0104-0.0000 0.2765 ( 3768 PWs) bands (ev): -1.4223 -1.4223 -1.4223 -1.4223 1.6484 1.6484 1.6485 1.6485 5.7488 5.7488 5.7493 5.7493 8.0929 8.0929 8.0936 8.0936 8.8960 8.8960 8.8963 8.8963 9.3728 9.3728 9.3749 9.3749 10.0961 10.0961 10.1022 10.1022 10.4564 10.4564 10.4581 10.4581 10.6247 10.6247 10.6302 10.6302 11.2390 11.2390 11.2435 11.2435 11.5587 11.5587 11.5592 11.5592 11.9014 11.9014 11.9018 11.9018 12.0384 12.0384 12.0386 12.0386 13.3720 13.3720 13.3734 13.3734 13.8526 13.8526 13.8639 13.8639 14.4838 14.4838 k = 0.0208-0.0000 0.2765 ( 3770 PWs) bands (ev): -1.4184 -1.4184 -1.4184 -1.4184 1.6498 1.6498 1.6500 1.6500 5.7528 5.7528 5.7539 5.7539 8.0943 8.0943 8.0958 8.0958 8.8916 8.8916 8.8924 8.8924 9.3651 9.3651 9.3694 9.3694 10.0833 10.0833 10.0953 10.0953 10.4516 10.4516 10.4548 10.4548 10.6169 10.6169 10.6275 10.6275 11.2421 11.2421 11.2510 11.2510 11.5630 11.5630 11.5640 11.5640 11.8994 11.8994 11.9004 11.9004 12.0404 12.0404 12.0409 12.0409 13.3706 13.3706 13.3736 13.3736 13.8260 13.8260 13.8467 13.8467 14.5068 14.5068 k = 0.0312-0.0000 0.2765 ( 3766 PWs) bands (ev): -1.4120 -1.4120 -1.4119 -1.4119 1.6522 1.6522 1.6525 1.6525 5.7597 5.7597 5.7614 5.7614 8.0968 8.0968 8.0991 8.0991 8.8845 8.8845 8.8857 8.8857 9.3527 9.3527 9.3591 9.3591 10.0644 10.0644 10.0820 10.0820 10.4446 10.4446 10.4489 10.4489 10.6063 10.6063 10.6214 10.6214 11.2484 11.2484 11.2617 11.2617 11.5700 11.5700 11.5715 11.5715 11.8965 11.8965 11.8981 11.8981 12.0437 12.0437 12.0446 12.0446 13.3687 13.3687 13.3734 13.3734 13.7902 13.7902 13.8178 13.8178 14.5448 14.5448 k = 0.0417-0.0000 0.2765 ( 3774 PWs) bands (ev): -1.4029 -1.4029 -1.4029 -1.4029 1.6556 1.6556 1.6559 1.6559 5.7694 5.7694 5.7717 5.7717 8.1003 8.1003 8.1035 8.1035 8.8747 8.8747 8.8764 8.8764 9.3350 9.3350 9.3434 9.3434 10.0403 10.0403 10.0629 10.0629 10.4359 10.4359 10.4410 10.4410 10.5935 10.5935 10.6124 10.6124 11.2576 11.2576 11.2753 11.2753 11.5793 11.5793 11.5814 11.5814 11.8926 11.8926 11.8951 11.8951 12.0479 12.0479 12.0492 12.0492 13.3660 13.3660 13.3726 13.3726 13.7492 13.7492 13.7812 13.7812 14.5937 14.5937 k = 0.0521-0.0000 0.2765 ( 3778 PWs) bands (ev): -1.3912 -1.3912 -1.3912 -1.3912 1.6599 1.6599 1.6603 1.6603 5.7820 5.7820 5.7849 5.7849 8.1046 8.1046 8.1088 8.1088 8.8621 8.8621 8.8644 8.8644 9.3114 9.3114 9.3217 9.3217 10.0120 10.0120 10.0389 10.0389 10.4258 10.4258 10.4313 10.4313 10.5793 10.5793 10.6011 10.6011 11.2693 11.2693 11.2912 11.2912 11.5904 11.5904 11.5931 11.5931 11.8881 11.8881 11.8917 11.8917 12.0530 12.0530 12.0549 12.0549 13.3621 13.3621 13.3712 13.3712 13.7062 13.7062 13.7404 13.7404 14.6499 14.6499 k = 0.0625-0.0000 0.2765 ( 3774 PWs) bands (ev): -1.3770 -1.3770 -1.3769 -1.3769 1.6651 1.6651 1.6656 1.6656 5.7975 5.7975 5.8009 5.8009 8.1095 8.1095 8.1148 8.1148 8.8468 8.8468 8.8499 8.8499 9.2812 9.2812 9.2931 9.2931 9.9811 9.9811 10.0114 10.0114 10.4145 10.4145 10.4201 10.4201 10.5645 10.5645 10.5884 10.5884 11.2827 11.2827 11.3090 11.3090 11.6028 11.6028 11.6063 11.6063 11.8832 11.8832 11.8881 11.8881 12.0587 12.0587 12.0614 12.0614 13.3567 13.3567 13.3688 13.3688 13.6638 13.6638 13.6984 13.6984 14.7108 14.7108 k = 0.0729-0.0000 0.2765 ( 3774 PWs) bands (ev): -1.3601 -1.3601 -1.3601 -1.3601 1.6712 1.6712 1.6718 1.6718 5.8158 5.8158 5.8198 5.8198 8.1146 8.1146 8.1212 8.1212 8.8288 8.8288 8.8329 8.8329 9.2439 9.2439 9.2570 9.2570 9.9491 9.9491 9.9819 9.9819 10.4018 10.4018 10.4073 10.4073 10.5498 10.5498 10.5752 10.5752 11.2975 11.2975 11.3280 11.3280 11.6160 11.6160 11.6205 11.6205 11.8782 11.8782 11.8846 11.8846 12.0648 12.0648 12.0684 12.0684 13.3488 13.3488 13.3647 13.3647 13.6240 13.6240 13.6573 13.6573 14.7742 14.7742 k = 0.0833-0.0000 0.2765 ( 3778 PWs) bands (ev): -1.3408 -1.3408 -1.3407 -1.3407 1.6781 1.6781 1.6788 1.6788 5.8369 5.8369 5.8414 5.8414 8.1195 8.1195 8.1276 8.1276 8.8079 8.8079 8.8132 8.8132 9.1993 9.1993 9.2132 9.2132 9.9175 9.9175 9.9518 9.9518 10.3877 10.3877 10.3926 10.3926 10.5361 10.5361 10.5621 10.5621 11.3130 11.3130 11.3476 11.3476 11.6298 11.6298 11.6354 11.6354 11.8733 11.8733 11.8813 11.8813 12.0712 12.0712 12.0759 12.0759 13.3378 13.3378 13.3584 13.3584 13.5883 13.5883 13.6189 13.6189 14.8390 14.8390 k = 0.0938-0.0000 0.2765 ( 3778 PWs) bands (ev): -1.3188 -1.3188 -1.3188 -1.3188 1.6858 1.6858 1.6866 1.6866 5.8607 5.8607 5.8659 5.8659 8.1236 8.1236 8.1334 8.1334 8.7839 8.7839 8.7908 8.7908 9.1478 9.1478 9.1621 9.1621 9.8876 9.8876 9.9225 9.9225 10.3719 10.3719 10.3759 10.3759 10.5239 10.5239 10.5498 10.5498 11.3286 11.3286 11.3674 11.3674 11.6438 11.6438 11.6506 11.6506 11.8687 11.8687 11.8786 11.8786 12.0777 12.0777 12.0836 12.0836 13.3228 13.3228 13.3491 13.3491 13.5582 13.5582 13.5847 13.5847 14.9041 14.9041 k = 0.1042-0.0000 0.2765 ( 3774 PWs) bands (ev): -1.2944 -1.2944 -1.2943 -1.2943 1.6942 1.6942 1.6950 1.6950 5.8874 5.8874 5.8932 5.8932 8.1260 8.1260 8.1378 8.1378 8.7564 8.7564 8.7653 8.7653 9.0909 9.0909 9.1050 9.1050 9.8602 9.8602 9.8950 9.8950 10.3543 10.3543 10.3572 10.3572 10.5136 10.5136 10.5388 10.5388 11.3440 11.3440 11.3869 11.3869 11.6576 11.6576 11.6660 11.6660 11.8645 11.8645 11.8765 11.8765 12.0845 12.0845 12.0917 12.0917 13.3035 13.3035 13.3357 13.3357 13.5344 13.5344 13.5560 13.5560 14.9687 14.9688 k = 0.1146-0.0000 0.2765 ( 3770 PWs) bands (ev): -1.2674 -1.2674 -1.2674 -1.2674 1.7032 1.7032 1.7042 1.7042 5.9168 5.9168 5.9232 5.9232 8.1255 8.1255 8.1396 8.1396 8.7248 8.7248 8.7362 8.7362 9.0308 9.0308 9.0444 9.0444 9.8356 9.8356 9.8698 9.8698 10.3352 10.3352 10.3365 10.3365 10.5050 10.5050 10.5291 10.5291 11.3587 11.3587 11.4055 11.4055 11.6713 11.6713 11.6813 11.6813 11.8612 11.8612 11.8754 11.8754 12.0912 12.0912 12.0998 12.0998 13.2800 13.2800 13.3177 13.3177 13.5167 13.5167 13.5337 13.5337 15.0325 15.0325 k = 0.1250-0.0000 0.2765 ( 3754 PWs) bands (ev): -1.2379 -1.2379 -1.2379 -1.2379 1.7128 1.7128 1.7138 1.7138 5.9489 5.9489 5.9559 5.9559 8.1202 8.1202 8.1370 8.1370 8.6886 8.6886 8.7028 8.7028 8.9708 8.9708 8.9837 8.9837 9.8136 9.8136 9.8469 9.8469 10.3143 10.3143 10.3146 10.3146 10.4979 10.4979 10.5208 10.5208 11.3722 11.3722 11.4228 11.4228 11.6846 11.6846 11.6964 11.6964 11.8588 11.8588 11.8752 11.8752 12.0979 12.0979 12.1081 12.1081 13.2533 13.2533 13.2953 13.2953 13.5043 13.5043 13.5177 13.5177 15.0946 15.0947 k = 0.1354-0.0000 0.2765 ( 3746 PWs) bands (ev): -1.2059 -1.2059 -1.2059 -1.2059 1.7229 1.7229 1.7240 1.7240 5.9837 5.9837 5.9914 5.9914 8.1079 8.1079 8.1274 8.1274 8.6475 8.6475 8.6647 8.6647 8.9147 8.9147 8.9270 8.9270 9.7939 9.7939 9.8260 9.8260 10.2909 10.2909 10.2928 10.2928 10.4920 10.4920 10.5136 10.5136 11.3844 11.3844 11.4384 11.4384 11.6974 11.6974 11.7109 11.7109 11.8575 11.8575 11.8762 11.8762 12.1045 12.1045 12.1163 12.1163 13.2244 13.2244 13.2693 13.2693 13.4962 13.4962 13.5070 13.5070 15.1545 15.1547 k = 0.1458-0.0000 0.2765 ( 3752 PWs) bands (ev): -1.1715 -1.1715 -1.1715 -1.1715 1.7333 1.7333 1.7345 1.7345 6.0211 6.0211 6.0294 6.0294 8.0854 8.0854 8.1074 8.1074 8.6029 8.6029 8.6224 8.6224 8.8656 8.8656 8.8777 8.8777 9.7758 9.7758 9.8067 9.8067 10.2666 10.2666 10.2701 10.2701 10.4870 10.4870 10.5073 10.5073 11.3947 11.3947 11.4517 11.4517 11.7095 11.7095 11.7247 11.7247 11.8573 11.8573 11.8784 11.8784 12.1109 12.1109 12.1245 12.1245 13.1941 13.1941 13.2407 13.2407 13.4912 13.4912 13.5007 13.5007 15.2085 15.2092 k = 0.1562-0.0000 0.2765 ( 3748 PWs) bands (ev): -1.1346 -1.1346 -1.1346 -1.1346 1.7440 1.7440 1.7453 1.7453 6.0611 6.0611 6.0701 6.0701 8.0494 8.0494 8.0731 8.0731 8.5584 8.5584 8.5784 8.5784 8.8254 8.8254 8.8383 8.8383 9.7590 9.7590 9.7888 9.7888 10.2419 10.2419 10.2469 10.2469 10.4824 10.4824 10.5016 10.5016 11.4034 11.4034 11.4630 11.4630 11.7210 11.7210 11.7378 11.7378 11.8585 11.8585 11.8820 11.8820 12.1174 12.1174 12.1328 12.1328 13.1633 13.1633 13.2105 13.2105 13.4885 13.4885 13.4973 13.4973 15.2369 15.2437 k = 0.1667-0.0000 0.2765 ( 3744 PWs) bands (ev): -1.0954 -1.0954 -1.0953 -1.0953 1.7549 1.7549 1.7563 1.7563 6.1037 6.1037 6.1134 6.1134 7.9974 7.9974 8.0214 8.0214 8.5178 8.5178 8.5364 8.5364 8.7942 8.7942 8.8087 8.8087 9.7430 9.7430 9.7717 9.7717 10.2170 10.2170 10.2235 10.2235 10.4779 10.4779 10.4961 10.4961 11.4103 11.4103 11.4718 11.4718 11.7318 11.7318 11.7498 11.7498 11.8611 11.8611 11.8870 11.8870 12.1238 12.1238 12.1411 12.1411 13.1324 13.1324 13.1796 13.1796 13.4873 13.4873 13.4962 13.4962 15.2406 15.2424 k = 0.1771-0.0000 0.2765 ( 3742 PWs) bands (ev): -1.0537 -1.0537 -1.0536 -1.0536 1.7658 1.7658 1.7673 1.7673 6.1488 6.1488 6.1592 6.1592 7.9287 7.9287 7.9517 7.9517 8.4831 8.4831 8.4985 8.4985 8.7718 8.7718 8.7885 8.7885 9.7273 9.7273 9.7552 9.7552 10.1922 10.1922 10.2001 10.2001 10.4733 10.4733 10.4906 10.4906 11.4154 11.4154 11.4783 11.4783 11.7417 11.7417 11.7606 11.7606 11.8650 11.8650 11.8934 11.8934 12.1301 12.1301 12.1494 12.1494 13.1015 13.1015 13.1482 13.1482 13.4873 13.4873 13.4967 13.4967 15.1710 15.1711 k = 0.1875-0.0000 0.2765 ( 3742 PWs) bands (ev): -1.0097 -1.0097 -1.0096 -1.0096 1.7765 1.7765 1.7782 1.7782 6.1964 6.1964 6.2075 6.2075 7.8448 7.8448 7.8660 7.8660 8.4534 8.4534 8.4649 8.4649 8.7577 8.7577 8.7767 8.7767 9.7117 9.7117 9.7389 9.7389 10.1677 10.1677 10.1770 10.1770 10.4684 10.4684 10.4848 10.4848 11.4187 11.4187 11.4824 11.4824 11.7507 11.7507 11.7701 11.7701 11.8701 11.8701 11.9010 11.9010 12.1363 12.1363 12.1577 12.1577 13.0710 13.0710 13.1167 13.1167 13.4883 13.4883 13.4983 13.4983 15.0812 15.0812 k = 0.1979-0.0000 0.2765 ( 3746 PWs) bands (ev): -0.9634 -0.9634 -0.9633 -0.9633 1.7870 1.7870 1.7887 1.7887 6.2463 6.2463 6.2582 6.2582 7.7489 7.7489 7.7681 7.7681 8.4265 8.4265 8.4342 8.4342 8.7515 8.7515 8.7725 8.7725 9.6959 9.6959 9.7225 9.7225 10.1435 10.1435 10.1543 10.1543 10.4628 10.4628 10.4786 10.4786 11.4205 11.4205 11.4843 11.4843 11.7589 11.7589 11.7783 11.7783 11.8761 11.8761 11.9096 11.9096 12.1425 12.1425 12.1661 12.1661 13.0406 13.0406 13.0851 13.0851 13.4899 13.4899 13.5008 13.5008 14.9885 14.9885 k = 0.2083-0.0000 0.2765 ( 3738 PWs) bands (ev): -0.9148 -0.9148 -0.9147 -0.9147 1.7971 1.7971 1.7989 1.7989 6.2985 6.2985 6.3112 6.3112 7.6441 7.6441 7.6615 7.6615 8.4000 8.4000 8.4048 8.4048 8.7526 8.7526 8.7753 8.7753 9.6796 9.6796 9.7058 9.7058 10.1199 10.1199 10.1321 10.1321 10.4566 10.4566 10.4718 10.4718 11.4209 11.4209 11.4843 11.4843 11.7662 11.7662 11.7853 11.7853 11.8829 11.8829 11.9190 11.9190 12.1489 12.1489 12.1745 12.1745 13.0104 13.0104 13.0535 13.0535 13.4920 13.4920 13.5040 13.5040 14.8968 14.8968 k = 0.2188-0.0000 0.2765 ( 3744 PWs) bands (ev): -0.8640 -0.8640 -0.8638 -0.8638 1.8065 1.8065 1.8084 1.8084 6.3530 6.3530 6.3664 6.3664 7.5332 7.5332 7.5492 7.5492 8.3725 8.3725 8.3754 8.3754 8.7603 8.7603 8.7840 8.7840 9.6627 9.6627 9.6886 9.6886 10.0969 10.0969 10.1105 10.1105 10.4493 10.4493 10.4640 10.4640 11.4201 11.4201 11.4826 11.4826 11.7726 11.7726 11.7912 11.7912 11.8901 11.8901 11.9288 11.9288 12.1552 12.1552 12.1829 12.1829 12.9803 12.9803 13.0218 13.0218 13.4945 13.4945 13.5075 13.5075 14.8077 14.8077 k = 0.2292-0.0000 0.2765 ( 3748 PWs) bands (ev): -0.8109 -0.8109 -0.8108 -0.8108 1.8151 1.8151 1.8171 1.8171 6.4096 6.4096 6.4237 6.4237 7.4185 7.4185 7.4334 7.4334 8.3434 8.3434 8.3454 8.3454 8.7735 8.7735 8.7977 8.7977 9.6451 9.6451 9.6708 9.6708 10.0746 10.0746 10.0896 10.0896 10.4410 10.4410 10.4551 10.4551 11.4182 11.4182 11.4794 11.4794 11.7781 11.7781 11.7961 11.7961 11.8974 11.8974 11.9386 11.9386 12.1615 12.1615 12.1911 12.1911 12.9502 12.9502 12.9900 12.9900 13.4974 13.4974 13.5115 13.5115 14.7219 14.7219 k = 0.2396-0.0000 0.2765 ( 3750 PWs) bands (ev): -0.7558 -0.7558 -0.7556 -0.7556 1.8227 1.8227 1.8248 1.8248 6.4681 6.4681 6.4830 6.4830 7.3017 7.3017 7.3159 7.3159 8.3127 8.3127 8.3146 8.3146 8.7911 8.7911 8.8154 8.8154 9.6268 9.6268 9.6525 9.6525 10.0530 10.0530 10.0695 10.0695 10.4315 10.4315 10.4451 10.4451 11.4154 11.4154 11.4751 11.4751 11.7829 11.7829 11.8001 11.8001 11.9047 11.9047 11.9482 11.9482 12.1680 12.1680 12.1994 12.1994 12.9200 12.9200 12.9580 12.9580 13.5005 13.5005 13.5156 13.5156 14.6400 14.6400 k = 0.2500-0.0000 0.2765 ( 3750 PWs) bands (ev): -0.6985 -0.6985 -0.6983 -0.6983 1.8290 1.8290 1.8312 1.8312 6.5286 6.5286 6.5439 6.5439 7.1842 7.1842 7.1982 7.1982 8.2806 8.2806 8.2830 8.2830 8.8121 8.8121 8.8363 8.8363 9.6077 9.6077 9.6334 9.6334 10.0321 10.0321 10.0501 10.0501 10.4207 10.4207 10.4339 10.4339 11.4118 11.4118 11.4698 11.4698 11.7871 11.7871 11.8034 11.8034 11.9118 11.9118 11.9574 11.9574 12.1744 12.1744 12.2075 12.2075 12.8895 12.8895 12.9257 12.9257 13.5037 13.5037 13.5200 13.5200 14.5624 14.5624 k = 0.2604-0.0000 0.2765 ( 3750 PWs) bands (ev): -0.6392 -0.6392 -0.6390 -0.6390 1.8339 1.8339 1.8361 1.8361 6.5907 6.5907 6.6061 6.6061 7.0671 7.0671 7.0816 7.0816 8.2473 8.2473 8.2508 8.2508 8.8356 8.8356 8.8595 8.8595 9.5879 9.5879 9.6137 9.6137 10.0121 10.0121 10.0316 10.0316 10.4085 10.4085 10.4212 10.4212 11.4077 11.4077 11.4637 11.4637 11.7906 11.7906 11.8060 11.8060 11.9185 11.9185 11.9659 11.9659 12.1808 12.1808 12.2153 12.2153 12.8588 12.8588 12.8931 12.8931 13.5071 13.5071 13.5243 13.5243 14.4893 14.4893 k = 0.2708-0.0000 0.2765 ( 3762 PWs) bands (ev): -0.5779 -0.5779 -0.5777 -0.5777 1.8370 1.8370 1.8393 1.8393 6.6542 6.6542 6.6681 6.6681 6.9515 6.9515 6.9682 6.9682 8.2132 8.2132 8.2181 8.2181 8.8610 8.8610 8.8844 8.8844 9.5672 9.5672 9.5933 9.5933 9.9928 9.9928 10.0138 10.0138 10.3950 10.3950 10.4071 10.4071 11.4030 11.4030 11.4569 11.4569 11.7936 11.7936 11.8081 11.8081 11.9247 11.9247 11.9737 11.9737 12.1871 12.1871 12.2228 12.2228 12.8276 12.8276 12.8601 12.8601 13.5105 13.5105 13.5286 13.5286 14.4209 14.4209 k = 0.2812-0.0000 0.2765 ( 3760 PWs) bands (ev): -0.5148 -0.5148 -0.5145 -0.5145 1.8381 1.8381 1.8406 1.8406 6.7175 6.7175 6.7227 6.7227 6.8394 6.8394 6.8659 6.8659 8.1787 8.1787 8.1855 8.1855 8.8875 8.8875 8.9104 8.9104 9.5460 9.5460 9.5723 9.5723 9.9743 9.9743 9.9968 9.9968 10.3801 10.3801 10.3916 10.3916 11.3979 11.3979 11.4497 11.4497 11.7960 11.7960 11.8097 11.8097 11.9305 11.9305 11.9807 11.9807 12.1932 12.1932 12.2299 12.2299 12.7961 12.7961 12.8268 12.8268 13.5139 13.5139 13.5327 13.5327 14.3575 14.3575 k = 0.2917-0.0000 0.2765 ( 3756 PWs) bands (ev): -0.4498 -0.4498 -0.4495 -0.4495 1.8371 1.8371 1.8395 1.8395 6.7078 6.7078 6.7191 6.7191 6.7929 6.7929 6.8371 6.8371 8.1441 8.1441 8.1532 8.1532 8.9146 8.9146 8.9369 8.9369 9.5242 9.5242 9.5506 9.5506 9.9565 9.9565 9.9805 9.9805 10.3639 10.3639 10.3746 10.3746 11.3926 11.3926 11.4422 11.4422 11.7981 11.7981 11.8110 11.8110 11.9358 11.9358 11.9869 11.9869 12.1992 12.1992 12.2365 12.2365 12.7643 12.7643 12.7932 12.7932 13.5171 13.5171 13.5366 13.5366 14.2990 14.2991 k = 0.3021-0.0000 0.2765 ( 3758 PWs) bands (ev): -0.3830 -0.3830 -0.3827 -0.3827 1.8335 1.8335 1.8360 1.8360 6.6142 6.6142 6.6149 6.6149 6.8562 6.8562 6.8913 6.8913 8.1099 8.1099 8.1216 8.1216 8.9419 8.9419 8.9634 8.9634 9.5018 9.5018 9.5285 9.5285 9.9392 9.9392 9.9647 9.9647 10.3464 10.3464 10.3563 10.3563 11.3870 11.3870 11.4343 11.4343 11.7997 11.7997 11.8118 11.8118 11.9406 11.9406 11.9923 11.9923 12.2047 12.2047 12.2426 12.2426 12.7321 12.7321 12.7594 12.7594 13.5200 13.5200 13.5401 13.5401 14.2457 14.2457 k = 0.3125-0.0000 0.2765 ( 3750 PWs) bands (ev): -0.3146 -0.3146 -0.3143 -0.3143 1.8271 1.8271 1.8297 1.8297 6.5111 6.5111 6.5131 6.5131 6.9233 6.9233 6.9576 6.9576 8.0766 8.0766 8.0913 8.0913 8.9687 8.9687 8.9894 8.9894 9.4791 9.4791 9.5059 9.5059 9.9224 9.9224 9.9495 9.9495 10.3279 10.3279 10.3368 10.3368 11.3813 11.3813 11.4263 11.4263 11.8010 11.8010 11.8124 11.8124 11.9449 11.9449 11.9969 11.9969 12.2099 12.2099 12.2481 12.2481 12.6999 12.6999 12.7255 12.7255 13.5227 13.5227 13.5430 13.5430 14.1976 14.1976 k = 0.3229-0.0000 0.2765 ( 3754 PWs) bands (ev): -0.2446 -0.2446 -0.2443 -0.2443 1.8178 1.8178 1.8204 1.8204 6.4111 6.4111 6.4141 6.4141 6.9907 6.9907 7.0262 7.0262 8.0445 8.0445 8.0626 8.0626 8.9947 8.9947 9.0143 9.0143 9.4561 9.4561 9.4829 9.4829 9.9058 9.9058 9.9344 9.9344 10.3087 10.3087 10.3164 10.3164 11.3754 11.3754 11.4180 11.4180 11.8021 11.8021 11.8127 11.8127 11.9489 11.9489 12.0008 12.0008 12.2147 12.2147 12.2529 12.2529 12.6675 12.6675 12.6916 12.6916 13.5248 13.5248 13.5451 13.5451 14.1547 14.1547 k = 0.3333-0.0000 0.2765 ( 3748 PWs) bands (ev): -0.1732 -0.1732 -0.1728 -0.1728 1.8052 1.8052 1.8078 1.8078 6.3156 6.3156 6.3190 6.3190 7.0576 7.0576 7.0952 7.0952 8.0145 8.0145 8.0366 8.0366 9.0193 9.0193 9.0376 9.0376 9.4332 9.4332 9.4597 9.4597 9.8891 9.8891 9.9193 9.9193 10.2891 10.2891 10.2955 10.2955 11.3694 11.3694 11.4096 11.4096 11.8030 11.8030 11.8129 11.8129 11.9526 11.9526 12.0041 12.0041 12.2189 12.2189 12.2571 12.2571 12.6354 12.6354 12.6582 12.6582 13.5262 13.5262 13.5464 13.5464 14.1170 14.1171 k = 0.3438-0.0000 0.2765 ( 3754 PWs) bands (ev): -0.1005 -0.1005 -0.1000 -0.1000 1.7891 1.7891 1.7918 1.7918 6.2250 6.2250 6.2285 6.2285 7.1230 7.1230 7.1634 7.1634 7.9875 7.9875 8.0138 8.0138 9.0420 9.0420 9.0585 9.0585 9.4108 9.4108 9.4367 9.4367 9.8720 9.8720 9.9037 9.9037 10.2695 10.2695 10.2745 10.2745 11.3632 11.3632 11.4010 11.4010 11.8036 11.8036 11.8128 11.8128 11.9559 11.9559 12.0067 12.0067 12.2226 12.2226 12.2605 12.2605 12.6038 12.6038 12.6253 12.6253 13.5269 13.5269 13.5467 13.5467 14.0844 14.0844 k = 0.3542-0.0000 0.2765 ( 3754 PWs) bands (ev): -0.0265 -0.0265 -0.0260 -0.0260 1.7694 1.7694 1.7720 1.7720 6.1397 6.1397 6.1431 6.1431 7.1859 7.1859 7.2295 7.2295 7.9646 7.9646 7.9957 7.9957 9.0619 9.0619 9.0763 9.0763 9.3895 9.3895 9.4143 9.4143 9.8542 9.8542 9.8872 9.8872 10.2505 10.2505 10.2540 10.2540 11.3570 11.3570 11.3924 11.3924 11.8041 11.8041 11.8127 11.8127 11.9591 11.9591 12.0089 12.0089 12.2258 12.2258 12.2632 12.2632 12.5729 12.5729 12.5933 12.5933 13.5268 13.5268 13.5459 13.5459 14.0568 14.0568 k = 0.3646-0.0000 0.2765 ( 3748 PWs) bands (ev): 0.0485 0.0485 0.0491 0.0491 1.7458 1.7458 1.7484 1.7484 6.0599 6.0599 6.0633 6.0633 7.2448 7.2448 7.2918 7.2918 7.9475 7.9475 7.9834 7.9834 9.0782 9.0782 9.0896 9.0896 9.3701 9.3701 9.3932 9.3932 9.8353 9.8353 9.8694 9.8694 10.2327 10.2327 10.2346 10.2346 11.3508 11.3508 11.3837 11.3837 11.8046 11.8046 11.8125 11.8125 11.9621 11.9621 12.0106 12.0106 12.2284 12.2284 12.2653 12.2653 12.5431 12.5431 12.5624 12.5624 13.5257 13.5257 13.5439 13.5439 14.0341 14.0341 k = 0.3750-0.0000 0.2765 ( 3756 PWs) bands (ev): 0.1245 0.1245 0.1251 0.1251 1.7183 1.7183 1.7209 1.7209 5.9859 5.9859 5.9891 5.9891 7.2982 7.2982 7.3482 7.3482 7.9382 7.9382 7.9788 7.9788 9.0895 9.0895 9.0970 9.0970 9.3540 9.3540 9.3743 9.3743 9.8149 9.8149 9.8498 9.8498 10.2164 10.2164 10.2170 10.2170 11.3446 11.3446 11.3750 11.3750 11.8049 11.8049 11.8122 11.8122 11.9650 11.9650 12.0117 12.0117 12.2305 12.2305 12.2666 12.2666 12.5146 12.5146 12.5330 12.5330 13.5238 13.5238 13.5409 13.5409 14.0158 14.0158 k = 0.3854-0.0000 0.2765 ( 3764 PWs) bands (ev): 0.2011 0.2011 0.2018 0.2018 1.6868 1.6868 1.6893 1.6893 5.9178 5.9178 5.9208 5.9208 7.3442 7.3442 7.3963 7.3963 7.9392 7.9392 7.9835 7.9835 9.0943 9.0943 9.0969 9.0969 9.3426 9.3426 9.3590 9.3590 9.7929 9.7929 9.8280 9.8280 10.2016 10.2016 10.2022 10.2022 11.3383 11.3383 11.3663 11.3663 11.8052 11.8052 11.8119 11.8119 11.9677 11.9677 12.0123 12.0123 12.2320 12.2320 12.2673 12.2673 12.4879 12.4879 12.5054 12.5054 13.5211 13.5211 13.5368 13.5368 14.0016 14.0016 k = 0.3958-0.0000 0.2765 ( 3764 PWs) bands (ev): 0.2783 0.2783 0.2790 0.2790 1.6513 1.6513 1.6538 1.6538 5.8557 5.8557 5.8585 5.8585 7.3815 7.3815 7.4337 7.4337 7.9528 7.9528 7.9990 7.9990 9.0881 9.0881 9.0911 9.0911 9.3368 9.3368 9.3488 9.3488 9.7692 9.7692 9.8041 9.8041 10.1888 10.1888 10.1903 10.1903 11.3323 11.3323 11.3578 11.3578 11.8056 11.8056 11.8117 11.8117 11.9703 11.9703 12.0125 12.0125 12.2332 12.2332 12.2673 12.2673 12.4632 12.4632 12.4799 12.4799 13.5177 13.5177 13.5320 13.5320 13.9911 13.9911 k = 0.4062-0.0000 0.2765 ( 3752 PWs) bands (ev): 0.3558 0.3558 0.3565 0.3565 1.6118 1.6118 1.6142 1.6142 5.7998 5.7998 5.8024 5.8024 7.4093 7.4093 7.4593 7.4593 7.9800 7.9800 8.0258 8.0258 9.0706 9.0706 9.0788 9.0788 9.3366 9.3366 9.3443 9.3443 9.7442 9.7442 9.7781 9.7781 10.1789 10.1789 10.1810 10.1810 11.3267 11.3267 11.3496 11.3496 11.8060 11.8060 11.8115 11.8115 11.9730 11.9730 12.0124 12.0124 12.2340 12.2340 12.2667 12.2667 12.4408 12.4408 12.4567 12.4567 13.5138 13.5138 13.5266 13.5266 13.9837 13.9837 k = 0.4167-0.0000 0.2765 ( 3752 PWs) bands (ev): 0.4333 0.4333 0.4341 0.4341 1.5685 1.5685 1.5708 1.5708 5.7501 5.7501 5.7523 5.7523 7.4281 7.4281 7.4737 7.4737 8.0200 8.0200 8.0633 8.0633 9.0451 9.0451 9.0575 9.0575 9.3410 9.3410 9.3455 9.3455 9.7181 9.7181 9.7504 9.7504 10.1716 10.1716 10.1740 10.1740 11.3212 11.3212 11.3416 11.3416 11.8063 11.8063 11.8113 11.8113 11.9756 11.9756 12.0118 12.0118 12.2346 12.2346 12.2655 12.2655 12.4207 12.4207 12.4357 12.4357 13.5096 13.5096 13.5209 13.5209 13.9788 13.9789 k = 0.4271-0.0000 0.2765 ( 3750 PWs) bands (ev): 0.5105 0.5105 0.5113 0.5113 1.5216 1.5216 1.5238 1.5238 5.7064 5.7064 5.7084 5.7084 7.4394 7.4394 7.4793 7.4793 8.0702 8.0702 8.1097 8.1097 9.0131 9.0131 9.0284 9.0284 9.3489 9.3489 9.3512 9.3512 9.6915 9.6915 9.7216 9.7216 10.1667 10.1667 10.1691 10.1691 11.3162 11.3162 11.3341 11.3341 11.8067 11.8067 11.8110 11.8110 11.9782 11.9782 12.0109 12.0109 12.2350 12.2350 12.2637 12.2637 12.4032 12.4032 12.4172 12.4172 13.5054 13.5054 13.5151 13.5151 13.9761 13.9762 k = 0.4375-0.0000 0.2765 ( 3748 PWs) bands (ev): 0.5869 0.5869 0.5878 0.5878 1.4714 1.4714 1.4735 1.4735 5.6688 5.6688 5.6706 5.6706 7.4453 7.4453 7.4789 7.4789 8.1274 8.1274 8.1625 8.1625 8.9759 8.9759 8.9928 8.9928 9.3589 9.3589 9.3602 9.3602 9.6653 9.6653 9.6927 9.6927 10.1637 10.1637 10.1660 10.1660 11.3117 11.3117 11.3270 11.3270 11.8071 11.8071 11.8109 11.8109 11.9808 11.9808 12.0095 12.0095 12.2354 12.2354 12.2613 12.2613 12.3883 12.3883 12.4011 12.4011 13.5014 13.5014 13.5096 13.5096 13.9749 13.9750 k = 0.4479-0.0000 0.2765 ( 3740 PWs) bands (ev): 0.6620 0.6620 0.6630 0.6630 1.4186 1.4186 1.4206 1.4206 5.6373 5.6373 5.6387 5.6387 7.4475 7.4475 7.4749 7.4749 8.1883 8.1883 8.2191 8.2191 8.9349 8.9349 8.9525 8.9525 9.3702 9.3702 9.3711 9.3711 9.6401 9.6401 9.6644 9.6644 10.1622 10.1622 10.1642 10.1642 11.3079 11.3079 11.3207 11.3207 11.8076 11.8076 11.8107 11.8107 11.9834 11.9834 12.0079 12.0079 12.2360 12.2360 12.2586 12.2586 12.3762 12.3762 12.3875 12.3875 13.4978 13.4978 13.5045 13.5045 13.9747 13.9748 k = 0.4583-0.0000 0.2765 ( 3736 PWs) bands (ev): 0.7349 0.7349 0.7359 0.7359 1.3640 1.3640 1.3658 1.3658 5.6116 5.6116 5.6128 5.6128 7.4478 7.4478 7.4692 7.4692 8.2500 8.2500 8.2766 8.2766 8.8918 8.8918 8.9090 8.9090 9.3819 9.3819 9.3830 9.3830 9.6170 9.6170 9.6376 9.6376 10.1617 10.1617 10.1634 10.1634 11.3048 11.3048 11.3150 11.3150 11.8080 11.8080 11.8105 11.8105 11.9860 11.9860 12.0059 12.0059 12.2367 12.2367 12.2555 12.2555 12.3669 12.3669 12.3764 12.3764 13.4946 13.4946 13.5000 13.5000 13.9753 13.9753 k = 0.4688-0.0000 0.2765 ( 3740 PWs) bands (ev): 0.8040 0.8040 0.8050 0.8050 1.3091 1.3091 1.3108 1.3108 5.5918 5.5918 5.5927 5.5927 7.4474 7.4474 7.4631 7.4631 8.3093 8.3093 8.3315 8.3315 8.8489 8.8489 8.8648 8.8648 9.3933 9.3933 9.3947 9.3947 9.5970 9.5970 9.6135 9.6135 10.1618 10.1618 10.1631 10.1631 11.3026 11.3026 11.3102 11.3102 11.8083 11.8083 11.8102 11.8102 11.9885 11.9885 12.0036 12.0036 12.2377 12.2377 12.2523 12.2523 12.3600 12.3600 12.3674 12.3674 13.4922 13.4922 13.4962 13.4962 13.9764 13.9764 k = 0.4792-0.0000 0.2765 ( 3736 PWs) bands (ev): 0.8661 0.8661 0.8670 0.8670 1.2573 1.2573 1.2586 1.2586 5.5778 5.5778 5.5784 5.5784 7.4473 7.4473 7.4576 7.4576 8.3620 8.3620 8.3789 8.3789 8.8105 8.8105 8.8234 8.8234 9.4035 9.4035 9.4049 9.4049 9.5817 9.5817 9.5934 9.5934 10.1622 10.1622 10.1631 10.1631 11.3013 11.3013 11.3064 11.3064 11.8087 11.8087 11.8100 11.8100 11.9911 11.9911 12.0013 12.0013 12.2391 12.2391 12.2490 12.2490 12.3557 12.3557 12.3607 12.3607 13.4906 13.4906 13.4932 13.4932 13.9776 13.9778 k = 0.4896-0.0000 0.2765 ( 3736 PWs) bands (ev): 0.9140 0.9140 0.9147 0.9147 1.2158 1.2158 1.2167 1.2167 5.5694 5.5694 5.5697 5.5697 7.4479 7.4479 7.4530 7.4530 8.4018 8.4018 8.4114 8.4114 8.7832 8.7832 8.7909 8.7909 9.4109 9.4109 9.4119 9.4119 9.5725 9.5725 9.5787 9.5787 10.1626 10.1626 10.1631 10.1631 11.3009 11.3009 11.3035 11.3035 11.8091 11.8091 11.8097 11.8097 11.9937 11.9937 11.9988 11.9988 12.2410 12.2410 12.2460 12.2460 12.3536 12.3536 12.3562 12.3562 13.4898 13.4898 13.4911 13.4911 13.9788 13.9788 k = 0.5000-0.0000 0.2765 ( 3736 PWs) bands (ev): 0.9337 0.9337 0.9337 0.9337 1.1989 1.1989 1.1989 1.1989 5.5668 5.5668 5.5668 5.5668 7.4498 7.4498 7.4498 7.4498 8.4202 8.4202 8.4202 8.4202 8.7756 8.7756 8.7756 8.7756 9.4140 9.4140 9.4140 9.4140 9.5714 9.5714 9.5714 9.5714 10.1629 10.1629 10.1629 10.1629 11.3017 11.3017 11.3017 11.3017 11.8094 11.8094 11.8094 11.8094 11.9963 11.9963 11.9963 11.9963 12.2433 12.2433 12.2433 12.2433 12.3538 12.3538 12.3538 12.3538 13.4900 13.4900 13.4900 13.4900 13.9799 13.9799 k = 0.5000-0.0000 0.2765 ( 3736 PWs) bands (ev): 0.9337 0.9337 0.9337 0.9337 1.1989 1.1989 1.1989 1.1989 5.5668 5.5668 5.5668 5.5668 7.4498 7.4498 7.4498 7.4498 8.4202 8.4202 8.4202 8.4202 8.7756 8.7756 8.7756 8.7756 9.4140 9.4140 9.4140 9.4140 9.5714 9.5714 9.5714 9.5714 10.1629 10.1629 10.1629 10.1629 11.3017 11.3017 11.3017 11.3017 11.8094 11.8094 11.8094 11.8094 11.9963 11.9963 11.9963 11.9963 12.2433 12.2433 12.2433 12.2433 12.3538 12.3538 12.3538 12.3538 13.4900 13.4900 13.4900 13.4900 13.9799 13.9799 k = 0.5000 0.0101 0.2765 ( 3736 PWs) bands (ev): 0.9341 0.9341 0.9341 0.9341 1.1990 1.1990 1.1990 1.1990 5.5659 5.5659 5.5659 5.5659 7.4428 7.4428 7.4428 7.4428 8.4223 8.4223 8.4223 8.4223 8.7808 8.7808 8.7808 8.7808 9.4140 9.4140 9.4140 9.4140 9.5705 9.5705 9.5705 9.5705 10.1648 10.1648 10.1648 10.1648 11.3015 11.3015 11.3015 11.3015 11.8098 11.8098 11.8098 11.8098 11.9965 11.9965 11.9965 11.9965 12.2434 12.2434 12.2434 12.2434 12.3539 12.3539 12.3539 12.3539 13.4915 13.4915 13.4915 13.4915 13.9813 13.9813 k = 0.5000 0.0203 0.2765 ( 3752 PWs) bands (ev): 0.9353 0.9353 0.9353 0.9353 1.1994 1.1994 1.1994 1.1994 5.5632 5.5632 5.5632 5.5632 7.4224 7.4224 7.4224 7.4224 8.4285 8.4285 8.4285 8.4285 8.7961 8.7961 8.7961 8.7961 9.4137 9.4137 9.4137 9.4137 9.5677 9.5677 9.5677 9.5677 10.1703 10.1703 10.1703 10.1703 11.3007 11.3007 11.3007 11.3007 11.8110 11.8110 11.8110 11.8110 11.9970 11.9970 11.9970 11.9970 12.2437 12.2437 12.2437 12.2437 12.3539 12.3539 12.3539 12.3539 13.4958 13.4958 13.4958 13.4958 13.9856 13.9856 k = 0.5000 0.0304 0.2765 ( 3752 PWs) bands (ev): 0.9372 0.9372 0.9372 0.9372 1.2000 1.2000 1.2000 1.2000 5.5589 5.5589 5.5589 5.5589 7.3896 7.3896 7.3896 7.3896 8.4386 8.4386 8.4386 8.4386 8.8203 8.8203 8.8203 8.8203 9.4133 9.4133 9.4133 9.4133 9.5635 9.5635 9.5635 9.5635 10.1793 10.1793 10.1793 10.1793 11.2996 11.2996 11.2996 11.2996 11.8129 11.8129 11.8129 11.8129 11.9979 11.9979 11.9979 11.9979 12.2443 12.2443 12.2443 12.2443 12.3542 12.3542 12.3542 12.3542 13.5032 13.5032 13.5032 13.5032 13.9929 13.9929 k = 0.5000 0.0406 0.2765 ( 3756 PWs) bands (ev): 0.9399 0.9399 0.9399 0.9399 1.2009 1.2009 1.2009 1.2009 5.5530 5.5530 5.5530 5.5530 7.3460 7.3460 7.3460 7.3460 8.4526 8.4526 8.4526 8.4526 8.8518 8.8518 8.8518 8.8518 9.4129 9.4129 9.4129 9.4129 9.5577 9.5577 9.5577 9.5577 10.1918 10.1918 10.1918 10.1918 11.2981 11.2981 11.2981 11.2981 11.8156 11.8156 11.8156 11.8156 11.9993 11.9993 11.9993 11.9993 12.2451 12.2451 12.2451 12.2451 12.3544 12.3544 12.3544 12.3544 13.5135 13.5135 13.5135 13.5135 14.0030 14.0030 k = 0.5000 0.0507 0.2765 ( 3756 PWs) bands (ev): 0.9434 0.9434 0.9434 0.9434 1.2019 1.2019 1.2019 1.2019 5.5457 5.5457 5.5457 5.5457 7.2935 7.2935 7.2935 7.2935 8.4701 8.4701 8.4701 8.4701 8.8887 8.8887 8.8887 8.8887 9.4125 9.4125 9.4125 9.4125 9.5507 9.5507 9.5507 9.5507 10.2073 10.2073 10.2073 10.2073 11.2961 11.2961 11.2961 11.2961 11.8190 11.8190 11.8190 11.8190 12.0010 12.0010 12.0010 12.0010 12.2461 12.2461 12.2461 12.2461 12.3548 12.3548 12.3548 12.3548 13.5267 13.5267 13.5267 13.5267 14.0160 14.0160 k = 0.5000 0.0609 0.2765 ( 3760 PWs) bands (ev): 0.9475 0.9475 0.9475 0.9475 1.2031 1.2031 1.2031 1.2031 5.5373 5.5373 5.5373 5.5373 7.2338 7.2338 7.2338 7.2338 8.4910 8.4910 8.4910 8.4910 8.9291 8.9291 8.9291 8.9291 9.4123 9.4123 9.4123 9.4123 9.5428 9.5428 9.5428 9.5428 10.2258 10.2258 10.2258 10.2258 11.2937 11.2937 11.2937 11.2937 11.8232 11.8232 11.8232 11.8232 12.0029 12.0029 12.0029 12.0029 12.2473 12.2473 12.2473 12.2473 12.3552 12.3552 12.3552 12.3552 13.5426 13.5426 13.5426 13.5426 14.0318 14.0318 k = 0.5000 0.0710 0.2765 ( 3764 PWs) bands (ev): 0.9524 0.9524 0.9524 0.9524 1.2045 1.2045 1.2045 1.2045 5.5280 5.5280 5.5280 5.5280 7.1684 7.1684 7.1684 7.1684 8.5149 8.5149 8.5149 8.5149 8.9712 8.9712 8.9712 8.9712 9.4123 9.4123 9.4123 9.4123 9.5342 9.5342 9.5342 9.5342 10.2468 10.2468 10.2468 10.2468 11.2909 11.2909 11.2909 11.2909 11.8280 11.8280 11.8280 11.8280 12.0052 12.0052 12.0052 12.0052 12.2487 12.2487 12.2487 12.2487 12.3558 12.3558 12.3558 12.3558 13.5613 13.5613 13.5613 13.5613 14.0505 14.0505 k = 0.5000 0.0812 0.2765 ( 3760 PWs) bands (ev): 0.9580 0.9580 0.9580 0.9580 1.2060 1.2060 1.2060 1.2060 5.5179 5.5179 5.5179 5.5179 7.0987 7.0987 7.0987 7.0987 8.5416 8.5416 8.5416 8.5416 9.0135 9.0135 9.0135 9.0135 9.4130 9.4130 9.4130 9.4130 9.5252 9.5252 9.5252 9.5252 10.2703 10.2703 10.2703 10.2703 11.2877 11.2877 11.2877 11.2877 11.8335 11.8335 11.8335 11.8335 12.0077 12.0077 12.0077 12.0077 12.2504 12.2504 12.2504 12.2504 12.3564 12.3564 12.3564 12.3564 13.5827 13.5827 13.5827 13.5827 14.0720 14.0720 k = 0.5000 0.0913 0.2765 ( 3768 PWs) bands (ev): 0.9642 0.9642 0.9642 0.9642 1.2075 1.2075 1.2075 1.2075 5.5076 5.5076 5.5076 5.5076 7.0258 7.0258 7.0258 7.0258 8.5706 8.5706 8.5706 8.5706 9.0545 9.0545 9.0545 9.0545 9.4143 9.4143 9.4143 9.4143 9.5160 9.5160 9.5160 9.5160 10.2959 10.2959 10.2959 10.2959 11.2841 11.2841 11.2841 11.2841 11.8397 11.8397 11.8397 11.8397 12.0105 12.0105 12.0105 12.0105 12.2523 12.2523 12.2523 12.2523 12.3570 12.3570 12.3570 12.3570 13.6067 13.6067 13.6067 13.6067 14.0962 14.0962 k = 0.5000 0.1015 0.2765 ( 3764 PWs) bands (ev): 0.9711 0.9711 0.9711 0.9711 1.2090 1.2090 1.2090 1.2090 5.4971 5.4971 5.4971 5.4971 6.9507 6.9507 6.9507 6.9507 8.6018 8.6018 8.6018 8.6018 9.0929 9.0929 9.0929 9.0929 9.4168 9.4168 9.4168 9.4168 9.5070 9.5070 9.5070 9.5070 10.3234 10.3234 10.3234 10.3234 11.2800 11.2800 11.2800 11.2800 11.8464 11.8464 11.8464 11.8464 12.0136 12.0136 12.0136 12.0136 12.2544 12.2544 12.2544 12.2544 12.3577 12.3577 12.3577 12.3577 13.6333 13.6333 13.6333 13.6333 14.1232 14.1232 k = 0.5000 0.1116 0.2765 ( 3764 PWs) bands (ev): 0.9786 0.9786 0.9786 0.9786 1.2105 1.2105 1.2105 1.2105 5.4869 5.4869 5.4869 5.4869 6.8742 6.8742 6.8742 6.8742 8.6347 8.6347 8.6347 8.6347 9.1276 9.1276 9.1276 9.1276 9.4204 9.4204 9.4204 9.4204 9.4984 9.4984 9.4984 9.4984 10.3526 10.3526 10.3526 10.3526 11.2755 11.2755 11.2755 11.2755 11.8537 11.8537 11.8537 11.8537 12.0168 12.0168 12.0168 12.0168 12.2567 12.2567 12.2567 12.2567 12.3585 12.3585 12.3585 12.3585 13.6624 13.6624 13.6624 13.6624 14.1530 14.1530 k = 0.5000 0.1218 0.2765 ( 3772 PWs) bands (ev): 0.9866 0.9866 0.9866 0.9866 1.2119 1.2119 1.2119 1.2119 5.4771 5.4771 5.4771 5.4771 6.7969 6.7969 6.7969 6.7969 8.6690 8.6690 8.6690 8.6690 9.1576 9.1576 9.1576 9.1576 9.4254 9.4254 9.4254 9.4254 9.4908 9.4908 9.4908 9.4908 10.3833 10.3833 10.3833 10.3833 11.2704 11.2704 11.2704 11.2704 11.8615 11.8615 11.8615 11.8615 12.0201 12.0201 12.0201 12.0201 12.2592 12.2592 12.2592 12.2592 12.3592 12.3592 12.3592 12.3592 13.6939 13.6939 13.6939 13.6939 14.1853 14.1853 k = 0.5000 0.1319 0.2765 ( 3772 PWs) bands (ev): 0.9951 0.9951 0.9951 0.9951 1.2131 1.2131 1.2131 1.2131 5.4683 5.4683 5.4683 5.4683 6.7193 6.7193 6.7193 6.7193 8.7044 8.7044 8.7044 8.7044 9.1824 9.1824 9.1824 9.1824 9.4310 9.4310 9.4310 9.4310 9.4850 9.4850 9.4850 9.4850 10.4153 10.4153 10.4153 10.4153 11.2647 11.2647 11.2647 11.2647 11.8698 11.8698 11.8698 11.8698 12.0235 12.0235 12.0235 12.0235 12.2619 12.2619 12.2619 12.2619 12.3599 12.3599 12.3599 12.3599 13.7279 13.7279 13.7279 13.7279 14.2202 14.2202 k = 0.5000 0.1421 0.2765 ( 3768 PWs) bands (ev): 1.0040 1.0040 1.0040 1.0040 1.2141 1.2141 1.2141 1.2141 5.4605 5.4605 5.4605 5.4605 6.6420 6.6420 6.6420 6.6420 8.7405 8.7405 8.7405 8.7405 9.2018 9.2018 9.2018 9.2018 9.4360 9.4360 9.4360 9.4360 9.4824 9.4824 9.4824 9.4824 10.4485 10.4485 10.4485 10.4485 11.2585 11.2585 11.2585 11.2585 11.8785 11.8785 11.8785 11.8785 12.0268 12.0268 12.0268 12.0268 12.2649 12.2649 12.2649 12.2649 12.3606 12.3606 12.3606 12.3606 13.7643 13.7643 13.7643 13.7643 14.2576 14.2576 k = 0.5000 0.1522 0.2765 ( 3768 PWs) bands (ev): 1.0134 1.0134 1.0134 1.0134 1.2148 1.2148 1.2148 1.2148 5.4542 5.4542 5.4542 5.4542 6.5654 6.5654 6.5654 6.5654 8.7770 8.7770 8.7770 8.7770 9.2161 9.2161 9.2161 9.2161 9.4383 9.4383 9.4383 9.4383 9.4845 9.4845 9.4845 9.4845 10.4826 10.4826 10.4826 10.4826 11.2515 11.2515 11.2515 11.2515 11.8876 11.8876 11.8876 11.8876 12.0301 12.0301 12.0301 12.0301 12.2680 12.2680 12.2680 12.2680 12.3612 12.3612 12.3612 12.3612 13.8032 13.8032 13.8032 13.8032 14.2974 14.2974 k = 0.5000 0.1624 0.2765 ( 3768 PWs) bands (ev): 1.0232 1.0232 1.0232 1.0232 1.2152 1.2152 1.2152 1.2152 5.4495 5.4495 5.4495 5.4495 6.4898 6.4898 6.4898 6.4898 8.8135 8.8135 8.8135 8.8135 9.2259 9.2259 9.2259 9.2259 9.4374 9.4374 9.4374 9.4374 9.4911 9.4911 9.4911 9.4911 10.5175 10.5175 10.5175 10.5175 11.2436 11.2436 11.2436 11.2436 11.8968 11.8968 11.8968 11.8968 12.0332 12.0332 12.0332 12.0332 12.2714 12.2714 12.2714 12.2714 12.3617 12.3617 12.3617 12.3617 13.8445 13.8445 13.8445 13.8445 14.3395 14.3395 k = 0.5000 0.1725 0.2765 ( 3772 PWs) bands (ev): 1.0332 1.0332 1.0332 1.0332 1.2151 1.2151 1.2151 1.2151 5.4467 5.4467 5.4467 5.4467 6.4155 6.4155 6.4155 6.4155 8.8497 8.8497 8.8497 8.8497 9.2321 9.2321 9.2321 9.2321 9.4348 9.4348 9.4348 9.4348 9.5002 9.5002 9.5002 9.5002 10.5530 10.5530 10.5530 10.5530 11.2349 11.2349 11.2349 11.2349 11.9064 11.9064 11.9064 11.9064 12.0361 12.0361 12.0361 12.0361 12.2750 12.2750 12.2750 12.2750 12.3620 12.3620 12.3620 12.3620 13.8881 13.8881 13.8881 13.8881 14.3836 14.3836 k = 0.5000 0.1827 0.2765 ( 3776 PWs) bands (ev): 1.0435 1.0435 1.0435 1.0435 1.2147 1.2147 1.2147 1.2147 5.4461 5.4461 5.4461 5.4461 6.3428 6.3428 6.3428 6.3428 8.8853 8.8853 8.8853 8.8853 9.2353 9.2353 9.2353 9.2353 9.4317 9.4317 9.4317 9.4317 9.5097 9.5097 9.5097 9.5097 10.5889 10.5889 10.5889 10.5889 11.2251 11.2251 11.2251 11.2251 11.9161 11.9161 11.9161 11.9161 12.0387 12.0387 12.0387 12.0387 12.2787 12.2787 12.2787 12.2787 12.3619 12.3619 12.3619 12.3619 13.9342 13.9342 13.9342 13.9342 14.4296 14.4296 k = 0.5000 0.1928 0.2765 ( 3776 PWs) bands (ev): 1.0540 1.0540 1.0540 1.0540 1.2137 1.2137 1.2137 1.2137 5.4479 5.4479 5.4479 5.4479 6.2720 6.2720 6.2720 6.2720 8.9200 8.9200 8.9200 8.9200 9.2365 9.2365 9.2365 9.2365 9.4291 9.4291 9.4291 9.4291 9.5182 9.5182 9.5182 9.5182 10.6252 10.6252 10.6252 10.6252 11.2142 11.2142 11.2142 11.2142 11.9258 11.9258 11.9258 11.9258 12.0408 12.0408 12.0408 12.0408 12.2827 12.2827 12.2827 12.2827 12.3617 12.3617 12.3617 12.3617 13.9828 13.9828 13.9828 13.9828 14.4772 14.4772 k = 0.5000 0.2030 0.2765 ( 3772 PWs) bands (ev): 1.0646 1.0646 1.0646 1.0646 1.2122 1.2122 1.2122 1.2122 5.4523 5.4523 5.4523 5.4523 6.2032 6.2032 6.2032 6.2032 8.9534 8.9534 8.9534 8.9534 9.2359 9.2359 9.2359 9.2359 9.4274 9.4274 9.4274 9.4274 9.5251 9.5251 9.5251 9.5251 10.6615 10.6615 10.6615 10.6615 11.2020 11.2020 11.2020 11.2020 11.9356 11.9356 11.9356 11.9356 12.0425 12.0425 12.0425 12.0425 12.2867 12.2867 12.2867 12.2867 12.3612 12.3612 12.3612 12.3612 14.0337 14.0337 14.0337 14.0337 14.5259 14.5259 k = 0.5000 0.2131 0.2765 ( 3780 PWs) bands (ev): 1.0752 1.0752 1.0752 1.0752 1.2102 1.2102 1.2102 1.2102 5.4594 5.4594 5.4594 5.4594 6.1367 6.1367 6.1367 6.1367 8.9852 8.9852 8.9852 8.9852 9.2340 9.2340 9.2340 9.2340 9.4267 9.4267 9.4267 9.4267 9.5299 9.5299 9.5299 9.5299 10.6978 10.6978 10.6978 10.6978 11.1884 11.1884 11.1884 11.1884 11.9453 11.9453 11.9453 11.9453 12.0437 12.0437 12.0437 12.0437 12.2909 12.2909 12.2909 12.2909 12.3604 12.3604 12.3604 12.3604 14.0869 14.0869 14.0869 14.0869 14.5750 14.5750 k = 0.5000 0.2233 0.2765 ( 3776 PWs) bands (ev): 1.0859 1.0859 1.0859 1.0859 1.2075 1.2075 1.2075 1.2075 5.4694 5.4694 5.4694 5.4694 6.0727 6.0727 6.0727 6.0727 9.0153 9.0153 9.0153 9.0153 9.2311 9.2311 9.2311 9.2311 9.4275 9.4275 9.4275 9.4275 9.5324 9.5324 9.5324 9.5324 10.7339 10.7339 10.7339 10.7339 11.1735 11.1735 11.1735 11.1735 11.9548 11.9548 11.9548 11.9548 12.0443 12.0443 12.0443 12.0443 12.2953 12.2953 12.2953 12.2953 12.3592 12.3592 12.3592 12.3592 14.1425 14.1425 14.1425 14.1425 14.6236 14.6236 k = 0.5000 0.2334 0.2765 ( 3772 PWs) bands (ev): 1.0964 1.0964 1.0964 1.0964 1.2042 1.2042 1.2042 1.2042 5.4824 5.4824 5.4824 5.4824 6.0113 6.0113 6.0113 6.0113 9.0432 9.0432 9.0432 9.0432 9.2273 9.2273 9.2273 9.2273 9.4298 9.4298 9.4298 9.4298 9.5326 9.5326 9.5326 9.5326 10.7696 10.7696 10.7696 10.7696 11.1571 11.1571 11.1571 11.1571 11.9641 11.9641 11.9641 11.9641 12.0444 12.0444 12.0444 12.0444 12.2997 12.2997 12.2997 12.2997 12.3576 12.3576 12.3576 12.3576 14.2002 14.2002 14.2002 14.2002 14.6700 14.6700 k = 0.5000 0.2436 0.2765 ( 3764 PWs) bands (ev): 1.1068 1.1068 1.1068 1.1068 1.2002 1.2002 1.2002 1.2002 5.4986 5.4986 5.4986 5.4986 5.9527 5.9527 5.9527 5.9527 9.0689 9.0689 9.0689 9.0689 9.2228 9.2228 9.2228 9.2228 9.4336 9.4336 9.4336 9.4336 9.5306 9.5306 9.5306 9.5306 10.8048 10.8048 10.8048 10.8048 11.1391 11.1391 11.1391 11.1391 11.9730 11.9730 11.9730 11.9730 12.0438 12.0438 12.0438 12.0438 12.3042 12.3042 12.3042 12.3042 12.3558 12.3558 12.3558 12.3558 14.2600 14.2600 14.2600 14.2600 14.7118 14.7118 k = 0.5000 0.2537 0.2765 ( 3764 PWs) bands (ev): 1.1171 1.1171 1.1171 1.1171 1.1956 1.1956 1.1956 1.1956 5.5180 5.5180 5.5180 5.5180 5.8970 5.8970 5.8970 5.8970 9.0921 9.0921 9.0921 9.0921 9.2177 9.2177 9.2177 9.2177 9.4390 9.4390 9.4390 9.4390 9.5264 9.5264 9.5264 9.5264 10.8392 10.8392 10.8392 10.8392 11.1195 11.1195 11.1195 11.1195 11.9814 11.9814 11.9814 11.9814 12.0426 12.0426 12.0426 12.0426 12.3086 12.3086 12.3086 12.3086 12.3535 12.3535 12.3535 12.3535 14.3215 14.3215 14.3215 14.3215 14.7446 14.7446 k = 0.5000 0.2639 0.2765 ( 3760 PWs) bands (ev): 1.1270 1.1270 1.1270 1.1270 1.1904 1.1904 1.1904 1.1904 5.5408 5.5408 5.5408 5.5408 5.8443 5.8443 5.8443 5.8443 9.1127 9.1127 9.1127 9.1127 9.2118 9.2118 9.2118 9.2118 9.4458 9.4458 9.4458 9.4458 9.5204 9.5204 9.5204 9.5204 10.8728 10.8728 10.8728 10.8728 11.0984 11.0984 11.0984 11.0984 11.9893 11.9893 11.9893 11.9893 12.0409 12.0409 12.0409 12.0409 12.3129 12.3129 12.3129 12.3129 12.3511 12.3511 12.3511 12.3511 14.3846 14.3846 14.3846 14.3846 14.7624 14.7624 k = 0.5000 0.2740 0.2765 ( 3760 PWs) bands (ev): 1.1366 1.1366 1.1366 1.1366 1.1844 1.1844 1.1844 1.1844 5.5669 5.5669 5.5669 5.5669 5.7948 5.7948 5.7948 5.7948 9.1307 9.1307 9.1307 9.1307 9.2054 9.2054 9.2054 9.2054 9.4541 9.4541 9.4541 9.4541 9.5128 9.5128 9.5128 9.5128 10.9053 10.9053 10.9053 10.9053 11.0757 11.0757 11.0757 11.0757 11.9962 11.9962 11.9962 11.9962 12.0388 12.0388 12.0388 12.0388 12.3169 12.3169 12.3169 12.3169 12.3484 12.3484 12.3484 12.3484 14.4485 14.4485 14.4485 14.4485 14.7592 14.7592 k = 0.5000 0.2842 0.2765 ( 3760 PWs) bands (ev): 1.1458 1.1458 1.1458 1.1458 1.1779 1.1779 1.1779 1.1779 5.5964 5.5964 5.5964 5.5964 5.7484 5.7484 5.7484 5.7484 9.1459 9.1459 9.1459 9.1459 9.1984 9.1984 9.1984 9.1984 9.4633 9.4633 9.4633 9.4633 9.5040 9.5040 9.5040 9.5040 10.9364 10.9364 10.9364 10.9364 11.0516 11.0516 11.0516 11.0516 12.0021 12.0021 12.0021 12.0021 12.0364 12.0364 12.0364 12.0364 12.3205 12.3205 12.3205 12.3205 12.3459 12.3459 12.3459 12.3459 14.5128 14.5128 14.5128 14.5128 14.7338 14.7338 k = 0.5000 0.2943 0.2765 ( 3752 PWs) bands (ev): 1.1546 1.1546 1.1546 1.1546 1.1708 1.1708 1.1708 1.1708 5.6293 5.6293 5.6293 5.6293 5.7054 5.7054 5.7054 5.7054 9.1577 9.1577 9.1577 9.1577 9.1915 9.1915 9.1915 9.1915 9.4733 9.4733 9.4733 9.4733 9.4943 9.4943 9.4943 9.4943 10.9657 10.9657 10.9657 10.9657 11.0267 11.0267 11.0267 11.0267 12.0063 12.0063 12.0063 12.0063 12.0344 12.0344 12.0344 12.0344 12.3231 12.3231 12.3231 12.3231 12.3438 12.3438 12.3438 12.3438 14.5761 14.5761 14.5761 14.5761 14.6907 14.6907 k = 0.5000 0.3045 0.2765 ( 3752 PWs) bands (ev): 1.1618 1.1618 1.1618 1.1618 1.1641 1.1641 1.1641 1.1641 5.6656 5.6656 5.6656 5.6656 5.6657 5.6657 5.6657 5.6657 9.1629 9.1629 9.1629 9.1629 9.1879 9.1879 9.1879 9.1879 9.4822 9.4822 9.4822 9.4822 9.4855 9.4855 9.4855 9.4855 10.9855 10.9855 10.9855 10.9855 11.0084 11.0084 11.0084 11.0084 12.0078 12.0078 12.0078 12.0078 12.0335 12.0335 12.0335 12.0335 12.3241 12.3241 12.3241 12.3241 12.3430 12.3430 12.3430 12.3430 14.6364 14.6364 14.6364 14.6365 14.6365 14.6365 k = 0.5000 0.3045 0.2765 ( 3752 PWs) bands (ev): 1.1618 1.1618 1.1618 1.1618 1.1641 1.1641 1.1641 1.1641 5.6656 5.6656 5.6656 5.6656 5.6657 5.6657 5.6657 5.6657 9.1629 9.1629 9.1629 9.1629 9.1879 9.1879 9.1879 9.1879 9.4822 9.4822 9.4822 9.4822 9.4855 9.4855 9.4855 9.4855 10.9855 10.9855 10.9855 10.9855 11.0084 11.0084 11.0084 11.0084 12.0078 12.0078 12.0078 12.0078 12.0335 12.0335 12.0335 12.0335 12.3241 12.3241 12.3241 12.3241 12.3430 12.3430 12.3430 12.3430 14.6364 14.6364 14.6364 14.6365 14.6365 14.6365 k = 0.4896 0.3045 0.2765 ( 3748 PWs) bands (ev): 1.1166 1.1166 1.1166 1.1166 1.2055 1.2055 1.2055 1.2055 5.6291 5.6291 5.6291 5.6291 5.7087 5.7087 5.7087 5.7087 9.1551 9.1551 9.1551 9.1551 9.1938 9.1938 9.1938 9.1938 9.4675 9.4675 9.4675 9.4675 9.5015 9.5015 9.5015 9.5015 10.9851 10.9851 10.9851 10.9851 11.0083 11.0083 11.0083 11.0083 12.0042 12.0042 12.0042 12.0042 12.0362 12.0362 12.0362 12.0362 12.3238 12.3238 12.3238 12.3238 12.3447 12.3447 12.3447 12.3447 14.5758 14.5758 14.5758 14.5759 14.6909 14.6909 k = 0.4792 0.3045 0.2765 ( 3760 PWs) bands (ev): 1.0668 1.0668 1.0668 1.0668 1.2438 1.2438 1.2438 1.2438 5.5996 5.5996 5.5996 5.5996 5.7579 5.7579 5.7579 5.7579 9.1396 9.1396 9.1396 9.1396 9.2036 9.2036 9.2036 9.2036 9.4527 9.4527 9.4527 9.4527 9.5203 9.5203 9.5203 9.5203 10.9837 10.9837 10.9837 10.9837 11.0078 11.0078 11.0078 11.0078 11.9954 11.9954 11.9954 11.9954 12.0419 12.0419 12.0419 12.0419 12.3231 12.3231 12.3231 12.3231 12.3492 12.3492 12.3492 12.3492 14.5115 14.5115 14.5115 14.5115 14.7358 14.7358 k = 0.4688 0.3045 0.2765 ( 3756 PWs) bands (ev): 1.0139 1.0139 1.0139 1.0139 1.2777 1.2777 1.2777 1.2777 5.5775 5.5775 5.5775 5.5775 5.8127 5.8127 5.8127 5.8127 9.1209 9.1209 9.1209 9.1209 9.2129 9.2129 9.2129 9.2129 9.4393 9.4393 9.4393 9.4393 9.5401 9.5401 9.5401 9.5401 10.9816 10.9816 10.9816 10.9816 11.0071 11.0071 11.0071 11.0071 11.9841 11.9841 11.9841 11.9841 12.0484 12.0484 12.0484 12.0484 12.3226 12.3226 12.3226 12.3226 12.3564 12.3564 12.3564 12.3564 14.4451 14.4451 14.4451 14.4451 14.7674 14.7674 k = 0.4583 0.3045 0.2765 ( 3756 PWs) bands (ev): 0.9583 0.9583 0.9583 0.9583 1.3068 1.3068 1.3068 1.3068 5.5629 5.5629 5.5629 5.5629 5.8727 5.8727 5.8727 5.8727 9.1002 9.1002 9.1002 9.1002 9.2207 9.2207 9.2207 9.2207 9.4274 9.4274 9.4274 9.4274 9.5610 9.5610 9.5610 9.5610 10.9790 10.9790 10.9790 10.9790 11.0061 11.0061 11.0061 11.0061 11.9708 11.9708 11.9708 11.9708 12.0550 12.0550 12.0550 12.0550 12.3223 12.3223 12.3223 12.3223 12.3658 12.3658 12.3658 12.3658 14.3779 14.3779 14.3779 14.3779 14.7826 14.7826 k = 0.4479 0.3045 0.2765 ( 3756 PWs) bands (ev): 0.9004 0.9004 0.9004 0.9004 1.3309 1.3309 1.3309 1.3309 5.5563 5.5563 5.5563 5.5563 5.9372 5.9372 5.9372 5.9372 9.0777 9.0777 9.0777 9.0777 9.2271 9.2271 9.2271 9.2271 9.4171 9.4171 9.4171 9.4171 9.5826 9.5826 9.5826 9.5826 10.9758 10.9758 10.9758 10.9758 11.0048 11.0048 11.0048 11.0048 11.9557 11.9557 11.9557 11.9557 12.0615 12.0615 12.0615 12.0615 12.3222 12.3222 12.3222 12.3222 12.3775 12.3775 12.3775 12.3775 14.3107 14.3107 14.3107 14.3107 14.7811 14.7811 k = 0.4375 0.3045 0.2765 ( 3756 PWs) bands (ev): 0.8405 0.8405 0.8405 0.8405 1.3499 1.3499 1.3499 1.3499 5.5577 5.5577 5.5577 5.5577 6.0059 6.0059 6.0059 6.0059 9.0537 9.0537 9.0537 9.0537 9.2319 9.2319 9.2319 9.2319 9.4081 9.4081 9.4081 9.4081 9.6049 9.6049 9.6049 9.6049 10.9722 10.9722 10.9722 10.9722 11.0032 11.0032 11.0032 11.0032 11.9391 11.9391 11.9391 11.9391 12.0679 12.0679 12.0679 12.0679 12.3223 12.3223 12.3223 12.3223 12.3915 12.3915 12.3915 12.3915 14.2441 14.2441 14.2441 14.2441 14.7657 14.7657 k = 0.4271 0.3045 0.2765 ( 3752 PWs) bands (ev): 0.7791 0.7791 0.7791 0.7791 1.3638 1.3638 1.3638 1.3638 5.5672 5.5672 5.5672 5.5672 6.0780 6.0780 6.0780 6.0780 9.0286 9.0286 9.0286 9.0286 9.2353 9.2353 9.2353 9.2353 9.4006 9.4006 9.4006 9.4006 9.6279 9.6279 9.6279 9.6279 10.9685 10.9685 10.9685 10.9685 11.0013 11.0013 11.0013 11.0013 11.9208 11.9208 11.9208 11.9208 12.0742 12.0742 12.0742 12.0742 12.3225 12.3225 12.3225 12.3225 12.4077 12.4077 12.4077 12.4077 14.1785 14.1785 14.1785 14.1785 14.7404 14.7404 k = 0.4167 0.3045 0.2765 ( 3760 PWs) bands (ev): 0.7163 0.7163 0.7163 0.7163 1.3725 1.3725 1.3725 1.3725 5.5847 5.5847 5.5847 5.5847 6.1530 6.1530 6.1530 6.1530 9.0025 9.0025 9.0025 9.0025 9.2372 9.2372 9.2372 9.2372 9.3943 9.3943 9.3943 9.3943 9.6514 9.6514 9.6514 9.6514 10.9647 10.9647 10.9647 10.9647 10.9991 10.9991 10.9991 10.9991 11.9011 11.9011 11.9011 11.9011 12.0803 12.0803 12.0803 12.0803 12.3227 12.3227 12.3227 12.3227 12.4262 12.4262 12.4262 12.4262 14.1143 14.1143 14.1143 14.1143 14.7086 14.7086 k = 0.4062 0.3045 0.2765 ( 3752 PWs) bands (ev): 0.6527 0.6527 0.6527 0.6527 1.3761 1.3761 1.3761 1.3761 5.6101 5.6101 5.6101 5.6101 6.2305 6.2305 6.2305 6.2305 8.9758 8.9758 8.9758 8.9758 9.2377 9.2377 9.2377 9.2377 9.3894 9.3894 9.3894 9.3894 9.6754 9.6754 9.6754 9.6754 10.9610 10.9610 10.9610 10.9610 10.9969 10.9969 10.9969 10.9969 11.8801 11.8801 11.8801 11.8801 12.0863 12.0863 12.0863 12.0863 12.3229 12.3229 12.3229 12.3229 12.4472 12.4472 12.4472 12.4472 14.0519 14.0519 14.0519 14.0519 14.6728 14.6728 k = 0.3958 0.3045 0.2765 ( 3740 PWs) bands (ev): 0.5884 0.5884 0.5884 0.5884 1.3747 1.3747 1.3747 1.3747 5.6432 5.6432 5.6432 5.6432 6.3097 6.3097 6.3097 6.3097 8.9488 8.9488 8.9488 8.9488 9.2370 9.2370 9.2370 9.2370 9.3856 9.3856 9.3856 9.3856 9.7000 9.7000 9.7000 9.7000 10.9574 10.9574 10.9574 10.9574 10.9947 10.9947 10.9947 10.9947 11.8578 11.8578 11.8578 11.8578 12.0920 12.0920 12.0920 12.0920 12.3233 12.3233 12.3233 12.3233 12.4706 12.4706 12.4706 12.4706 13.9914 13.9914 13.9914 13.9914 14.6346 14.6346 k = 0.3854 0.3045 0.2765 ( 3748 PWs) bands (ev): 0.5236 0.5236 0.5236 0.5236 1.3687 1.3687 1.3687 1.3687 5.6836 5.6836 5.6836 5.6836 6.3902 6.3902 6.3902 6.3902 8.9217 8.9217 8.9217 8.9217 9.2350 9.2350 9.2350 9.2350 9.3831 9.3831 9.3831 9.3831 9.7249 9.7249 9.7249 9.7249 10.9539 10.9539 10.9539 10.9539 10.9924 10.9924 10.9924 10.9924 11.8344 11.8344 11.8344 11.8344 12.0971 12.0971 12.0971 12.0971 12.3236 12.3236 12.3236 12.3236 12.4964 12.4964 12.4964 12.4964 13.9330 13.9330 13.9330 13.9330 14.5948 14.5948 k = 0.3750 0.3045 0.2765 ( 3748 PWs) bands (ev): 0.4588 0.4588 0.4588 0.4588 1.3582 1.3582 1.3582 1.3582 5.7311 5.7311 5.7311 5.7311 6.4712 6.4712 6.4712 6.4712 8.8950 8.8950 8.8950 8.8950 9.2318 9.2318 9.2318 9.2318 9.3817 9.3817 9.3817 9.3817 9.7503 9.7503 9.7503 9.7503 10.9508 10.9508 10.9508 10.9508 10.9905 10.9905 10.9905 10.9905 11.8101 11.8101 11.8101 11.8101 12.1016 12.1016 12.1016 12.1016 12.3242 12.3242 12.3242 12.3242 12.5246 12.5246 12.5246 12.5246 13.8769 13.8769 13.8769 13.8769 14.5544 14.5544 k = 0.3646 0.3045 0.2765 ( 3748 PWs) bands (ev): 0.3940 0.3940 0.3940 0.3940 1.3437 1.3437 1.3437 1.3437 5.7852 5.7852 5.7852 5.7852 6.5522 6.5522 6.5522 6.5522 8.8689 8.8689 8.8689 8.8689 9.2275 9.2275 9.2275 9.2275 9.3816 9.3816 9.3816 9.3816 9.7761 9.7761 9.7761 9.7761 10.9481 10.9481 10.9481 10.9481 10.9888 10.9888 10.9888 10.9888 11.7849 11.7849 11.7849 11.7849 12.1052 12.1052 12.1052 12.1052 12.3251 12.3251 12.3251 12.3251 12.5553 12.5553 12.5553 12.5553 13.8232 13.8232 13.8232 13.8232 14.5136 14.5136 k = 0.3542 0.3045 0.2765 ( 3752 PWs) bands (ev): 0.3295 0.3295 0.3295 0.3295 1.3254 1.3254 1.3254 1.3254 5.8453 5.8453 5.8453 5.8453 6.6325 6.6325 6.6325 6.6325 8.8438 8.8438 8.8438 8.8438 9.2221 9.2221 9.2221 9.2221 9.3827 9.3827 9.3827 9.3827 9.8022 9.8022 9.8022 9.8022 10.9458 10.9458 10.9458 10.9458 10.9875 10.9875 10.9875 10.9875 11.7590 11.7590 11.7590 11.7590 12.1077 12.1077 12.1077 12.1077 12.3265 12.3265 12.3265 12.3265 12.5886 12.5886 12.5886 12.5886 13.7721 13.7721 13.7721 13.7721 14.4727 14.4727 k = 0.3438 0.3045 0.2765 ( 3748 PWs) bands (ev): 0.2656 0.2656 0.2656 0.2656 1.3037 1.3037 1.3037 1.3037 5.9109 5.9109 5.9109 5.9109 6.7115 6.7115 6.7115 6.7115 8.8199 8.8199 8.8199 8.8199 9.2159 9.2159 9.2159 9.2159 9.3852 9.3852 9.3852 9.3852 9.8288 9.8288 9.8288 9.8288 10.9439 10.9439 10.9439 10.9439 10.9868 10.9868 10.9868 10.9868 11.7326 11.7326 11.7326 11.7326 12.1091 12.1091 12.1091 12.1091 12.3285 12.3285 12.3285 12.3285 12.6245 12.6245 12.6245 12.6245 13.7238 13.7238 13.7238 13.7238 14.4321 14.4321 k = 0.3333 0.3045 0.2765 ( 3744 PWs) bands (ev): 0.2023 0.2023 0.2023 0.2023 1.2791 1.2791 1.2791 1.2791 5.9816 5.9816 5.9816 5.9816 6.7884 6.7884 6.7884 6.7884 8.7977 8.7977 8.7977 8.7977 9.2088 9.2088 9.2088 9.2088 9.3891 9.3891 9.3891 9.3891 9.8557 9.8557 9.8557 9.8557 10.9426 10.9426 10.9426 10.9426 10.9866 10.9866 10.9866 10.9866 11.7058 11.7058 11.7058 11.7058 12.1090 12.1090 12.1090 12.1090 12.3311 12.3311 12.3311 12.3311 12.6631 12.6631 12.6631 12.6631 13.6784 13.6784 13.6784 13.6784 14.3918 14.3918 k = 0.3229 0.3045 0.2765 ( 3748 PWs) bands (ev): 0.1398 0.1398 0.1398 0.1398 1.2519 1.2519 1.2519 1.2519 6.0566 6.0566 6.0566 6.0566 6.8625 6.8625 6.8625 6.8625 8.7775 8.7775 8.7775 8.7775 9.2011 9.2011 9.2011 9.2011 9.3946 9.3946 9.3946 9.3946 9.8828 9.8828 9.8828 9.8828 10.9416 10.9416 10.9416 10.9416 10.9871 10.9871 10.9871 10.9871 11.6787 11.6787 11.6787 11.6787 12.1073 12.1073 12.1073 12.1073 12.3344 12.3344 12.3344 12.3344 12.7044 12.7044 12.7044 12.7044 13.6360 13.6360 13.6360 13.6360 14.3519 14.3519 k = 0.3125 0.3045 0.2765 ( 3760 PWs) bands (ev): 0.0783 0.0783 0.0783 0.0783 1.2226 1.2226 1.2226 1.2226 6.1354 6.1354 6.1354 6.1354 6.9332 6.9332 6.9332 6.9332 8.7596 8.7596 8.7596 8.7596 9.1929 9.1929 9.1929 9.1929 9.4018 9.4018 9.4018 9.4018 9.9101 9.9101 9.9101 9.9101 10.9411 10.9411 10.9411 10.9411 10.9883 10.9883 10.9883 10.9883 11.6516 11.6516 11.6516 11.6516 12.1040 12.1040 12.1040 12.1040 12.3383 12.3383 12.3383 12.3383 12.7485 12.7485 12.7485 12.7485 13.5969 13.5969 13.5969 13.5969 14.3126 14.3126 k = 0.3021 0.3045 0.2765 ( 3764 PWs) bands (ev): 0.0180 0.0180 0.0180 0.0180 1.1914 1.1914 1.1914 1.1914 6.2174 6.2174 6.2174 6.2174 6.9996 6.9996 6.9996 6.9996 8.7443 8.7443 8.7443 8.7443 9.1844 9.1844 9.1844 9.1844 9.4110 9.4110 9.4110 9.4110 9.9375 9.9375 9.9375 9.9375 10.9410 10.9410 10.9410 10.9410 10.9903 10.9903 10.9903 10.9903 11.6246 11.6246 11.6246 11.6246 12.0993 12.0993 12.0993 12.0993 12.3429 12.3429 12.3429 12.3429 12.7955 12.7955 12.7955 12.7955 13.5611 13.5611 13.5611 13.5611 14.2740 14.2740 k = 0.2917 0.3045 0.2765 ( 3760 PWs) bands (ev): -0.0412 -0.0412 -0.0412 -0.0412 1.1587 1.1587 1.1587 1.1587 6.3020 6.3020 6.3020 6.3020 7.0613 7.0613 7.0613 7.0613 8.7319 8.7319 8.7319 8.7319 9.1758 9.1758 9.1758 9.1758 9.4221 9.4221 9.4221 9.4221 9.9650 9.9650 9.9650 9.9650 10.9412 10.9412 10.9412 10.9412 10.9931 10.9931 10.9931 10.9931 11.5979 11.5979 11.5979 11.5979 12.0931 12.0931 12.0931 12.0931 12.3478 12.3478 12.3478 12.3478 12.8456 12.8456 12.8456 12.8456 13.5291 13.5291 13.5291 13.5291 14.2361 14.2361 k = 0.2812 0.3045 0.2765 ( 3764 PWs) bands (ev): -0.0990 -0.0990 -0.0990 -0.0990 1.1250 1.1250 1.1250 1.1250 6.3886 6.3886 6.3886 6.3886 7.1176 7.1176 7.1176 7.1176 8.7225 8.7225 8.7225 8.7225 9.1674 9.1674 9.1674 9.1674 9.4355 9.4355 9.4355 9.4355 9.9923 9.9923 9.9923 9.9923 10.9416 10.9416 10.9416 10.9416 10.9968 10.9968 10.9968 10.9968 11.5716 11.5716 11.5716 11.5716 12.0856 12.0856 12.0856 12.0856 12.3528 12.3528 12.3528 12.3528 12.8987 12.8987 12.8987 12.8987 13.5008 13.5008 13.5008 13.5008 14.1991 14.1991 k = 0.2708 0.3045 0.2765 ( 3760 PWs) bands (ev): -0.1553 -0.1553 -0.1553 -0.1553 1.0904 1.0904 1.0904 1.0904 6.4764 6.4764 6.4764 6.4764 7.1681 7.1681 7.1681 7.1681 8.7163 8.7163 8.7163 8.7163 9.1595 9.1595 9.1595 9.1595 9.4513 9.4513 9.4513 9.4513 10.0193 10.0193 10.0193 10.0193 10.9421 10.9421 10.9421 10.9421 11.0014 11.0014 11.0014 11.0014 11.5460 11.5460 11.5460 11.5460 12.0769 12.0769 12.0769 12.0769 12.3578 12.3578 12.3578 12.3578 12.9549 12.9549 12.9549 12.9549 13.4767 13.4767 13.4767 13.4767 14.1631 14.1631 k = 0.2604 0.3045 0.2765 ( 3768 PWs) bands (ev): -0.2101 -0.2101 -0.2101 -0.2101 1.0553 1.0553 1.0553 1.0553 6.5650 6.5650 6.5650 6.5650 7.2124 7.2124 7.2124 7.2124 8.7131 8.7131 8.7131 8.7131 9.1522 9.1522 9.1522 9.1522 9.4696 9.4696 9.4696 9.4696 10.0458 10.0458 10.0458 10.0458 10.9423 10.9423 10.9423 10.9423 11.0070 11.0070 11.0070 11.0070 11.5213 11.5213 11.5213 11.5213 12.0670 12.0670 12.0670 12.0670 12.3625 12.3625 12.3625 12.3625 13.0143 13.0143 13.0143 13.0143 13.4569 13.4569 13.4569 13.4569 14.1283 14.1283 k = 0.2500 0.3045 0.2765 ( 3776 PWs) bands (ev): -0.2633 -0.2633 -0.2633 -0.2633 1.0199 1.0199 1.0199 1.0199 6.6536 6.6536 6.6536 6.6536 7.2503 7.2503 7.2503 7.2503 8.7128 8.7128 8.7128 8.7128 9.1459 9.1459 9.1459 9.1459 9.4906 9.4906 9.4906 9.4906 10.0716 10.0716 10.0716 10.0716 10.9422 10.9422 10.9422 10.9422 11.0135 11.0135 11.0135 11.0135 11.4977 11.4977 11.4977 11.4977 12.0564 12.0564 12.0564 12.0564 12.3667 12.3667 12.3667 12.3667 13.0767 13.0767 13.0767 13.0767 13.4418 13.4418 13.4418 13.4418 14.0947 14.0947 k = 0.2396 0.3045 0.2765 ( 3784 PWs) bands (ev): -0.3147 -0.3147 -0.3147 -0.3147 0.9845 0.9845 0.9845 0.9845 6.7417 6.7417 6.7417 6.7417 7.2820 7.2820 7.2820 7.2820 8.7151 8.7151 8.7151 8.7151 9.1409 9.1409 9.1409 9.1409 9.5144 9.5144 9.5144 9.5144 10.0964 10.0964 10.0964 10.0964 10.9415 10.9415 10.9415 10.9415 11.0212 11.0212 11.0212 11.0212 11.4755 11.4755 11.4755 11.4755 12.0449 12.0449 12.0449 12.0449 12.3702 12.3702 12.3702 12.3702 13.1421 13.1421 13.1421 13.1421 13.4315 13.4315 13.4315 13.4315 14.0628 14.0628 k = 0.2292 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.3644 -0.3644 -0.3644 -0.3644 0.9494 0.9494 0.9494 0.9494 6.8285 6.8285 6.8285 6.8285 7.3075 7.3075 7.3075 7.3075 8.7196 8.7196 8.7196 8.7196 9.1375 9.1375 9.1375 9.1375 9.5410 9.5410 9.5410 9.5410 10.1199 10.1199 10.1199 10.1199 10.9399 10.9399 10.9399 10.9399 11.0299 11.0299 11.0299 11.0299 11.4549 11.4549 11.4549 11.4549 12.0330 12.0330 12.0330 12.0330 12.3727 12.3727 12.3727 12.3727 13.2102 13.2102 13.2102 13.2102 13.4264 13.4264 13.4264 13.4264 14.0327 14.0327 k = 0.2188 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.4123 -0.4123 -0.4123 -0.4123 0.9147 0.9147 0.9147 0.9147 6.9136 6.9136 6.9136 6.9136 7.3274 7.3274 7.3274 7.3274 8.7258 8.7258 8.7258 8.7258 9.1361 9.1361 9.1361 9.1361 9.5703 9.5703 9.5703 9.5703 10.1419 10.1419 10.1419 10.1419 10.9371 10.9371 10.9371 10.9371 11.0400 11.0400 11.0400 11.0400 11.4363 11.4363 11.4363 11.4363 12.0205 12.0205 12.0205 12.0205 12.3742 12.3742 12.3742 12.3742 13.2806 13.2806 13.2806 13.2806 13.4267 13.4267 13.4267 13.4267 14.0051 14.0051 k = 0.2083 0.3045 0.2765 ( 3792 PWs) bands (ev): -0.4582 -0.4582 -0.4582 -0.4582 0.8806 0.8806 0.8806 0.8806 6.9962 6.9962 6.9962 6.9962 7.3420 7.3420 7.3420 7.3420 8.7332 8.7332 8.7332 8.7332 9.1369 9.1369 9.1369 9.1369 9.6023 9.6023 9.6023 9.6023 10.1620 10.1620 10.1620 10.1620 10.9327 10.9327 10.9327 10.9327 11.0512 11.0512 11.0512 11.0512 11.4198 11.4198 11.4198 11.4198 12.0079 12.0079 12.0079 12.0079 12.3746 12.3746 12.3746 12.3746 13.3519 13.3519 13.3519 13.3519 13.4329 13.4329 13.4329 13.4329 13.9806 13.9806 k = 0.1979 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.5022 -0.5022 -0.5022 -0.5022 0.8473 0.8473 0.8473 0.8473 7.0757 7.0757 7.0757 7.0757 7.3521 7.3521 7.3521 7.3521 8.7413 8.7413 8.7413 8.7413 9.1402 9.1402 9.1402 9.1402 9.6367 9.6367 9.6367 9.6367 10.1801 10.1801 10.1801 10.1801 10.9266 10.9266 10.9266 10.9266 11.0638 11.0638 11.0638 11.0638 11.4057 11.4057 11.4057 11.4057 11.9952 11.9952 11.9952 11.9952 12.3738 12.3738 12.3738 12.3738 13.4191 13.4191 13.4191 13.4191 13.4490 13.4490 13.4490 13.4490 13.9608 13.9608 k = 0.1875 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.5442 -0.5442 -0.5442 -0.5442 0.8149 0.8149 0.8149 0.8149 7.1515 7.1515 7.1515 7.1515 7.3582 7.3582 7.3582 7.3582 8.7498 8.7498 8.7498 8.7498 9.1463 9.1463 9.1463 9.1463 9.6732 9.6732 9.6732 9.6732 10.1957 10.1957 10.1957 10.1957 10.9184 10.9184 10.9184 10.9184 11.0777 11.0777 11.0777 11.0777 11.3941 11.3941 11.3941 11.3941 11.9825 11.9825 11.9825 11.9825 12.3720 12.3720 12.3720 12.3720 13.4537 13.4537 13.4537 13.4537 13.5007 13.5007 13.5007 13.5007 13.9480 13.9480 k = 0.1771 0.3045 0.2765 ( 3780 PWs) bands (ev): -0.5842 -0.5842 -0.5842 -0.5842 0.7837 0.7837 0.7837 0.7837 7.2230 7.2230 7.2230 7.2230 7.3612 7.3612 7.3612 7.3612 8.7583 8.7583 8.7583 8.7583 9.1555 9.1555 9.1555 9.1555 9.7116 9.7116 9.7116 9.7116 10.2087 10.2087 10.2087 10.2087 10.9080 10.9080 10.9080 10.9080 11.0928 11.0928 11.0928 11.0928 11.3851 11.3851 11.3851 11.3851 11.9700 11.9700 11.9700 11.9700 12.3691 12.3691 12.3691 12.3691 13.4770 13.4770 13.4770 13.4770 13.5628 13.5628 13.5628 13.5628 13.9463 13.9463 k = 0.1667 0.3045 0.2765 ( 3776 PWs) bands (ev): -0.6220 -0.6220 -0.6220 -0.6220 0.7536 0.7536 0.7536 0.7536 7.2885 7.2885 7.2885 7.2885 7.3629 7.3629 7.3629 7.3629 8.7665 8.7665 8.7665 8.7665 9.1677 9.1677 9.1677 9.1677 9.7514 9.7514 9.7514 9.7514 10.2187 10.2187 10.2187 10.2187 10.8954 10.8954 10.8954 10.8954 11.1089 11.1089 11.1089 11.1089 11.3786 11.3786 11.3786 11.3786 11.9579 11.9579 11.9579 11.9579 12.3653 12.3653 12.3653 12.3653 13.5040 13.5040 13.5040 13.5040 13.6138 13.6138 13.6138 13.6138 13.9617 13.9617 k = 0.1562 0.3045 0.2765 ( 3784 PWs) bands (ev): -0.6577 -0.6577 -0.6577 -0.6577 0.7249 0.7249 0.7249 0.7249 7.3378 7.3378 7.3378 7.3378 7.3736 7.3736 7.3736 7.3736 8.7741 8.7741 8.7741 8.7741 9.1832 9.1832 9.1832 9.1832 9.7922 9.7922 9.7922 9.7922 10.2258 10.2258 10.2258 10.2258 10.8806 10.8806 10.8806 10.8806 11.1260 11.1260 11.1260 11.1260 11.3743 11.3743 11.3743 11.3743 11.9462 11.9462 11.9462 11.9462 12.3607 12.3607 12.3607 12.3607 13.5353 13.5353 13.5353 13.5353 13.6471 13.6471 13.6471 13.6471 13.9998 13.9998 k = 0.1458 0.3045 0.2765 ( 3784 PWs) bands (ev): -0.6913 -0.6913 -0.6913 -0.6913 0.6976 0.6976 0.6976 0.6976 7.3460 7.3460 7.3460 7.3460 7.4186 7.4186 7.4186 7.4186 8.7813 8.7813 8.7813 8.7813 9.2020 9.2020 9.2020 9.2020 9.8337 9.8337 9.8337 9.8337 10.2298 10.2298 10.2298 10.2298 10.8638 10.8638 10.8638 10.8638 11.1438 11.1438 11.1438 11.1438 11.3723 11.3723 11.3723 11.3723 11.9351 11.9351 11.9351 11.9351 12.3555 12.3555 12.3555 12.3555 13.5700 13.5700 13.5700 13.5700 13.6633 13.6633 13.6633 13.6633 14.0600 14.0600 k = 0.1354 0.3045 0.2765 ( 3772 PWs) bands (ev): -0.7227 -0.7227 -0.7227 -0.7227 0.6718 0.6718 0.6718 0.6718 7.3423 7.3423 7.3423 7.3423 7.4690 7.4690 7.4690 7.4690 8.7878 8.7878 8.7878 8.7878 9.2238 9.2238 9.2238 9.2238 9.8755 9.8755 9.8755 9.8755 10.2307 10.2307 10.2307 10.2307 10.8451 10.8451 10.8451 10.8451 11.1620 11.1620 11.1620 11.1620 11.3722 11.3722 11.3722 11.3722 11.9248 11.9248 11.9248 11.9248 12.3499 12.3499 12.3499 12.3499 13.6052 13.6052 13.6052 13.6052 13.6706 13.6706 13.6706 13.6706 14.1368 14.1368 k = 0.1250 0.3045 0.2765 ( 3772 PWs) bands (ev): -0.7518 -0.7518 -0.7518 -0.7518 0.6477 0.6477 0.6477 0.6477 7.3362 7.3362 7.3362 7.3362 7.5155 7.5155 7.5155 7.5155 8.7935 8.7935 8.7935 8.7935 9.2486 9.2486 9.2486 9.2486 9.9171 9.9171 9.9171 9.9171 10.2286 10.2286 10.2286 10.2286 10.8249 10.8249 10.8249 10.8249 11.1802 11.1802 11.1802 11.1802 11.3736 11.3736 11.3736 11.3736 11.9153 11.9153 11.9153 11.9153 12.3440 12.3440 12.3440 12.3440 13.6288 13.6288 13.6288 13.6288 13.6859 13.6859 13.6859 13.6859 14.2238 14.2238 k = 0.1146 0.3045 0.2765 ( 3780 PWs) bands (ev): -0.7787 -0.7787 -0.7787 -0.7787 0.6252 0.6252 0.6252 0.6252 7.3292 7.3292 7.3292 7.3292 7.5571 7.5571 7.5571 7.5571 8.7986 8.7986 8.7986 8.7986 9.2758 9.2758 9.2758 9.2758 9.9583 9.9583 9.9583 9.9583 10.2237 10.2237 10.2237 10.2237 10.8032 10.8032 10.8032 10.8032 11.1982 11.1982 11.1982 11.1982 11.3762 11.3762 11.3762 11.3762 11.9066 11.9066 11.9066 11.9066 12.3380 12.3380 12.3380 12.3380 13.6303 13.6303 13.6303 13.6303 13.7228 13.7228 13.7228 13.7228 14.3169 14.3169 k = 0.1042 0.3045 0.2765 ( 3780 PWs) bands (ev): -0.8034 -0.8034 -0.8034 -0.8034 0.6045 0.6045 0.6045 0.6045 7.3218 7.3218 7.3218 7.3218 7.5939 7.5939 7.5939 7.5939 8.8031 8.8031 8.8031 8.8031 9.3052 9.3052 9.3052 9.3052 9.9986 9.9986 9.9986 9.9986 10.2163 10.2163 10.2163 10.2163 10.7805 10.7805 10.7805 10.7805 11.2155 11.2155 11.2155 11.2155 11.3798 11.3798 11.3798 11.3798 11.8990 11.8990 11.8990 11.8990 12.3320 12.3320 12.3320 12.3320 13.6223 13.6223 13.6223 13.6223 13.7704 13.7704 13.7704 13.7704 14.4134 14.4134 k = 0.0938 0.3045 0.2765 ( 3780 PWs) bands (ev): -0.8257 -0.8257 -0.8257 -0.8257 0.5855 0.5855 0.5855 0.5855 7.3144 7.3144 7.3144 7.3144 7.6258 7.6258 7.6258 7.6258 8.8070 8.8070 8.8070 8.8070 9.3361 9.3361 9.3361 9.3361 10.0376 10.0376 10.0376 10.0376 10.2068 10.2068 10.2068 10.2068 10.7570 10.7570 10.7570 10.7570 11.2320 11.2320 11.2320 11.2320 11.3840 11.3840 11.3840 11.3840 11.8923 11.8923 11.8923 11.8923 12.3262 12.3262 12.3262 12.3262 13.6117 13.6117 13.6117 13.6117 13.8219 13.8219 13.8219 13.8219 14.5112 14.5112 k = 0.0833 0.3045 0.2765 ( 3772 PWs) bands (ev): -0.8458 -0.8458 -0.8458 -0.8458 0.5685 0.5685 0.5685 0.5685 7.3072 7.3072 7.3072 7.3072 7.6532 7.6532 7.6532 7.6532 8.8103 8.8103 8.8103 8.8103 9.3679 9.3679 9.3679 9.3679 10.0746 10.0746 10.0746 10.0746 10.1961 10.1961 10.1961 10.1961 10.7331 10.7331 10.7331 10.7331 11.2473 11.2473 11.2473 11.2473 11.3887 11.3887 11.3887 11.3887 11.8866 11.8866 11.8866 11.8866 12.3207 12.3207 12.3207 12.3207 13.6007 13.6007 13.6007 13.6007 13.8751 13.8751 13.8751 13.8751 14.6087 14.6087 k = 0.0729 0.3045 0.2765 ( 3780 PWs) bands (ev): -0.8635 -0.8635 -0.8635 -0.8635 0.5533 0.5533 0.5533 0.5533 7.3004 7.3004 7.3004 7.3004 7.6764 7.6764 7.6764 7.6764 8.8131 8.8131 8.8131 8.8131 9.3997 9.3997 9.3997 9.3997 10.1078 10.1078 10.1078 10.1078 10.1859 10.1859 10.1859 10.1859 10.7089 10.7089 10.7089 10.7089 11.2611 11.2611 11.2611 11.2611 11.3934 11.3934 11.3934 11.3934 11.8819 11.8819 11.8819 11.8819 12.3156 12.3156 12.3156 12.3156 13.5901 13.5901 13.5901 13.5901 13.9282 13.9282 13.9282 13.9282 14.7047 14.7047 k = 0.0625 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.8789 -0.8789 -0.8789 -0.8789 0.5401 0.5401 0.5401 0.5401 7.2942 7.2942 7.2942 7.2942 7.6957 7.6957 7.6957 7.6957 8.8154 8.8154 8.8154 8.8154 9.4308 9.4308 9.4308 9.4308 10.1313 10.1313 10.1313 10.1313 10.1825 10.1825 10.1825 10.1825 10.6850 10.6850 10.6850 10.6850 11.2732 11.2732 11.2732 11.2732 11.3980 11.3980 11.3980 11.3980 11.8780 11.8780 11.8780 11.8780 12.3109 12.3109 12.3109 12.3109 13.5804 13.5804 13.5804 13.5804 13.9797 13.9797 13.9797 13.9797 14.7977 14.7977 k = 0.0521 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.8919 -0.8919 -0.8919 -0.8919 0.5289 0.5289 0.5289 0.5289 7.2887 7.2887 7.2887 7.2887 7.7114 7.7114 7.7114 7.7114 8.8173 8.8173 8.8173 8.8173 9.4600 9.4600 9.4600 9.4600 10.1343 10.1343 10.1343 10.1343 10.1969 10.1969 10.1969 10.1969 10.6619 10.6619 10.6619 10.6619 11.2836 11.2836 11.2836 11.2836 11.4023 11.4023 11.4023 11.4023 11.8750 11.8750 11.8750 11.8750 12.3069 12.3069 12.3069 12.3069 13.5719 13.5719 13.5719 13.5719 14.0281 14.0281 14.0281 14.0281 14.8867 14.8867 k = 0.0417 0.3045 0.2765 ( 3792 PWs) bands (ev): -0.9026 -0.9026 -0.9026 -0.9026 0.5197 0.5197 0.5197 0.5197 7.2841 7.2841 7.2841 7.2841 7.7238 7.7238 7.7238 7.7238 8.8188 8.8188 8.8188 8.8188 9.4864 9.4864 9.4864 9.4864 10.1253 10.1253 10.1253 10.1253 10.2206 10.2206 10.2206 10.2206 10.6402 10.6402 10.6402 10.6402 11.2921 11.2921 11.2921 11.2921 11.4061 11.4061 11.4061 11.4061 11.8725 11.8725 11.8725 11.8725 12.3035 12.3035 12.3035 12.3035 13.5647 13.5647 13.5647 13.5647 14.0714 14.0714 14.0714 14.0714 14.9701 14.9701 k = 0.0312 0.3045 0.2765 ( 3784 PWs) bands (ev): -0.9109 -0.9109 -0.9109 -0.9109 0.5125 0.5125 0.5125 0.5125 7.2805 7.2805 7.2805 7.2805 7.7332 7.7332 7.7332 7.7332 8.8200 8.8200 8.8200 8.8200 9.5087 9.5087 9.5087 9.5087 10.1146 10.1146 10.1146 10.1146 10.2437 10.2437 10.2437 10.2437 10.6211 10.6211 10.6211 10.6211 11.2988 11.2988 11.2988 11.2988 11.4094 11.4094 11.4094 11.4094 11.8709 11.8709 11.8709 11.8709 12.3008 12.3008 12.3008 12.3008 13.5590 13.5590 13.5590 13.5590 14.1078 14.1078 14.1078 14.1078 15.0461 15.0461 k = 0.0208 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.9168 -0.9168 -0.9168 -0.9168 0.5073 0.5073 0.5073 0.5073 7.2778 7.2778 7.2778 7.2778 7.7398 7.7398 7.7398 7.7398 8.8207 8.8207 8.8207 8.8207 9.5258 9.5258 9.5258 9.5258 10.1053 10.1053 10.1053 10.1053 10.2623 10.2623 10.2623 10.2623 10.6057 10.6057 10.6057 10.6057 11.3035 11.3035 11.3035 11.3035 11.4118 11.4118 11.4118 11.4118 11.8698 11.8698 11.8698 11.8698 12.2988 12.2988 12.2988 12.2988 13.5549 13.5549 13.5549 13.5549 14.1354 14.1354 14.1354 14.1354 15.1115 15.1115 k = 0.0104 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.9204 -0.9204 -0.9204 -0.9204 0.5042 0.5042 0.5042 0.5042 7.2762 7.2762 7.2762 7.2762 7.7437 7.7437 7.7437 7.7437 8.8212 8.8212 8.8212 8.8212 9.5365 9.5365 9.5365 9.5365 10.0992 10.0992 10.0992 10.0992 10.2745 10.2745 10.2745 10.2745 10.5955 10.5955 10.5955 10.5955 11.3063 11.3063 11.3063 11.3063 11.4133 11.4133 11.4133 11.4133 11.8691 11.8691 11.8691 11.8691 12.2976 12.2976 12.2976 12.2976 13.5524 13.5524 13.5524 13.5524 14.1527 14.1527 14.1527 14.1527 15.1587 15.1587 k = 0.0000 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.9216 -0.9216 -0.9216 -0.9216 0.5032 0.5032 0.5032 0.5032 7.2756 7.2756 7.2756 7.2756 7.7449 7.7449 7.7449 7.7449 8.8213 8.8213 8.8213 8.8213 9.5402 9.5402 9.5402 9.5402 10.0971 10.0971 10.0971 10.0971 10.2788 10.2788 10.2788 10.2788 10.5920 10.5920 10.5920 10.5920 11.3073 11.3073 11.3073 11.3073 11.4138 11.4138 11.4138 11.4138 11.8689 11.8689 11.8689 11.8689 12.2972 12.2972 12.2972 12.2972 13.5515 13.5515 13.5515 13.5515 14.1586 14.1586 14.1586 14.1586 15.1757 15.1757 k = 0.0000 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.9216 -0.9216 -0.9216 -0.9216 0.5032 0.5032 0.5032 0.5032 7.2756 7.2756 7.2756 7.2756 7.7449 7.7449 7.7449 7.7449 8.8213 8.8213 8.8213 8.8213 9.5402 9.5402 9.5402 9.5402 10.0971 10.0971 10.0971 10.0971 10.2788 10.2788 10.2788 10.2788 10.5920 10.5920 10.5920 10.5920 11.3073 11.3073 11.3073 11.3073 11.4138 11.4138 11.4138 11.4138 11.8689 11.8689 11.8689 11.8689 12.2972 12.2972 12.2972 12.2972 13.5515 13.5515 13.5515 13.5515 14.1586 14.1586 14.1586 14.1586 15.1757 15.1758 k = 0.0000 0.2943 0.2765 ( 3780 PWs) bands (ev): -0.9238 -0.9238 -0.9238 -0.9238 0.5068 0.5068 0.5068 0.5068 7.2689 7.2689 7.2689 7.2689 7.7475 7.7475 7.7475 7.7475 8.8246 8.8246 8.8246 8.8246 9.5395 9.5395 9.5395 9.5395 10.0938 10.0938 10.0938 10.0938 10.2799 10.2799 10.2799 10.2799 10.5932 10.5932 10.5932 10.5932 11.3073 11.3073 11.3073 11.3073 11.4129 11.4129 11.4129 11.4129 11.8698 11.8698 11.8698 11.8698 12.2965 12.2965 12.2965 12.2965 13.5473 13.5473 13.5473 13.5473 14.1638 14.1638 14.1638 14.1638 15.1679 15.1679 k = 0.0000 0.2842 0.2765 ( 3776 PWs) bands (ev): -0.9303 -0.9303 -0.9303 -0.9303 0.5175 0.5175 0.5175 0.5175 7.2493 7.2493 7.2493 7.2493 7.7545 7.7545 7.7545 7.7545 8.8343 8.8343 8.8343 8.8343 9.5376 9.5376 9.5376 9.5376 10.0839 10.0839 10.0839 10.0839 10.2833 10.2833 10.2833 10.2833 10.5965 10.5965 10.5965 10.5965 11.3073 11.3073 11.3073 11.3073 11.4102 11.4102 11.4102 11.4102 11.8724 11.8724 11.8724 11.8724 12.2942 12.2942 12.2942 12.2942 13.5351 13.5351 13.5351 13.5351 14.1784 14.1784 14.1784 14.1784 15.1217 15.1217 k = 0.0000 0.2740 0.2765 ( 3776 PWs) bands (ev): -0.9408 -0.9408 -0.9408 -0.9408 0.5351 0.5351 0.5351 0.5351 7.2182 7.2182 7.2182 7.2182 7.7652 7.7652 7.7652 7.7652 8.8500 8.8500 8.8500 8.8500 9.5345 9.5345 9.5345 9.5345 10.0680 10.0680 10.0680 10.0680 10.2890 10.2890 10.2890 10.2890 10.6013 10.6013 10.6013 10.6013 11.3074 11.3074 11.3074 11.3074 11.4059 11.4059 11.4059 11.4059 11.8766 11.8766 11.8766 11.8766 12.2903 12.2903 12.2903 12.2903 13.5168 13.5168 13.5168 13.5168 14.2004 14.2004 14.2004 14.2004 15.0545 15.0545 k = 0.0000 0.2639 0.2765 ( 3774 PWs) bands (ev): -0.9550 -0.9550 -0.9550 -0.9550 0.5591 0.5591 0.5591 0.5591 7.1775 7.1775 7.1775 7.1775 7.7781 7.7781 7.7781 7.7781 8.8710 8.8710 8.8710 8.8710 9.5303 9.5303 9.5303 9.5303 10.0471 10.0471 10.0471 10.0471 10.2969 10.2969 10.2969 10.2969 10.6071 10.6071 10.6071 10.6071 11.3075 11.3075 11.3075 11.3075 11.4002 11.4002 11.4002 11.4002 11.8822 11.8822 11.8822 11.8822 12.2849 12.2849 12.2849 12.2849 13.4946 13.4946 13.4946 13.4946 14.2272 14.2272 14.2272 14.2272 14.9840 14.9840 k = 0.0000 0.2537 0.2765 ( 3782 PWs) bands (ev): -0.9725 -0.9725 -0.9725 -0.9725 0.5891 0.5891 0.5891 0.5891 7.1287 7.1287 7.1287 7.1287 7.7922 7.7922 7.7922 7.7922 8.8964 8.8964 8.8964 8.8964 9.5250 9.5250 9.5250 9.5250 10.0219 10.0219 10.0219 10.0219 10.3068 10.3068 10.3068 10.3068 10.6131 10.6131 10.6131 10.6131 11.3078 11.3078 11.3078 11.3078 11.3934 11.3934 11.3934 11.3934 11.8891 11.8891 11.8891 11.8891 12.2779 12.2779 12.2779 12.2779 13.4705 13.4705 13.4705 13.4705 14.2562 14.2562 14.2562 14.2562 14.9134 14.9134 k = 0.0000 0.2436 0.2765 ( 3774 PWs) bands (ev): -0.9926 -0.9926 -0.9926 -0.9926 0.6245 0.6245 0.6245 0.6245 7.0735 7.0735 7.0735 7.0735 7.8070 7.8070 7.8070 7.8070 8.9254 8.9254 8.9254 8.9254 9.5190 9.5190 9.5190 9.5190 9.9938 9.9938 9.9938 9.9938 10.3186 10.3186 10.3186 10.3186 10.6189 10.6189 10.6189 10.6189 11.3082 11.3082 11.3082 11.3082 11.3860 11.3860 11.3860 11.3860 11.8971 11.8971 11.8971 11.8971 12.2696 12.2696 12.2696 12.2696 13.4463 13.4463 13.4463 13.4463 14.2852 14.2852 14.2852 14.2852 14.8438 14.8438 k = 0.0000 0.2334 0.2765 ( 3782 PWs) bands (ev): -1.0150 -1.0150 -1.0150 -1.0150 0.6647 0.6647 0.6647 0.6647 7.0131 7.0131 7.0131 7.0131 7.8218 7.8218 7.8218 7.8218 8.9567 8.9567 8.9567 8.9567 9.5121 9.5121 9.5121 9.5121 9.9639 9.9639 9.9639 9.9639 10.3320 10.3320 10.3320 10.3320 10.6237 10.6237 10.6237 10.6237 11.3086 11.3086 11.3086 11.3086 11.3782 11.3782 11.3782 11.3782 11.9058 11.9058 11.9058 11.9058 12.2599 12.2599 12.2599 12.2599 13.4231 13.4231 13.4231 13.4231 14.3128 14.3128 14.3128 14.3128 14.7755 14.7755 k = 0.0000 0.2233 0.2765 ( 3782 PWs) bands (ev): -1.0391 -1.0391 -1.0391 -1.0391 0.7090 0.7090 0.7090 0.7090 6.9485 6.9485 6.9485 6.9485 7.8366 7.8366 7.8366 7.8366 8.9892 8.9892 8.9892 8.9892 9.5046 9.5046 9.5046 9.5046 9.9332 9.9332 9.9332 9.9332 10.3469 10.3469 10.3469 10.3469 10.6271 10.6271 10.6271 10.6271 11.3087 11.3087 11.3087 11.3087 11.3711 11.3711 11.3711 11.3711 11.9150 11.9150 11.9150 11.9150 12.2489 12.2489 12.2489 12.2489 13.4019 13.4019 13.4019 13.4019 14.3379 14.3379 14.3379 14.3379 14.7089 14.7089 k = 0.0000 0.2131 0.2765 ( 3778 PWs) bands (ev): -1.0645 -1.0645 -1.0645 -1.0645 0.7568 0.7568 0.7568 0.7568 6.8806 6.8806 6.8806 6.8806 7.8512 7.8512 7.8512 7.8512 9.0216 9.0216 9.0216 9.0216 9.4967 9.4967 9.4967 9.4967 9.9032 9.9032 9.9032 9.9032 10.3630 10.3630 10.3630 10.3630 10.6290 10.6290 10.6290 10.6290 11.3081 11.3081 11.3081 11.3081 11.3654 11.3654 11.3654 11.3654 11.9246 11.9246 11.9246 11.9246 12.2366 12.2366 12.2366 12.2366 13.3832 13.3832 13.3832 13.3832 14.3597 14.3597 14.3597 14.3597 14.6444 14.6444 k = 0.0000 0.2030 0.2765 ( 3772 PWs) bands (ev): -1.0906 -1.0906 -1.0906 -1.0906 0.8076 0.8076 0.8076 0.8076 6.8101 6.8101 6.8101 6.8101 7.8656 7.8656 7.8656 7.8656 9.0525 9.0525 9.0525 9.0525 9.4885 9.4885 9.4885 9.4885 9.8752 9.8752 9.8752 9.8752 10.3801 10.3801 10.3801 10.3801 10.6291 10.6291 10.6291 10.6291 11.3059 11.3059 11.3059 11.3059 11.3622 11.3622 11.3622 11.3622 11.9342 11.9342 11.9342 11.9342 12.2232 12.2232 12.2232 12.2232 13.3673 13.3673 13.3673 13.3673 14.3777 14.3777 14.3777 14.3777 14.5827 14.5827 k = 0.0000 0.1928 0.2765 ( 3780 PWs) bands (ev): -1.1171 -1.1171 -1.1171 -1.1171 0.8608 0.8608 0.8608 0.8608 6.7378 6.7378 6.7378 6.7378 7.8799 7.8799 7.8799 7.8799 9.0803 9.0803 9.0803 9.0803 9.4800 9.4800 9.4800 9.4800 9.8504 9.8504 9.8504 9.8504 10.3978 10.3978 10.3978 10.3978 10.6273 10.6273 10.6273 10.6273 11.3017 11.3017 11.3017 11.3017 11.3621 11.3621 11.3621 11.3621 11.9438 11.9438 11.9438 11.9438 12.2086 12.2086 12.2086 12.2086 13.3541 13.3541 13.3541 13.3541 14.3903 14.3903 14.3903 14.3903 14.5254 14.5254 k = 0.0000 0.1827 0.2765 ( 3774 PWs) bands (ev): -1.1437 -1.1437 -1.1437 -1.1437 0.9159 0.9159 0.9159 0.9159 6.6641 6.6641 6.6641 6.6641 7.8941 7.8941 7.8941 7.8941 9.1035 9.1035 9.1035 9.1035 9.4714 9.4714 9.4714 9.4714 9.8306 9.8306 9.8306 9.8306 10.4160 10.4160 10.4160 10.4160 10.6238 10.6238 10.6238 10.6238 11.2957 11.2957 11.2957 11.2957 11.3655 11.3655 11.3655 11.3655 11.9532 11.9532 11.9532 11.9532 12.1931 12.1931 12.1931 12.1931 13.3438 13.3438 13.3438 13.3438 14.3921 14.3921 14.3921 14.3921 14.4783 14.4783 k = 0.0000 0.1725 0.2765 ( 3770 PWs) bands (ev): -1.1701 -1.1701 -1.1701 -1.1701 0.9723 0.9723 0.9723 0.9723 6.5898 6.5898 6.5898 6.5898 7.9083 7.9083 7.9083 7.9083 9.1209 9.1209 9.1209 9.1209 9.4628 9.4628 9.4628 9.4628 9.8170 9.8170 9.8170 9.8170 10.4344 10.4344 10.4344 10.4344 10.6187 10.6187 10.6187 10.6187 11.2886 11.2886 11.2886 11.2886 11.3715 11.3715 11.3715 11.3715 11.9623 11.9623 11.9623 11.9623 12.1766 12.1766 12.1766 12.1766 13.3362 13.3362 13.3362 13.3362 14.3693 14.3693 14.3693 14.3693 14.4556 14.4556 k = 0.0000 0.1624 0.2765 ( 3778 PWs) bands (ev): -1.1959 -1.1959 -1.1959 -1.1959 1.0296 1.0296 1.0296 1.0296 6.5152 6.5152 6.5152 6.5152 7.9225 7.9225 7.9225 7.9225 9.1312 9.1312 9.1312 9.1312 9.4541 9.4541 9.4541 9.4541 9.8106 9.8106 9.8106 9.8106 10.4528 10.4528 10.4528 10.4528 10.6119 10.6119 10.6119 10.6119 11.2810 11.2810 11.2810 11.2810 11.3797 11.3797 11.3797 11.3797 11.9708 11.9708 11.9708 11.9708 12.1592 12.1592 12.1592 12.1592 13.3310 13.3310 13.3310 13.3310 14.3257 14.3257 14.3257 14.3257 14.4540 14.4540 k = 0.0000 0.1522 0.2765 ( 3782 PWs) bands (ev): -1.2210 -1.2210 -1.2210 -1.2210 1.0872 1.0872 1.0872 1.0872 6.4410 6.4410 6.4410 6.4410 7.9367 7.9367 7.9367 7.9367 9.1339 9.1339 9.1339 9.1339 9.4456 9.4456 9.4456 9.4456 9.8121 9.8121 9.8121 9.8121 10.4707 10.4707 10.4707 10.4707 10.6040 10.6040 10.6040 10.6040 11.2735 11.2735 11.2735 11.2735 11.3896 11.3896 11.3896 11.3896 11.9788 11.9788 11.9788 11.9788 12.1411 12.1411 12.1411 12.1411 13.3280 13.3280 13.3280 13.3280 14.2770 14.2770 14.2770 14.2770 14.4580 14.4580 k = 0.0000 0.1421 0.2765 ( 3776 PWs) bands (ev): -1.2452 -1.2452 -1.2452 -1.2452 1.1446 1.1446 1.1446 1.1446 6.3678 6.3678 6.3678 6.3678 7.9509 7.9509 7.9509 7.9509 9.1294 9.1294 9.1294 9.1294 9.4373 9.4373 9.4373 9.4373 9.8211 9.8211 9.8211 9.8211 10.4879 10.4879 10.4879 10.4879 10.5953 10.5953 10.5953 10.5953 11.2665 11.2665 11.2665 11.2665 11.4010 11.4010 11.4010 11.4010 11.9861 11.9861 11.9861 11.9861 12.1226 12.1226 12.1226 12.1226 13.3271 13.3271 13.3271 13.3271 14.2286 14.2286 14.2286 14.2286 14.4627 14.4627 k = 0.0000 0.1319 0.2765 ( 3768 PWs) bands (ev): -1.2683 -1.2683 -1.2683 -1.2683 1.2014 1.2014 1.2014 1.2014 6.2960 6.2960 6.2960 6.2960 7.9651 7.9651 7.9651 7.9651 9.1182 9.1182 9.1182 9.1182 9.4292 9.4292 9.4292 9.4292 9.8368 9.8368 9.8368 9.8368 10.5039 10.5039 10.5039 10.5039 10.5862 10.5862 10.5862 10.5862 11.2601 11.2601 11.2601 11.2601 11.4134 11.4134 11.4134 11.4134 11.9925 11.9925 11.9925 11.9925 12.1039 12.1039 12.1039 12.1039 13.3279 13.3279 13.3279 13.3279 14.1820 14.1820 14.1820 14.1820 14.4670 14.4670 k = 0.0000 0.1218 0.2765 ( 3766 PWs) bands (ev): -1.2901 -1.2901 -1.2901 -1.2901 1.2570 1.2570 1.2570 1.2570 6.2262 6.2262 6.2262 6.2262 7.9793 7.9793 7.9793 7.9793 9.1019 9.1019 9.1019 9.1019 9.4217 9.4217 9.4217 9.4217 9.8577 9.8577 9.8577 9.8577 10.5178 10.5178 10.5178 10.5178 10.5777 10.5777 10.5777 10.5777 11.2545 11.2545 11.2545 11.2545 11.4267 11.4267 11.4267 11.4267 11.9976 11.9976 11.9976 11.9976 12.0853 12.0853 12.0853 12.0853 13.3301 13.3301 13.3301 13.3301 14.1378 14.1378 14.1378 14.1378 14.4706 14.4706 k = 0.0000 0.1116 0.2765 ( 3762 PWs) bands (ev): -1.3106 -1.3106 -1.3106 -1.3106 1.3109 1.3109 1.3109 1.3109 6.1590 6.1590 6.1590 6.1590 7.9934 7.9934 7.9934 7.9934 9.0817 9.0817 9.0817 9.0817 9.4146 9.4146 9.4146 9.4146 9.8824 9.8824 9.8824 9.8824 10.5274 10.5274 10.5274 10.5274 10.5720 10.5720 10.5720 10.5720 11.2498 11.2498 11.2498 11.2498 11.4407 11.4407 11.4407 11.4407 12.0012 12.0012 12.0012 12.0012 12.0675 12.0675 12.0675 12.0675 13.3335 13.3335 13.3335 13.3335 14.0963 14.0963 14.0963 14.0963 14.4734 14.4734 k = 0.0000 0.1015 0.2765 ( 3760 PWs) bands (ev): -1.3296 -1.3296 -1.3296 -1.3296 1.3626 1.3626 1.3626 1.3626 6.0949 6.0949 6.0949 6.0949 8.0072 8.0072 8.0072 8.0072 9.0590 9.0590 9.0590 9.0590 9.4080 9.4080 9.4080 9.4080 9.9096 9.9096 9.9096 9.9096 10.5293 10.5293 10.5293 10.5293 10.5726 10.5726 10.5726 10.5726 11.2460 11.2460 11.2460 11.2460 11.4550 11.4550 11.4550 11.4550 12.0019 12.0019 12.0019 12.0019 12.0517 12.0517 12.0517 12.0517 13.3376 13.3376 13.3376 13.3376 14.0578 14.0578 14.0578 14.0578 14.4756 14.4756 k = 0.0000 0.0913 0.2765 ( 3752 PWs) bands (ev): -1.3470 -1.3470 -1.3470 -1.3470 1.4116 1.4116 1.4116 1.4116 6.0346 6.0346 6.0346 6.0346 8.0206 8.0206 8.0206 8.0206 9.0351 9.0351 9.0351 9.0351 9.4021 9.4021 9.4021 9.4021 9.9378 9.9378 9.9378 9.9378 10.5238 10.5238 10.5238 10.5238 10.5794 10.5794 10.5794 10.5794 11.2431 11.2431 11.2431 11.2431 11.4696 11.4696 11.4696 11.4696 11.9975 11.9975 11.9975 11.9975 12.0406 12.0406 12.0406 12.0406 13.3423 13.3423 13.3423 13.3423 14.0224 14.0224 14.0224 14.0224 14.4772 14.4772 k = 0.0000 0.0812 0.2765 ( 3752 PWs) bands (ev): -1.3628 -1.3628 -1.3628 -1.3628 1.4574 1.4574 1.4574 1.4574 5.9785 5.9785 5.9785 5.9785 8.0336 8.0336 8.0336 8.0336 9.0111 9.0111 9.0111 9.0111 9.3967 9.3967 9.3967 9.3967 9.9662 9.9662 9.9662 9.9662 10.5148 10.5148 10.5148 10.5148 10.5884 10.5884 10.5884 10.5884 11.2410 11.2410 11.2410 11.2410 11.4840 11.4840 11.4840 11.4840 11.9870 11.9870 11.9870 11.9870 12.0355 12.0355 12.0355 12.0355 13.3473 13.3473 13.3473 13.3473 13.9904 13.9904 13.9904 13.9904 14.4782 14.4782 k = 0.0000 0.0710 0.2765 ( 3760 PWs) bands (ev): -1.3768 -1.3768 -1.3768 -1.3768 1.4993 1.4993 1.4993 1.4993 5.9273 5.9273 5.9273 5.9273 8.0458 8.0458 8.0458 8.0458 8.9878 8.9878 8.9878 8.9878 9.3919 9.3919 9.3919 9.3919 9.9936 9.9936 9.9936 9.9936 10.5047 10.5047 10.5047 10.5047 10.5975 10.5975 10.5975 10.5975 11.2396 11.2396 11.2396 11.2396 11.4982 11.4982 11.4982 11.4982 11.9726 11.9726 11.9726 11.9726 12.0343 12.0343 12.0343 12.0343 13.3523 13.3523 13.3523 13.3523 13.9617 13.9617 13.9617 13.9617 14.4789 14.4789 k = 0.0000 0.0609 0.2765 ( 3764 PWs) bands (ev): -1.3891 -1.3891 -1.3891 -1.3891 1.5369 1.5369 1.5369 1.5369 5.8816 5.8816 5.8816 5.8816 8.0571 8.0571 8.0571 8.0571 8.9660 8.9660 8.9660 8.9660 9.3877 9.3877 9.3877 9.3877 10.0194 10.0194 10.0194 10.0194 10.4945 10.4945 10.4945 10.4945 10.6057 10.6057 10.6057 10.6057 11.2389 11.2389 11.2389 11.2389 11.5116 11.5116 11.5116 11.5116 11.9572 11.9572 11.9572 11.9572 12.0346 12.0346 12.0346 12.0346 13.3571 13.3571 13.3571 13.3571 13.9367 13.9367 13.9367 13.9367 14.4792 14.4792 k = 0.0000 0.0507 0.2765 ( 3764 PWs) bands (ev): -1.3996 -1.3996 -1.3996 -1.3996 1.5697 1.5697 1.5697 1.5697 5.8418 5.8418 5.8418 5.8418 8.0672 8.0672 8.0672 8.0672 8.9463 8.9463 8.9463 8.9463 9.3841 9.3841 9.3841 9.3841 10.0428 10.0428 10.0428 10.0428 10.4849 10.4849 10.4849 10.4849 10.6128 10.6128 10.6128 10.6128 11.2386 11.2386 11.2386 11.2386 11.5241 11.5241 11.5241 11.5241 11.9424 11.9424 11.9424 11.9424 12.0354 12.0354 12.0354 12.0354 13.3616 13.3616 13.3616 13.3616 13.9153 13.9153 13.9153 13.9153 14.4794 14.4794 k = 0.0000 0.0406 0.2765 ( 3760 PWs) bands (ev): -1.4082 -1.4082 -1.4082 -1.4082 1.5973 1.5973 1.5973 1.5973 5.8086 5.8086 5.8086 5.8086 8.0760 8.0760 8.0760 8.0760 8.9295 8.9295 8.9295 8.9295 9.3812 9.3812 9.3812 9.3812 10.0632 10.0632 10.0632 10.0632 10.4762 10.4762 10.4762 10.4762 10.6188 10.6188 10.6188 10.6188 11.2387 11.2387 11.2387 11.2387 11.5352 11.5352 11.5352 11.5352 11.9291 11.9291 11.9291 11.9291 12.0362 12.0362 12.0362 12.0362 13.3655 13.3655 13.3655 13.3655 13.8976 13.8976 13.8976 13.8976 14.4793 14.4793 k = 0.0000 0.0304 0.2765 ( 3758 PWs) bands (ev): -1.4149 -1.4149 -1.4149 -1.4149 1.6192 1.6192 1.6192 1.6192 5.7822 5.7822 5.7822 5.7822 8.0831 8.0831 8.0831 8.0831 8.9158 8.9158 8.9158 8.9158 9.3790 9.3790 9.3790 9.3790 10.0798 10.0798 10.0798 10.0798 10.4689 10.4689 10.4689 10.4689 10.6234 10.6234 10.6234 10.6234 11.2389 11.2389 11.2389 11.2389 11.5445 11.5445 11.5445 11.5445 11.9179 11.9179 11.9179 11.9179 12.0369 12.0369 12.0369 12.0369 13.3687 13.3687 13.3687 13.3687 13.8839 13.8839 13.8839 13.8839 14.4793 14.4793 k = 0.0000 0.0203 0.2765 ( 3758 PWs) bands (ev): -1.4198 -1.4198 -1.4198 -1.4198 1.6351 1.6351 1.6351 1.6351 5.7631 5.7631 5.7631 5.7631 8.0884 8.0884 8.0884 8.0884 8.9058 8.9058 8.9058 8.9058 9.3773 9.3773 9.3773 9.3773 10.0922 10.0922 10.0922 10.0922 10.4634 10.4634 10.4634 10.4634 10.6266 10.6266 10.6266 10.6266 11.2392 11.2392 11.2392 11.2392 11.5515 11.5515 11.5515 11.5515 11.9094 11.9094 11.9094 11.9094 12.0374 12.0374 12.0374 12.0374 13.3710 13.3710 13.3710 13.3710 13.8740 13.8740 13.8740 13.8740 14.4792 14.4792 k = 0.0000 0.0101 0.2765 ( 3762 PWs) bands (ev): -1.4227 -1.4227 -1.4227 -1.4227 1.6447 1.6447 1.6447 1.6447 5.7515 5.7515 5.7515 5.7515 8.0916 8.0916 8.0916 8.0916 8.8996 8.8996 8.8996 8.8996 9.3764 9.3764 9.3764 9.3764 10.0999 10.0999 10.0999 10.0999 10.4599 10.4599 10.4599 10.4599 10.6286 10.6286 10.6286 10.6286 11.2394 11.2394 11.2394 11.2394 11.5560 11.5560 11.5560 11.5560 11.9040 11.9040 11.9040 11.9040 12.0377 12.0377 12.0377 12.0377 13.3724 13.3724 13.3724 13.3724 13.8681 13.8681 13.8681 13.8681 14.4791 14.4791 k = 0.0000 0.0000 0.2765 ( 3760 PWs) bands (ev): -1.4236 -1.4236 -1.4236 -1.4236 1.6479 1.6479 1.6479 1.6479 5.7476 5.7476 5.7476 5.7476 8.0927 8.0927 8.0927 8.0927 8.8975 8.8975 8.8975 8.8975 9.3761 9.3761 9.3761 9.3761 10.1025 10.1025 10.1025 10.1025 10.4587 10.4587 10.4587 10.4587 10.6293 10.6293 10.6293 10.6293 11.2395 11.2395 11.2395 11.2395 11.5575 11.5575 11.5575 11.5575 11.9022 11.9022 11.9022 11.9022 12.0378 12.0378 12.0378 12.0378 13.3729 13.3729 13.3729 13.3729 13.8661 13.8661 13.8661 13.8661 14.4790 14.4790 k = 0.0000 0.3045-0.0000 ( 3754 PWs) bands (ev): -1.2401 -1.2401 -1.2401 -1.2401 1.2251 1.2251 1.2251 1.2251 5.6644 5.6644 5.6644 5.6644 8.3407 8.3407 8.3407 8.3407 9.4043 9.4043 9.4043 9.4043 9.4569 9.4569 9.4569 9.4569 9.9285 9.9285 9.9285 9.9285 10.2670 10.2670 10.2670 10.2670 10.7781 10.7781 10.7781 10.7781 11.3411 11.3411 11.3411 11.3411 11.4622 11.4622 11.4622 11.4622 12.1581 12.1581 12.1581 12.1581 12.2084 12.2084 12.2084 12.2084 13.1458 13.1458 13.1458 13.1458 14.2293 14.2293 14.2293 14.2293 14.8390 14.8390 k = 0.0000 0.3045 0.0102 ( 3754 PWs) bands (ev): -1.2393 -1.2393 -1.2393 -1.2393 1.2227 1.2227 1.2227 1.2227 5.6683 5.6683 5.6683 5.6683 8.3405 8.3405 8.3405 8.3405 9.4029 9.4029 9.4029 9.4029 9.4569 9.4569 9.4569 9.4569 9.9284 9.9284 9.9284 9.9284 10.2670 10.2670 10.2670 10.2670 10.7776 10.7776 10.7776 10.7776 11.3411 11.3411 11.3411 11.3411 11.4621 11.4621 11.4621 11.4621 12.1576 12.1576 12.1576 12.1576 12.2079 12.2079 12.2079 12.2079 13.1472 13.1472 13.1472 13.1472 14.2315 14.2315 14.2315 14.2315 14.8353 14.8353 k = 0.0000 0.3045 0.0205 ( 3756 PWs) bands (ev): -1.2368 -1.2368 -1.2368 -1.2368 1.2154 1.2154 1.2154 1.2154 5.6799 5.6799 5.6799 5.6799 8.3401 8.3401 8.3401 8.3401 9.3986 9.3986 9.3986 9.3986 9.4569 9.4569 9.4569 9.4569 9.9283 9.9283 9.9283 9.9283 10.2672 10.2672 10.2672 10.2672 10.7759 10.7759 10.7759 10.7759 11.3412 11.3412 11.3412 11.3412 11.4615 11.4615 11.4615 11.4615 12.1561 12.1561 12.1561 12.1561 12.2065 12.2065 12.2065 12.2065 13.1516 13.1516 13.1516 13.1516 14.2380 14.2380 14.2380 14.2380 14.8244 14.8244 k = 0.0000 0.3045 0.0307 ( 3756 PWs) bands (ev): -1.2327 -1.2327 -1.2327 -1.2327 1.2034 1.2034 1.2034 1.2034 5.6990 5.6990 5.6990 5.6990 8.3393 8.3393 8.3393 8.3393 9.3910 9.3910 9.3910 9.3910 9.4571 9.4571 9.4571 9.4571 9.9283 9.9283 9.9283 9.9283 10.2675 10.2675 10.2675 10.2675 10.7731 10.7731 10.7731 10.7731 11.3415 11.3415 11.3415 11.3415 11.4606 11.4606 11.4606 11.4606 12.1531 12.1531 12.1531 12.1531 12.2046 12.2046 12.2046 12.2046 13.1588 13.1588 13.1588 13.1588 14.2487 14.2487 14.2487 14.2487 14.8066 14.8066 k = 0.0000 0.3045 0.0410 ( 3760 PWs) bands (ev): -1.2270 -1.2270 -1.2270 -1.2270 1.1868 1.1868 1.1868 1.1868 5.7255 5.7255 5.7255 5.7255 8.3381 8.3381 8.3381 8.3381 9.3799 9.3799 9.3799 9.3799 9.4579 9.4579 9.4579 9.4579 9.9284 9.9284 9.9284 9.9284 10.2678 10.2678 10.2678 10.2678 10.7693 10.7693 10.7693 10.7693 11.3417 11.3417 11.3417 11.3417 11.4593 11.4593 11.4593 11.4593 12.1484 12.1484 12.1484 12.1484 12.2028 12.2028 12.2028 12.2028 13.1689 13.1689 13.1689 13.1689 14.2636 14.2636 14.2636 14.2636 14.7826 14.7826 k = 0.0000 0.3045 0.0512 ( 3762 PWs) bands (ev): -1.2197 -1.2197 -1.2197 -1.2197 1.1660 1.1660 1.1660 1.1660 5.7591 5.7591 5.7591 5.7591 8.3364 8.3364 8.3364 8.3364 9.3650 9.3650 9.3650 9.3650 9.4593 9.4593 9.4593 9.4593 9.9292 9.9292 9.9292 9.9292 10.2683 10.2683 10.2683 10.2683 10.7644 10.7644 10.7644 10.7644 11.3420 11.3420 11.3420 11.3420 11.4577 11.4577 11.4577 11.4577 12.1415 12.1415 12.1415 12.1415 12.2015 12.2015 12.2015 12.2015 13.1816 13.1816 13.1816 13.1816 14.2824 14.2824 14.2824 14.2824 14.7531 14.7531 k = 0.0000 0.3045 0.0615 ( 3764 PWs) bands (ev): -1.2109 -1.2109 -1.2109 -1.2109 1.1412 1.1412 1.1412 1.1412 5.7996 5.7996 5.7996 5.7996 8.3340 8.3340 8.3340 8.3340 9.3462 9.3462 9.3462 9.3462 9.4614 9.4614 9.4614 9.4614 9.9307 9.9307 9.9307 9.9307 10.2688 10.2688 10.2688 10.2688 10.7585 10.7585 10.7585 10.7585 11.3421 11.3421 11.3421 11.3421 11.4558 11.4558 11.4558 11.4558 12.1323 12.1323 12.1323 12.1323 12.2013 12.2013 12.2013 12.2013 13.1968 13.1968 13.1968 13.1968 14.3049 14.3049 14.3049 14.3049 14.7190 14.7190 k = 0.0000 0.3045 0.0717 ( 3766 PWs) bands (ev): -1.2005 -1.2005 -1.2005 -1.2005 1.1128 1.1128 1.1128 1.1128 5.8464 5.8464 5.8464 5.8464 8.3309 8.3309 8.3309 8.3309 9.3236 9.3236 9.3236 9.3236 9.4641 9.4641 9.4641 9.4641 9.9332 9.9332 9.9332 9.9332 10.2694 10.2694 10.2694 10.2694 10.7517 10.7517 10.7517 10.7517 11.3421 11.3421 11.3421 11.3421 11.4536 11.4536 11.4536 11.4536 12.1210 12.1210 12.1210 12.1210 12.2020 12.2020 12.2020 12.2020 13.2143 13.2143 13.2143 13.2143 14.3308 14.3308 14.3308 14.3308 14.6814 14.6814 k = 0.0000 0.3045 0.0819 ( 3762 PWs) bands (ev): -1.1888 -1.1888 -1.1888 -1.1888 1.0813 1.0813 1.0813 1.0813 5.8993 5.8993 5.8993 5.8993 8.3268 8.3268 8.3268 8.3268 9.2974 9.2974 9.2974 9.2974 9.4675 9.4675 9.4675 9.4675 9.9369 9.9369 9.9369 9.9369 10.2701 10.2701 10.2701 10.2701 10.7440 10.7440 10.7440 10.7440 11.3420 11.3420 11.3420 11.3420 11.4512 11.4512 11.4512 11.4512 12.1077 12.1077 12.1077 12.1077 12.2038 12.2038 12.2038 12.2038 13.2341 13.2341 13.2341 13.2341 14.3598 14.3598 14.3598 14.3598 14.6411 14.6411 k = 0.0000 0.3045 0.0922 ( 3764 PWs) bands (ev): -1.1757 -1.1757 -1.1757 -1.1757 1.0469 1.0469 1.0469 1.0469 5.9577 5.9577 5.9577 5.9577 8.3214 8.3214 8.3214 8.3214 9.2679 9.2679 9.2679 9.2679 9.4712 9.4712 9.4712 9.4712 9.9418 9.9418 9.9418 9.9418 10.2707 10.2707 10.2707 10.2707 10.7356 10.7356 10.7356 10.7356 11.3417 11.3417 11.3417 11.3417 11.4487 11.4487 11.4487 11.4487 12.0929 12.0929 12.0929 12.0929 12.2066 12.2066 12.2066 12.2066 13.2557 13.2557 13.2557 13.2557 14.3913 14.3913 14.3913 14.3913 14.5995 14.5995 k = 0.0000 0.3045 0.1024 ( 3762 PWs) bands (ev): -1.1615 -1.1615 -1.1615 -1.1615 1.0103 1.0103 1.0103 1.0103 6.0212 6.0212 6.0212 6.0212 8.3145 8.3145 8.3145 8.3145 9.2353 9.2353 9.2353 9.2353 9.4755 9.4755 9.4755 9.4755 9.9481 9.9481 9.9481 9.9481 10.2715 10.2715 10.2715 10.2715 10.7264 10.7264 10.7264 10.7264 11.3410 11.3410 11.3410 11.3410 11.4460 11.4460 11.4460 11.4460 12.0769 12.0769 12.0769 12.0769 12.2101 12.2101 12.2101 12.2101 13.2790 13.2790 13.2790 13.2790 14.4236 14.4236 14.4236 14.4236 14.5586 14.5586 k = 0.0000 0.3045 0.1127 ( 3764 PWs) bands (ev): -1.1461 -1.1461 -1.1461 -1.1461 0.9718 0.9718 0.9718 0.9718 6.0894 6.0894 6.0894 6.0894 8.3057 8.3057 8.3057 8.3057 9.2003 9.2003 9.2003 9.2003 9.4801 9.4801 9.4801 9.4801 9.9556 9.9556 9.9556 9.9556 10.2722 10.2722 10.2722 10.2722 10.7167 10.7167 10.7167 10.7167 11.3401 11.3401 11.3401 11.3401 11.4432 11.4432 11.4432 11.4432 12.0600 12.0600 12.0600 12.0600 12.2143 12.2143 12.2143 12.2143 13.3036 13.3036 13.3036 13.3036 14.4496 14.4496 14.4496 14.4496 14.5261 14.5261 k = 0.0000 0.3045 0.1229 ( 3764 PWs) bands (ev): -1.1297 -1.1297 -1.1297 -1.1297 0.9320 0.9320 0.9320 0.9320 6.1617 6.1617 6.1617 6.1617 8.2946 8.2946 8.2946 8.2946 9.1635 9.1635 9.1635 9.1635 9.4849 9.4849 9.4849 9.4849 9.9644 9.9644 9.9644 9.9644 10.2729 10.2729 10.2729 10.2729 10.7065 10.7065 10.7065 10.7065 11.3388 11.3388 11.3388 11.3388 11.4403 11.4403 11.4403 11.4403 12.0426 12.0426 12.0426 12.0426 12.2193 12.2193 12.2193 12.2193 13.3292 13.3292 13.3292 13.3292 14.4422 14.4422 14.4422 14.4422 14.5297 14.5297 k = 0.0000 0.3045 0.1332 ( 3760 PWs) bands (ev): -1.1124 -1.1124 -1.1124 -1.1124 0.8913 0.8913 0.8913 0.8913 6.2377 6.2377 6.2377 6.2377 8.2806 8.2806 8.2806 8.2806 9.1256 9.1256 9.1256 9.1256 9.4900 9.4900 9.4900 9.4900 9.9742 9.9742 9.9742 9.9742 10.2736 10.2736 10.2736 10.2736 10.6961 10.6961 10.6961 10.6961 11.3372 11.3372 11.3372 11.3372 11.4375 11.4375 11.4375 11.4375 12.0250 12.0250 12.0250 12.0250 12.2248 12.2248 12.2248 12.2248 13.3553 13.3553 13.3553 13.3553 14.4072 14.4072 14.4072 14.4072 14.5640 14.5640 k = 0.0000 0.3045 0.1434 ( 3756 PWs) bands (ev): -1.0945 -1.0945 -1.0945 -1.0945 0.8502 0.8502 0.8502 0.8502 6.3169 6.3169 6.3169 6.3169 8.2633 8.2633 8.2633 8.2633 9.0873 9.0873 9.0873 9.0873 9.4952 9.4952 9.4952 9.4952 9.9849 9.9849 9.9849 9.9849 10.2743 10.2743 10.2743 10.2743 10.6854 10.6854 10.6854 10.6854 11.3352 11.3352 11.3352 11.3352 11.4347 11.4347 11.4347 11.4347 12.0074 12.0074 12.0074 12.0074 12.2307 12.2307 12.2307 12.2307 13.3816 13.3816 13.3816 13.3816 14.3679 14.3679 14.3679 14.3679 14.6063 14.6063 k = 0.0000 0.3045 0.1536 ( 3770 PWs) bands (ev): -1.0762 -1.0762 -1.0762 -1.0762 0.8091 0.8091 0.8091 0.8091 6.3987 6.3987 6.3987 6.3987 8.2420 8.2420 8.2420 8.2420 9.0495 9.0495 9.0495 9.0495 9.5004 9.5004 9.5004 9.5004 9.9962 9.9962 9.9962 9.9962 10.2748 10.2748 10.2748 10.2748 10.6746 10.6746 10.6746 10.6746 11.3329 11.3329 11.3329 11.3329 11.4319 11.4319 11.4319 11.4319 11.9900 11.9900 11.9900 11.9900 12.2370 12.2370 12.2370 12.2370 13.4075 13.4075 13.4075 13.4075 14.3294 14.3294 14.3294 14.3294 14.6518 14.6518 k = 0.0000 0.3045 0.1639 ( 3778 PWs) bands (ev): -1.0575 -1.0575 -1.0575 -1.0575 0.7687 0.7687 0.7687 0.7687 6.4828 6.4828 6.4828 6.4828 8.2163 8.2163 8.2163 8.2163 9.0131 9.0131 9.0131 9.0131 9.5056 9.5056 9.5056 9.5056 10.0081 10.0081 10.0081 10.0081 10.2754 10.2754 10.2754 10.2754 10.6639 10.6639 10.6639 10.6639 11.3303 11.3303 11.3303 11.3303 11.4292 11.4292 11.4292 11.4292 11.9731 11.9731 11.9731 11.9731 12.2436 12.2436 12.2436 12.2436 13.4326 13.4326 13.4326 13.4326 14.2934 14.2934 14.2934 14.2934 14.6994 14.6994 k = 0.0000 0.3045 0.1741 ( 3784 PWs) bands (ev): -1.0389 -1.0389 -1.0389 -1.0389 0.7294 0.7294 0.7294 0.7294 6.5684 6.5684 6.5684 6.5684 8.1855 8.1855 8.1855 8.1855 8.9789 8.9789 8.9789 8.9789 9.5107 9.5107 9.5107 9.5107 10.0201 10.0201 10.0201 10.0201 10.2759 10.2759 10.2759 10.2759 10.6534 10.6534 10.6534 10.6534 11.3276 11.3276 11.3276 11.3276 11.4266 11.4266 11.4266 11.4266 11.9569 11.9569 11.9569 11.9569 12.2505 12.2505 12.2505 12.2505 13.4561 13.4561 13.4561 13.4561 14.2608 14.2608 14.2608 14.2608 14.7487 14.7487 k = 0.0000 0.3045 0.1844 ( 3788 PWs) bands (ev): -1.0206 -1.0206 -1.0206 -1.0206 0.6917 0.6917 0.6917 0.6917 6.6552 6.6552 6.6552 6.6552 8.1495 8.1495 8.1495 8.1495 8.9474 8.9474 8.9474 8.9474 9.5156 9.5156 9.5156 9.5156 10.0320 10.0320 10.0320 10.0320 10.2764 10.2764 10.2764 10.2764 10.6433 10.6433 10.6433 10.6433 11.3246 11.3246 11.3246 11.3246 11.4243 11.4243 11.4243 11.4243 11.9416 11.9416 11.9416 11.9416 12.2574 12.2574 12.2574 12.2574 13.4777 13.4777 13.4777 13.4777 14.2324 14.2324 14.2324 14.2324 14.7993 14.7993 k = 0.0000 0.3045 0.1946 ( 3788 PWs) bands (ev): -1.0029 -1.0029 -1.0029 -1.0029 0.6561 0.6561 0.6561 0.6561 6.7425 6.7425 6.7425 6.7425 8.1082 8.1082 8.1082 8.1082 8.9194 8.9194 8.9194 8.9194 9.5203 9.5203 9.5203 9.5203 10.0437 10.0437 10.0437 10.0437 10.2768 10.2768 10.2768 10.2768 10.6337 10.6337 10.6337 10.6337 11.3217 11.3217 11.3217 11.3217 11.4221 11.4221 11.4221 11.4221 11.9273 11.9273 11.9273 11.9273 12.2643 12.2643 12.2643 12.2643 13.4967 13.4967 13.4967 13.4967 14.2087 14.2087 14.2087 14.2087 14.8509 14.8509 k = 0.0000 0.3045 0.2048 ( 3788 PWs) bands (ev): -0.9860 -0.9860 -0.9860 -0.9860 0.6230 0.6230 0.6230 0.6230 6.8296 6.8296 6.8296 6.8296 8.0616 8.0616 8.0616 8.0616 8.8950 8.8950 8.8950 8.8950 9.5246 9.5246 9.5246 9.5246 10.0548 10.0548 10.0548 10.0548 10.2772 10.2772 10.2772 10.2772 10.6248 10.6248 10.6248 10.6248 11.3188 11.3188 11.3188 11.3188 11.4201 11.4201 11.4201 11.4201 11.9144 11.9144 11.9144 11.9144 12.2710 12.2710 12.2710 12.2710 13.5128 13.5128 13.5128 13.5128 14.1900 14.1900 14.1900 14.1900 14.9032 14.9032 k = 0.0000 0.3045 0.2151 ( 3792 PWs) bands (ev): -0.9704 -0.9704 -0.9704 -0.9704 0.5931 0.5931 0.5931 0.5931 6.9156 6.9156 6.9156 6.9156 8.0106 8.0106 8.0106 8.0106 8.8743 8.8743 8.8743 8.8743 9.5285 9.5285 9.5285 9.5285 10.0651 10.0651 10.0651 10.0651 10.2775 10.2775 10.2775 10.2775 10.6167 10.6167 10.6167 10.6167 11.3161 11.3161 11.3161 11.3161 11.4184 11.4184 11.4184 11.4184 11.9026 11.9026 11.9026 11.9026 12.2772 12.2772 12.2772 12.2772 13.5257 13.5257 13.5257 13.5257 14.1762 14.1762 14.1762 14.1762 14.9561 14.9561 k = 0.0000 0.3045 0.2253 ( 3788 PWs) bands (ev): -0.9565 -0.9565 -0.9565 -0.9565 0.5668 0.5668 0.5668 0.5668 6.9995 6.9995 6.9995 6.9995 7.9561 7.9561 7.9561 7.9561 8.8574 8.8574 8.8574 8.8574 9.5319 9.5319 9.5319 9.5319 10.0743 10.0743 10.0743 10.0743 10.2779 10.2779 10.2779 10.2779 10.6095 10.6095 10.6095 10.6095 11.3136 11.3136 11.3136 11.3136 11.4170 11.4170 11.4170 11.4170 11.8926 11.8926 11.8926 11.8926 12.2829 12.2829 12.2829 12.2829 13.5354 13.5354 13.5354 13.5354 14.1670 14.1670 14.1670 14.1670 15.0090 15.0090 k = 0.0000 0.3045 0.2356 ( 3784 PWs) bands (ev): -0.9444 -0.9444 -0.9444 -0.9444 0.5445 0.5445 0.5445 0.5445 7.0794 7.0794 7.0794 7.0794 7.8998 7.8998 7.8998 7.8998 8.8440 8.8440 8.8440 8.8440 9.5348 9.5348 9.5348 9.5348 10.0822 10.0822 10.0822 10.0822 10.2782 10.2782 10.2782 10.2782 10.6035 10.6035 10.6035 10.6035 11.3114 11.3114 11.3114 11.3114 11.4159 11.4159 11.4159 11.4159 11.8842 11.8842 11.8842 11.8842 12.2878 12.2878 12.2878 12.2878 13.5424 13.5424 13.5424 13.5424 14.1617 14.1617 14.1617 14.1617 15.0615 15.0615 k = 0.0000 0.3045 0.2458 ( 3788 PWs) bands (ev): -0.9347 -0.9347 -0.9347 -0.9347 0.5267 0.5267 0.5267 0.5267 7.1528 7.1528 7.1528 7.1528 7.8446 7.8446 7.8446 7.8446 8.8339 8.8339 8.8339 8.8339 9.5371 9.5371 9.5371 9.5371 10.0886 10.0886 10.0886 10.0886 10.2784 10.2784 10.2784 10.2784 10.5986 10.5986 10.5986 10.5986 11.3096 11.3096 11.3096 11.3096 11.4149 11.4149 11.4149 11.4149 11.8776 11.8776 11.8776 11.8776 12.2919 12.2919 12.2919 12.2919 13.5469 13.5469 13.5469 13.5469 14.1592 14.1592 14.1592 14.1592 15.1119 15.1119 k = 0.0000 0.3045 0.2561 ( 3788 PWs) bands (ev): -0.9275 -0.9275 -0.9275 -0.9275 0.5137 0.5137 0.5137 0.5137 7.2153 7.2153 7.2153 7.2153 7.7951 7.7951 7.7951 7.7951 8.8269 8.8269 8.8269 8.8269 9.5388 9.5388 9.5388 9.5388 10.0932 10.0932 10.0932 10.0932 10.2786 10.2786 10.2786 10.2786 10.5950 10.5950 10.5950 10.5950 11.3083 11.3083 11.3083 11.3083 11.4143 11.4143 11.4143 11.4143 11.8728 11.8728 11.8728 11.8728 12.2948 12.2948 12.2948 12.2948 13.5496 13.5496 13.5496 13.5496 14.1585 14.1585 14.1585 14.1585 15.1551 15.1551 k = 0.0000 0.3045 0.2663 ( 3780 PWs) bands (ev): -0.9231 -0.9231 -0.9231 -0.9231 0.5058 0.5058 0.5058 0.5058 7.2593 7.2593 7.2593 7.2593 7.7587 7.7587 7.7587 7.7587 8.8227 8.8227 8.8227 8.8227 9.5398 9.5398 9.5398 9.5398 10.0961 10.0961 10.0961 10.0961 10.2787 10.2787 10.2787 10.2787 10.5928 10.5928 10.5928 10.5928 11.3076 11.3076 11.3076 11.3076 11.4139 11.4139 11.4139 11.4139 11.8699 11.8699 11.8699 11.8699 12.2967 12.2967 12.2967 12.2967 13.5511 13.5511 13.5511 13.5511 14.1585 14.1585 14.1585 14.1585 15.1745 15.1745 k = 0.0000 0.3045 0.2765 ( 3788 PWs) bands (ev): -0.9216 -0.9216 -0.9216 -0.9216 0.5032 0.5032 0.5032 0.5032 7.2756 7.2756 7.2756 7.2756 7.7449 7.7449 7.7449 7.7449 8.8213 8.8213 8.8213 8.8213 9.5402 9.5402 9.5402 9.5402 10.0971 10.0971 10.0971 10.0971 10.2788 10.2788 10.2788 10.2788 10.5920 10.5920 10.5920 10.5920 11.3073 11.3073 11.3073 11.3073 11.4138 11.4138 11.4138 11.4138 11.8689 11.8689 11.8689 11.8689 12.2972 12.2972 12.2972 12.2972 13.5515 13.5515 13.5515 13.5515 14.1586 14.1586 14.1586 14.1586 15.1757 15.1758 k = 0.5000-0.0000 0.2765 ( 3736 PWs) bands (ev): 0.9337 0.9337 0.9337 0.9337 1.1989 1.1989 1.1989 1.1989 5.5668 5.5668 5.5668 5.5668 7.4498 7.4498 7.4498 7.4498 8.4202 8.4202 8.4202 8.4202 8.7756 8.7756 8.7756 8.7756 9.4140 9.4140 9.4140 9.4140 9.5714 9.5714 9.5714 9.5714 10.1629 10.1629 10.1629 10.1629 11.3017 11.3017 11.3017 11.3017 11.8094 11.8094 11.8094 11.8094 11.9963 11.9963 11.9963 11.9963 12.2433 12.2433 12.2433 12.2433 12.3538 12.3538 12.3538 12.3538 13.4900 13.4900 13.4900 13.4900 13.9799 13.9799 k = 0.5000-0.0000 0.2663 ( 3736 PWs) bands (ev): 0.9300 0.9300 0.9304 0.9304 1.2024 1.2024 1.2029 1.2029 5.5679 5.5679 5.5686 5.5686 7.4486 7.4486 7.4491 7.4491 8.4036 8.4036 8.4261 8.4261 8.7714 8.7714 8.7889 8.7889 9.4091 9.4091 9.4127 9.4127 9.5666 9.5666 9.5813 9.5813 10.1624 10.1624 10.1655 10.1655 11.2983 11.2983 11.3052 11.3052 11.8059 11.8059 11.8114 11.8114 11.9951 11.9951 11.9972 11.9972 12.2425 12.2425 12.2437 12.2437 12.3538 12.3538 12.3541 12.3541 13.4824 13.4824 13.4919 13.4919 13.9798 13.9867 k = 0.5000-0.0000 0.2561 ( 3740 PWs) bands (ev): 0.9198 0.9198 0.9205 0.9205 1.2128 1.2128 1.2137 1.2137 5.5720 5.5720 5.5733 5.5733 7.4454 7.4454 7.4463 7.4463 8.3786 8.3786 8.4202 8.4202 8.7773 8.7773 8.8088 8.8088 9.3997 9.3997 9.4046 9.4046 9.5675 9.5675 9.5944 9.5944 10.1641 10.1641 10.1701 10.1701 11.2950 11.2950 11.3088 11.3088 11.8009 11.8009 11.8120 11.8120 11.9936 11.9936 11.9978 11.9978 12.2413 12.2413 12.2437 12.2437 12.3539 12.3539 12.3545 12.3545 13.4698 13.4698 13.4882 13.4882 13.9865 13.9866 k = 0.5000-0.0000 0.2458 ( 3744 PWs) bands (ev): 0.9046 0.9046 0.9055 0.9055 1.2288 1.2288 1.2300 1.2300 5.5789 5.5789 5.5810 5.5810 7.4402 7.4402 7.4416 7.4416 8.3478 8.3478 8.4036 8.4036 8.7922 8.7922 8.8325 8.8325 9.3878 9.3878 9.3906 9.3906 9.5733 9.5733 9.6089 9.6089 10.1683 10.1683 10.1766 10.1766 11.2916 11.2916 11.3125 11.3125 11.7945 11.7945 11.8112 11.8112 11.9918 11.9918 11.9980 11.9980 12.2398 12.2398 12.2433 12.2433 12.3542 12.3542 12.3551 12.3551 13.4535 13.4535 13.4796 13.4796 13.9994 13.9995 k = 0.5000-0.0000 0.2356 ( 3748 PWs) bands (ev): 0.8858 0.8858 0.8869 0.8869 1.2488 1.2488 1.2501 1.2501 5.5889 5.5889 5.5916 5.5916 7.4331 7.4331 7.4347 7.4347 8.3134 8.3134 8.3789 8.3789 8.8133 8.8133 8.8577 8.8577 9.3728 9.3728 9.3750 9.3750 9.5820 9.5820 9.6232 9.6232 10.1751 10.1751 10.1853 10.1853 11.2882 11.2882 11.3161 11.3161 11.7869 11.7869 11.8092 11.8092 11.9898 11.9898 11.9977 11.9977 12.2379 12.2379 12.2426 12.2426 12.3547 12.3547 12.3558 12.3558 13.4347 13.4347 13.4672 13.4672 14.0172 14.0172 k = 0.5000-0.0000 0.2253 ( 3748 PWs) bands (ev): 0.8648 0.8648 0.8660 0.8660 1.2714 1.2714 1.2729 1.2729 5.6017 5.6017 5.6051 5.6051 7.4240 7.4240 7.4257 7.4257 8.2767 8.2767 8.3485 8.3485 8.8379 8.8379 8.8822 8.8822 9.3531 9.3531 9.3628 9.3628 9.5923 9.5923 9.6365 9.6365 10.1850 10.1850 10.1961 10.1961 11.2846 11.2846 11.3196 11.3196 11.7783 11.7783 11.8063 11.8063 11.9875 11.9875 11.9971 11.9971 12.2358 12.2358 12.2416 12.2416 12.3554 12.3554 12.3568 12.3568 13.4147 13.4147 13.4522 13.4522 14.0385 14.0385 k = 0.5000-0.0000 0.2151 ( 3744 PWs) bands (ev): 0.8425 0.8425 0.8437 0.8437 1.2958 1.2958 1.2974 1.2974 5.6174 5.6174 5.6215 5.6215 7.4128 7.4128 7.4144 7.4144 8.2388 8.2388 8.3145 8.3145 8.8634 8.8634 8.9045 8.9045 9.3333 9.3333 9.3524 9.3524 9.6029 9.6029 9.6480 9.6480 10.1981 10.1981 10.2093 10.2093 11.2805 11.2805 11.3228 11.3228 11.7690 11.7690 11.8027 11.8027 11.9850 11.9850 11.9960 11.9960 12.2335 12.2335 12.2402 12.2402 12.3563 12.3563 12.3580 12.3580 13.3946 13.3946 13.4361 13.4361 14.0620 14.0621 k = 0.5000-0.0000 0.2048 ( 3752 PWs) bands (ev): 0.8195 0.8195 0.8208 0.8208 1.3211 1.3211 1.3227 1.3227 5.6360 5.6360 5.6409 5.6409 7.3994 7.3994 7.4006 7.4006 8.2006 8.2006 8.2782 8.2782 8.8875 8.8875 8.9230 8.9230 9.3147 9.3147 9.3448 9.3448 9.6131 9.6131 9.6572 9.6572 10.2147 10.2147 10.2249 10.2249 11.2757 11.2757 11.3252 11.3252 11.7594 11.7594 11.7987 11.7987 11.9822 11.9822 11.9944 11.9944 12.2311 12.2311 12.2386 12.2386 12.3573 12.3573 12.3592 12.3592 13.3750 13.3750 13.4195 13.4195 14.0867 14.0867 k = 0.5000-0.0000 0.1946 ( 3762 PWs) bands (ev): 0.7964 0.7964 0.7976 0.7976 1.3468 1.3468 1.3486 1.3486 5.6574 5.6574 5.6631 5.6631 7.3837 7.3837 7.3843 7.3843 8.1626 8.1626 8.2407 8.2407 8.9084 8.9084 8.9364 8.9364 9.2990 9.2990 9.3412 9.3412 9.6225 9.6225 9.6640 9.6640 10.2348 10.2348 10.2429 10.2429 11.2702 11.2702 11.3267 11.3267 11.7499 11.7499 11.7946 11.7946 11.9791 11.9791 11.9923 11.9923 12.2285 12.2285 12.2368 12.2368 12.3587 12.3587 12.3608 12.3608 13.3566 13.3566 13.4035 13.4035 14.1115 14.1116 k = 0.5000-0.0000 0.1844 ( 3762 PWs) bands (ev): 0.7734 0.7734 0.7746 0.7746 1.3727 1.3727 1.3744 1.3744 5.6817 5.6817 5.6881 5.6881 7.3653 7.3653 7.3657 7.3657 8.1254 8.1254 8.2029 8.2029 8.9241 8.9241 8.9439 8.9439 9.2879 9.2879 9.3423 9.3423 9.6308 9.6308 9.6685 9.6685 10.2584 10.2584 10.2637 10.2637 11.2636 11.2636 11.3269 11.3269 11.7411 11.7411 11.7908 11.7908 11.9760 11.9760 11.9898 11.9898 12.2258 12.2258 12.2347 12.2347 12.3602 12.3602 12.3625 12.3625 13.3400 13.3400 13.3885 13.3885 14.1361 14.1361 k = 0.5000-0.0000 0.1741 ( 3770 PWs) bands (ev): 0.7509 0.7509 0.7521 0.7521 1.3983 1.3983 1.4000 1.4000 5.7088 5.7088 5.7160 5.7160 7.3434 7.3434 7.3450 7.3450 8.0893 8.0893 8.1651 8.1651 8.9332 8.9332 8.9451 8.9451 9.2826 9.2826 9.3483 9.3483 9.6379 9.6379 9.6706 9.6706 10.2853 10.2853 10.2870 10.2870 11.2559 11.2559 11.3255 11.3255 11.7332 11.7332 11.7874 11.7874 11.9725 11.9725 11.9868 11.9868 12.2231 12.2231 12.2325 12.2325 12.3620 12.3620 12.3643 12.3643 13.3253 13.3253 13.3748 13.3748 14.1596 14.1596 k = 0.5000-0.0000 0.1639 ( 3774 PWs) bands (ev): 0.7290 0.7290 0.7302 0.7302 1.4234 1.4234 1.4251 1.4251 5.7386 5.7386 5.7466 5.7466 7.3184 7.3184 7.3217 7.3217 8.0547 8.0547 8.1280 8.1280 8.9347 8.9347 8.9405 8.9405 9.2840 9.2840 9.3589 9.3589 9.6437 9.6437 9.6706 9.6706 10.3128 10.3128 10.3154 10.3154 11.2467 11.2467 11.3221 11.3221 11.7267 11.7267 11.7846 11.7846 11.9689 11.9689 11.9834 11.9834 12.2204 12.2204 12.2302 12.2302 12.3640 12.3640 12.3664 12.3664 13.3128 13.3128 13.3629 13.3629 14.1821 14.1821 k = 0.5000-0.0000 0.1536 ( 3778 PWs) bands (ev): 0.7080 0.7080 0.7090 0.7090 1.4479 1.4479 1.4495 1.4495 5.7711 5.7711 5.7800 5.7800 7.2904 7.2904 7.2955 7.2955 8.0219 8.0219 8.0920 8.0920 8.9290 8.9290 8.9307 8.9307 9.2917 9.2917 9.3732 9.3732 9.6484 9.6484 9.6690 9.6690 10.3410 10.3410 10.3482 10.3482 11.2362 11.2362 11.3164 11.3164 11.7219 11.7219 11.7826 11.7826 11.9652 11.9652 11.9797 11.9797 12.2177 12.2177 12.2277 12.2277 12.3662 12.3662 12.3686 12.3686 13.3025 13.3025 13.3527 13.3527 14.2031 14.2031 k = 0.5000-0.0000 0.1434 ( 3780 PWs) bands (ev): 0.6878 0.6878 0.6888 0.6888 1.4715 1.4715 1.4730 1.4730 5.8062 5.8062 5.8160 5.8160 7.2591 7.2591 7.2664 7.2664 7.9911 7.9911 8.0573 8.0573 8.9169 8.9169 8.9174 8.9174 9.3047 9.3047 9.3902 9.3902 9.6521 9.6521 9.6660 9.6660 10.3713 10.3713 10.3833 10.3833 11.2240 11.2240 11.3081 11.3081 11.7192 11.7192 11.7815 11.7815 11.9614 11.9614 11.9757 11.9757 12.2150 12.2150 12.2252 12.2252 12.3686 12.3686 12.3710 12.3710 13.2944 13.2944 13.3443 13.3443 14.2226 14.2226 k = 0.5000-0.0000 0.1332 ( 3784 PWs) bands (ev): 0.6687 0.6687 0.6697 0.6697 1.4940 1.4940 1.4955 1.4955 5.8439 5.8439 5.8546 5.8546 7.2246 7.2246 7.2341 7.2341 7.9626 7.9626 8.0244 8.0244 8.9003 8.9003 8.9014 8.9014 9.3214 9.3214 9.4090 9.4090 9.6547 9.6547 9.6618 9.6618 10.4036 10.4036 10.4205 10.4205 11.2101 11.2101 11.2971 11.2971 11.7184 11.7184 11.7813 11.7813 11.9576 11.9576 11.9715 11.9715 12.2124 12.2124 12.2225 12.2225 12.3712 12.3712 12.3736 12.3736 13.2885 13.2885 13.3377 13.3377 14.2404 14.2404 k = 0.5000-0.0000 0.1229 ( 3768 PWs) bands (ev): 0.6507 0.6507 0.6516 0.6516 1.5154 1.5154 1.5169 1.5169 5.8841 5.8841 5.8956 5.8956 7.1869 7.1869 7.1988 7.1988 7.9366 7.9366 7.9936 7.9936 8.8818 8.8818 8.8826 8.8826 9.3404 9.3404 9.4286 9.4286 9.6566 9.6566 9.6569 9.6569 10.4376 10.4376 10.4594 10.4594 11.1947 11.1947 11.2835 11.2835 11.7197 11.7197 11.7819 11.7819 11.9540 11.9540 11.9673 11.9673 12.2099 12.2099 12.2199 12.2199 12.3740 12.3740 12.3763 12.3763 13.2849 13.2849 13.3329 13.3329 14.2567 14.2567 k = 0.5000-0.0000 0.1127 ( 3776 PWs) bands (ev): 0.6339 0.6339 0.6348 0.6348 1.5355 1.5355 1.5369 1.5369 5.9266 5.9266 5.9390 5.9390 7.1459 7.1459 7.1602 7.1602 7.9130 7.9130 7.9648 7.9648 8.8622 8.8622 8.8623 8.8623 9.3606 9.3606 9.4483 9.4483 9.6514 9.6514 9.6577 9.6577 10.4730 10.4730 10.4996 10.4996 11.1774 11.1774 11.2671 11.2671 11.7227 11.7227 11.7831 11.7831 11.9505 11.9505 11.9631 11.9631 12.2074 12.2074 12.2172 12.2172 12.3768 12.3768 12.3789 12.3789 13.2831 13.2831 13.3295 13.3295 14.2713 14.2713 k = 0.5000-0.0000 0.1024 ( 3764 PWs) bands (ev): 0.6184 0.6184 0.6192 0.6192 1.5543 1.5543 1.5555 1.5555 5.9713 5.9713 5.9847 5.9847 7.1021 7.1021 7.1185 7.1185 7.8919 7.8919 7.9385 7.9385 8.8416 8.8416 8.8425 8.8425 9.3811 9.3811 9.4676 9.4676 9.6457 9.6457 9.6582 9.6582 10.5096 10.5096 10.5407 10.5407 11.1586 11.1586 11.2482 11.2482 11.7273 11.7273 11.7850 11.7850 11.9473 11.9473 11.9591 11.9591 12.2052 12.2052 12.2147 12.2147 12.3797 12.3797 12.3817 12.3817 13.2832 13.2832 13.3275 13.3275 14.2844 14.2844 k = 0.5000-0.0000 0.0922 ( 3762 PWs) bands (ev): 0.6042 0.6042 0.6049 0.6049 1.5715 1.5715 1.5727 1.5727 6.0181 6.0181 6.0324 6.0324 7.0556 7.0556 7.0739 7.0739 7.8732 7.8732 7.9146 7.9146 8.8214 8.8214 8.8230 8.8230 9.4012 9.4012 9.4858 9.4858 9.6400 9.6400 9.6582 9.6582 10.5470 10.5470 10.5826 10.5826 11.1380 11.1380 11.2269 11.2269 11.7331 11.7331 11.7870 11.7870 11.9443 11.9443 11.9551 11.9551 12.2030 12.2030 12.2120 12.2120 12.3826 12.3826 12.3844 12.3844 13.2848 13.2848 13.3266 13.3266 14.2960 14.2961 k = 0.5000-0.0000 0.0819 ( 3762 PWs) bands (ev): 0.5914 0.5914 0.5920 0.5920 1.5872 1.5872 1.5882 1.5882 6.0667 6.0667 6.0820 6.0820 7.0066 7.0066 7.0266 7.0266 7.8570 7.8570 7.8932 7.8932 8.8021 8.8021 8.8043 8.8043 9.4207 9.4207 9.5025 9.5025 9.6344 9.6344 9.6577 9.6577 10.5850 10.5850 10.6248 10.6248 11.1159 11.1159 11.2035 11.2035 11.7397 11.7397 11.7892 11.7892 11.9416 11.9416 11.9515 11.9515 12.2010 12.2010 12.2094 12.2094 12.3854 12.3854 12.3870 12.3870 13.2877 13.2877 13.3266 13.3266 14.3063 14.3063 k = 0.5000-0.0000 0.0717 ( 3754 PWs) bands (ev): 0.5800 0.5800 0.5806 0.5806 1.6012 1.6012 1.6021 1.6021 6.1170 6.1170 6.1331 6.1331 6.9557 6.9557 6.9769 6.9769 7.8432 7.8432 7.8743 7.8743 8.7843 8.7843 8.7869 8.7869 9.4391 9.4391 9.5173 9.5173 9.6294 9.6294 9.6567 9.6567 10.6233 10.6233 10.6671 10.6671 11.0922 11.0922 11.1780 11.1780 11.7468 11.7468 11.7913 11.7913 11.9394 11.9394 11.9482 11.9482 12.1992 12.1992 12.2069 12.2069 12.3881 12.3881 12.3895 12.3895 13.2918 13.2918 13.3273 13.3273 14.3153 14.3153 k = 0.5000-0.0000 0.0615 ( 3774 PWs) bands (ev): 0.5701 0.5701 0.5705 0.5705 1.6134 1.6134 1.6143 1.6143 6.1686 6.1686 6.1855 6.1855 6.9033 6.9033 6.9253 6.9253 7.8316 7.8316 7.8578 7.8578 8.7683 8.7683 8.7711 8.7711 9.4563 9.4563 9.5295 9.5295 9.6253 9.6253 9.6553 9.6553 10.6616 10.6616 10.7091 10.7091 11.0669 11.0669 11.1505 11.1505 11.7540 11.7540 11.7930 11.7930 11.9374 11.9374 11.9451 11.9451 12.1975 12.1975 12.2044 12.2044 12.3906 12.3906 12.3918 12.3918 13.2965 13.2965 13.3281 13.3281 14.3231 14.3232 k = 0.5000-0.0000 0.0512 ( 3768 PWs) bands (ev): 0.5616 0.5616 0.5620 0.5620 1.6240 1.6240 1.6247 1.6247 6.2210 6.2210 6.2385 6.2385 6.8500 6.8500 6.8724 6.8724 7.8223 7.8223 7.8437 7.8437 8.7545 8.7545 8.7572 8.7572 9.4723 9.4723 9.5386 9.5386 9.6228 9.6228 9.6534 9.6534 10.6998 10.6998 10.7509 10.7509 11.0403 11.0403 11.1214 11.1214 11.7612 11.7612 11.7942 11.7942 11.9360 11.9360 11.9425 11.9425 12.1963 12.1963 12.2022 12.2022 12.3928 12.3928 12.3938 12.3938 13.3018 13.3018 13.3290 13.3290 14.3300 14.3300 k = 0.5000-0.0000 0.0410 ( 3764 PWs) bands (ev): 0.5547 0.5547 0.5550 0.5550 1.6326 1.6326 1.6332 1.6332 6.2736 6.2736 6.2915 6.2915 6.7969 6.7969 6.8190 6.8190 7.8151 7.8151 7.8320 7.8320 8.7431 8.7431 8.7455 8.7455 9.4869 9.4869 9.5440 9.5440 9.6223 9.6223 9.6510 9.6510 10.7376 10.7376 10.7919 10.7919 11.0124 11.0124 11.0907 11.0907 11.7680 11.7680 11.7948 11.7948 11.9350 11.9350 11.9403 11.9403 12.1953 12.1953 12.2002 12.2002 12.3948 12.3948 12.3955 12.3955 13.3073 13.3073 13.3296 13.3296 14.3360 14.3360 k = 0.5000-0.0000 0.0307 ( 3764 PWs) bands (ev): 0.5493 0.5493 0.5495 0.5495 1.6394 1.6394 1.6399 1.6399 6.3252 6.3252 6.3428 6.3428 6.7454 6.7454 6.7664 6.7664 7.8100 7.8100 7.8225 7.8225 8.7341 8.7341 8.7360 8.7360 9.5001 9.5001 9.5455 9.5455 9.6240 9.6240 9.6481 9.6481 10.7748 10.7748 10.8318 10.8318 10.9835 10.9835 11.0586 11.0586 11.7743 11.7743 11.7945 11.7945 11.9344 11.9344 11.9385 11.9385 12.1945 12.1945 12.1983 12.1983 12.3963 12.3963 12.3969 12.3969 13.3126 13.3126 13.3298 13.3298 14.3412 14.3414 k = 0.5000-0.0000 0.0205 ( 3766 PWs) bands (ev): 0.5454 0.5454 0.5455 0.5455 1.6443 1.6443 1.6446 1.6446 6.3736 6.3736 6.3894 6.3894 6.6989 6.6989 6.7171 6.7171 7.8070 7.8070 7.8153 7.8153 8.7277 8.7277 8.7291 8.7291 9.5120 9.5120 9.5434 9.5434 9.6273 9.6273 9.6446 9.6446 10.8109 10.8109 10.8693 10.8693 10.9547 10.9547 11.0251 11.0251 11.7798 11.7798 11.7934 11.7934 11.9343 11.9343 11.9370 11.9370 12.1942 12.1942 12.1968 12.1968 12.3975 12.3975 12.3978 12.3978 13.3175 13.3175 13.3291 13.3291 14.3456 14.3457 k = 0.5000-0.0000 0.0102 ( 3760 PWs) bands (ev): 0.5431 0.5431 0.5432 0.5432 1.6473 1.6473 1.6475 1.6475 6.4136 6.4136 6.4241 6.4241 6.6645 6.6645 6.6762 6.6762 7.8060 7.8060 7.8101 7.8101 8.7240 8.7240 8.7247 8.7247 9.5225 9.5225 9.5385 9.5385 9.6316 9.6316 9.6406 9.6406 10.8458 10.8458 10.8948 10.8948 10.9357 10.9357 10.9908 10.9908 11.7846 11.7846 11.7914 11.7914 11.9346 11.9346 11.9359 11.9359 12.1943 12.1943 12.1956 12.1956 12.3982 12.3982 12.3984 12.3984 13.3217 13.3217 13.3276 13.3276 14.3494 14.3495 k = 0.5000-0.0000-0.0000 ( 3770 PWs) bands (ev): 0.5423 0.5423 0.5423 0.5423 1.6484 1.6484 1.6484 1.6484 6.4341 6.4341 6.4341 6.4341 6.6550 6.6550 6.6550 6.6550 7.8070 7.8070 7.8070 7.8070 8.7230 8.7230 8.7230 8.7230 9.5314 9.5314 9.5314 9.5314 9.6362 9.6362 9.6362 9.6362 10.8777 10.8777 10.8777 10.8777 10.9569 10.9569 10.9569 10.9569 11.7884 11.7884 11.7884 11.7884 11.9350 11.9350 11.9350 11.9350 12.1948 12.1948 12.1948 12.1948 12.3985 12.3985 12.3985 12.3985 13.3250 13.3250 13.3250 13.3250 14.3524 14.3524 k = 0.5000 0.3045-0.0000 ( 3752 PWs) bands (ev): 1.0932 1.0932 1.0932 1.0932 1.0999 1.0999 1.0999 1.0999 6.2966 6.2966 6.2966 6.2966 6.3018 6.3018 6.3018 6.3018 8.3284 8.3284 8.3284 8.3284 8.3713 8.3713 8.3713 8.3713 9.4868 9.4868 9.4868 9.4868 9.4966 9.4966 9.4966 9.4966 10.8305 10.8305 10.8305 10.8305 10.8360 10.8360 10.8360 10.8360 12.1863 12.1863 12.1863 12.1863 12.1896 12.1896 12.1896 12.1896 12.3308 12.3308 12.3308 12.3308 12.3409 12.3409 12.3409 12.3409 13.6269 13.6269 13.6270 13.6272 13.6277 13.6277 k = 0.5000 0.3045 0.0102 ( 3760 PWs) bands (ev): 1.0933 1.0933 1.0935 1.0935 1.1001 1.1001 1.1002 1.1002 6.2937 6.2937 6.2938 6.2938 6.2988 6.2988 6.2990 6.2990 8.3316 8.3316 8.3324 8.3324 8.3741 8.3741 8.3756 8.3756 9.4867 9.4867 9.4869 9.4869 9.4964 9.4964 9.4967 9.4967 10.8304 10.8304 10.8313 10.8313 10.8359 10.8359 10.8367 10.8367 12.1836 12.1836 12.1882 12.1882 12.1885 12.1885 12.1898 12.1898 12.3295 12.3295 12.3318 12.3318 12.3391 12.3391 12.3424 12.3424 13.6279 13.6279 13.6286 13.6286 13.6294 13.6295 k = 0.5000 0.3045 0.0205 ( 3768 PWs) bands (ev): 1.0939 1.0939 1.0942 1.0942 1.1006 1.1006 1.1009 1.1009 6.2850 6.2850 6.2853 6.2853 6.2900 6.2900 6.2903 6.2903 8.3420 8.3420 8.3436 8.3436 8.3840 8.3840 8.3868 8.3868 9.4866 9.4866 9.4870 9.4870 9.4963 9.4963 9.4968 9.4968 10.8310 10.8310 10.8330 10.8330 10.8366 10.8366 10.8382 10.8382 12.1801 12.1801 12.1866 12.1866 12.1891 12.1891 12.1891 12.1891 12.3280 12.3280 12.3325 12.3325 12.3370 12.3370 12.3436 12.3436 13.6325 13.6326 13.6332 13.6335 13.6355 13.6361 k = 0.5000 0.3045 0.0307 ( 3764 PWs) bands (ev): 1.0950 1.0950 1.0953 1.0953 1.1016 1.1016 1.1020 1.1020 6.2710 6.2710 6.2714 6.2714 6.2756 6.2756 6.2762 6.2762 8.3592 8.3592 8.3617 8.3617 8.4005 8.4005 8.4048 8.4048 9.4865 9.4865 9.4871 9.4871 9.4962 9.4962 9.4970 9.4970 10.8325 10.8325 10.8354 10.8354 10.8381 10.8381 10.8405 10.8405 12.1759 12.1759 12.1839 12.1839 12.1876 12.1876 12.1893 12.1893 12.3264 12.3264 12.3331 12.3331 12.3347 12.3347 12.3445 12.3445 13.6408 13.6408 13.6415 13.6415 13.6453 13.6453 k = 0.5000 0.3045 0.0410 ( 3768 PWs) bands (ev): 1.0964 1.0964 1.0969 1.0969 1.1030 1.1030 1.1035 1.1035 6.2520 6.2520 6.2526 6.2526 6.2563 6.2563 6.2569 6.2569 8.3828 8.3828 8.3861 8.3861 8.4232 8.4232 8.4289 8.4289 9.4863 9.4863 9.4872 9.4872 9.4960 9.4960 9.4972 9.4972 10.8348 10.8348 10.8387 10.8387 10.8403 10.8403 10.8435 10.8435 12.1710 12.1710 12.1803 12.1803 12.1851 12.1851 12.1885 12.1885 12.3248 12.3248 12.3323 12.3323 12.3334 12.3334 12.3450 12.3450 13.6527 13.6527 13.6535 13.6535 13.6586 13.6588 k = 0.5000 0.3045 0.0512 ( 3760 PWs) bands (ev): 1.0983 1.0983 1.0989 1.0989 1.1048 1.1048 1.1054 1.1054 6.2286 6.2286 6.2292 6.2292 6.2324 6.2324 6.2332 6.2332 8.4121 8.4121 8.4162 8.4162 8.4516 8.4516 8.4586 8.4586 9.4861 9.4861 9.4873 9.4873 9.4959 9.4959 9.4974 9.4974 10.8379 10.8379 10.8427 10.8427 10.8433 10.8433 10.8474 10.8474 12.1654 12.1654 12.1759 12.1759 12.1818 12.1818 12.1867 12.1867 12.3231 12.3231 12.3300 12.3300 12.3336 12.3336 12.3454 12.3454 13.6681 13.6681 13.6691 13.6691 13.6754 13.6754 k = 0.5000 0.3045 0.0615 ( 3760 PWs) bands (ev): 1.1005 1.1005 1.1012 1.1012 1.1069 1.1069 1.1076 1.1076 6.2014 6.2014 6.2021 6.2021 6.2047 6.2047 6.2056 6.2056 8.4464 8.4464 8.4513 8.4513 8.4849 8.4849 8.4933 8.4933 9.4859 9.4859 9.4873 9.4873 9.4958 9.4958 9.4975 9.4975 10.8417 10.8417 10.8469 10.8469 10.8476 10.8476 10.8519 10.8519 12.1591 12.1591 12.1706 12.1706 12.1775 12.1775 12.1838 12.1838 12.3215 12.3215 12.3277 12.3277 12.3337 12.3337 12.3455 12.3455 13.6872 13.6872 13.6884 13.6884 13.6958 13.6958 k = 0.5000 0.3045 0.0717 ( 3760 PWs) bands (ev): 1.1031 1.1031 1.1039 1.1039 1.1093 1.1093 1.1102 1.1102 6.1710 6.1710 6.1718 6.1718 6.1738 6.1738 6.1748 6.1748 8.4850 8.4850 8.4906 8.4906 8.5223 8.5223 8.5321 8.5321 9.4857 9.4857 9.4873 9.4873 9.4957 9.4957 9.4977 9.4977 10.8462 10.8462 10.8513 10.8513 10.8531 10.8531 10.8572 10.8572 12.1521 12.1521 12.1646 12.1646 12.1723 12.1723 12.1799 12.1799 12.3201 12.3201 12.3256 12.3256 12.3337 12.3337 12.3455 12.3455 13.7097 13.7097 13.7114 13.7114 13.7196 13.7196 k = 0.5000 0.3045 0.0819 ( 3752 PWs) bands (ev): 1.1060 1.1060 1.1070 1.1070 1.1121 1.1121 1.1130 1.1130 6.1382 6.1382 6.1389 6.1389 6.1405 6.1405 6.1415 6.1415 8.5269 8.5269 8.5333 8.5333 8.5631 8.5631 8.5742 8.5742 9.4855 9.4855 9.4873 9.4873 9.4956 9.4956 9.4978 9.4978 10.8515 10.8515 10.8564 10.8564 10.8595 10.8595 10.8632 10.8632 12.1446 12.1446 12.1578 12.1578 12.1662 12.1662 12.1749 12.1749 12.3188 12.3188 12.3238 12.3238 12.3337 12.3337 12.3453 12.3453 13.7359 13.7359 13.7380 13.7380 13.7470 13.7470 k = 0.5000 0.3045 0.0922 ( 3756 PWs) bands (ev): 1.1092 1.1092 1.1103 1.1103 1.1151 1.1151 1.1162 1.1162 6.1035 6.1035 6.1042 6.1042 6.1054 6.1054 6.1063 6.1063 8.5715 8.5715 8.5786 8.5786 8.6064 8.6064 8.6189 8.6189 9.4852 9.4852 9.4873 9.4873 9.4954 9.4954 9.4979 9.4979 10.8575 10.8575 10.8622 10.8622 10.8665 10.8665 10.8699 10.8699 12.1365 12.1365 12.1502 12.1502 12.1593 12.1593 12.1689 12.1689 12.3178 12.3178 12.3222 12.3222 12.3336 12.3336 12.3451 12.3451 13.7655 13.7655 13.7681 13.7681 13.7777 13.7777 k = 0.5000 0.3045 0.1024 ( 3752 PWs) bands (ev): 1.1126 1.1126 1.1138 1.1138 1.1184 1.1184 1.1195 1.1195 6.0676 6.0676 6.0683 6.0683 6.0691 6.0691 6.0700 6.0700 8.6179 8.6179 8.6258 8.6258 8.6515 8.6515 8.6654 8.6654 9.4848 9.4848 9.4873 9.4873 9.4953 9.4953 9.4979 9.4979 10.8642 10.8642 10.8687 10.8687 10.8742 10.8742 10.8773 10.8773 12.1279 12.1279 12.1420 12.1420 12.1516 12.1516 12.1620 12.1620 12.3171 12.3171 12.3211 12.3211 12.3337 12.3337 12.3448 12.3448 13.7986 13.7986 13.8017 13.8017 13.8118 13.8119 k = 0.5000 0.3045 0.1127 ( 3752 PWs) bands (ev): 1.1162 1.1162 1.1175 1.1175 1.1218 1.1218 1.1230 1.1230 6.0311 6.0311 6.0318 6.0318 6.0321 6.0321 6.0331 6.0331 8.6655 8.6655 8.6741 8.6741 8.6978 8.6978 8.7129 8.7129 9.4844 9.4844 9.4872 9.4872 9.4951 9.4951 9.4979 9.4979 10.8715 10.8715 10.8757 10.8757 10.8826 10.8826 10.8853 10.8853 12.1189 12.1189 12.1331 12.1331 12.1433 12.1433 12.1541 12.1541 12.3166 12.3166 12.3203 12.3203 12.3338 12.3338 12.3445 12.3445 13.8351 13.8351 13.8388 13.8388 13.8492 13.8492 k = 0.5000 0.3045 0.1229 ( 3756 PWs) bands (ev): 1.1200 1.1200 1.1214 1.1214 1.1253 1.1253 1.1267 1.1267 5.9945 5.9945 5.9951 5.9951 5.9952 5.9952 5.9961 5.9961 8.7135 8.7135 8.7228 8.7228 8.7443 8.7443 8.7608 8.7608 9.4840 9.4840 9.4871 9.4871 9.4948 9.4948 9.4979 9.4979 10.8794 10.8794 10.8833 10.8833 10.8916 10.8916 10.8939 10.8939 12.1094 12.1094 12.1237 12.1237 12.1345 12.1345 12.1455 12.1455 12.3164 12.3164 12.3197 12.3197 12.3340 12.3340 12.3443 12.3443 13.8750 13.8750 13.8794 13.8794 13.8899 13.8899 k = 0.5000 0.3045 0.1332 ( 3752 PWs) bands (ev): 1.1239 1.1239 1.1254 1.1254 1.1290 1.1290 1.1304 1.1304 5.9582 5.9582 5.9586 5.9586 5.9588 5.9588 5.9595 5.9595 8.7612 8.7612 8.7714 8.7714 8.7907 8.7907 8.8085 8.8085 9.4835 9.4835 9.4870 9.4870 9.4946 9.4946 9.4977 9.4977 10.8878 10.8878 10.8915 10.8915 10.9011 10.9011 10.9031 10.9031 12.0998 12.0998 12.1139 12.1139 12.1252 12.1252 12.1363 12.1363 12.3164 12.3164 12.3195 12.3195 12.3344 12.3344 12.3441 12.3441 13.9182 13.9182 13.9234 13.9234 13.9339 13.9339 k = 0.5000 0.3045 0.1434 ( 3748 PWs) bands (ev): 1.1278 1.1278 1.1295 1.1295 1.1326 1.1326 1.1342 1.1342 5.9228 5.9228 5.9229 5.9229 5.9233 5.9233 5.9237 5.9237 8.8082 8.8082 8.8191 8.8191 8.8362 8.8362 8.8553 8.8553 9.4830 9.4830 9.4868 9.4868 9.4943 9.4943 9.4975 9.4975 10.8966 10.8966 10.9001 10.9001 10.9111 10.9111 10.9127 10.9127 12.0900 12.0900 12.1038 12.1038 12.1157 12.1157 12.1267 12.1267 12.3166 12.3166 12.3196 12.3196 12.3349 12.3349 12.3440 12.3440 13.9646 13.9646 13.9706 13.9706 13.9810 13.9810 k = 0.5000 0.3045 0.1536 ( 3748 PWs) bands (ev): 1.1318 1.1318 1.1335 1.1335 1.1363 1.1363 1.1380 1.1380 5.8885 5.8885 5.8886 5.8886 5.8890 5.8890 5.8892 5.8892 8.8538 8.8538 8.8656 8.8656 8.8803 8.8803 8.9006 8.9006 9.4824 9.4824 9.4866 9.4866 9.4939 9.4939 9.4972 9.4972 10.9058 10.9058 10.9090 10.9090 10.9214 10.9214 10.9226 10.9226 12.0801 12.0801 12.0935 12.0935 12.1060 12.1060 12.1167 12.1167 12.3170 12.3170 12.3198 12.3198 12.3354 12.3354 12.3439 12.3439 14.0142 14.0142 14.0211 14.0211 14.0311 14.0311 k = 0.5000 0.3045 0.1639 ( 3752 PWs) bands (ev): 1.1357 1.1357 1.1375 1.1375 1.1399 1.1399 1.1416 1.1416 5.8556 5.8556 5.8559 5.8559 5.8563 5.8563 5.8563 5.8563 8.8976 8.8976 8.9102 8.9102 8.9224 8.9224 8.9440 8.9440 9.4818 9.4818 9.4864 9.4864 9.4935 9.4935 9.4967 9.4967 10.9152 10.9152 10.9181 10.9181 10.9318 10.9318 10.9328 10.9328 12.0703 12.0703 12.0831 12.0831 12.0963 12.0963 12.1066 12.1066 12.3176 12.3176 12.3202 12.3202 12.3360 12.3360 12.3438 12.3438 14.0667 14.0667 14.0745 14.0745 14.0840 14.0840 k = 0.5000 0.3045 0.1741 ( 3756 PWs) bands (ev): 1.1395 1.1395 1.1413 1.1413 1.1434 1.1434 1.1452 1.1452 5.8247 5.8247 5.8250 5.8250 5.8252 5.8252 5.8254 5.8254 8.9391 8.9391 8.9526 8.9526 8.9623 8.9623 8.9850 8.9850 9.4812 9.4812 9.4861 9.4861 9.4929 9.4929 9.4961 9.4961 10.9246 10.9246 10.9272 10.9272 10.9423 10.9423 10.9430 10.9430 12.0607 12.0607 12.0727 12.0727 12.0868 12.0868 12.0965 12.0965 12.3182 12.3182 12.3207 12.3207 12.3367 12.3367 12.3438 12.3438 14.1220 14.1220 14.1306 14.1306 14.1396 14.1396 k = 0.5000 0.3045 0.1844 ( 3760 PWs) bands (ev): 1.1431 1.1431 1.1451 1.1451 1.1467 1.1467 1.1486 1.1486 5.7959 5.7959 5.7964 5.7964 5.7964 5.7964 5.7966 5.7966 8.9779 8.9779 8.9924 8.9924 8.9993 8.9993 9.0232 9.0232 9.4805 9.4805 9.4858 9.4858 9.4924 9.4924 9.4954 9.4954 10.9340 10.9340 10.9363 10.9363 10.9526 10.9526 10.9531 10.9531 12.0515 12.0515 12.0627 12.0627 12.0776 12.0776 12.0867 12.0867 12.3189 12.3189 12.3213 12.3213 12.3374 12.3374 12.3438 12.3438 14.1797 14.1797 14.1893 14.1893 14.1975 14.1975 k = 0.5000 0.3045 0.1946 ( 3764 PWs) bands (ev): 1.1466 1.1466 1.1486 1.1486 1.1498 1.1498 1.1517 1.1517 5.7696 5.7696 5.7700 5.7700 5.7701 5.7701 5.7703 5.7703 9.0137 9.0137 9.0293 9.0293 9.0333 9.0333 9.0581 9.0581 9.4799 9.4799 9.4855 9.4855 9.4917 9.4917 9.4944 9.4944 10.9431 10.9431 10.9452 10.9452 10.9627 10.9627 10.9629 10.9629 12.0427 12.0427 12.0530 12.0530 12.0689 12.0689 12.0773 12.0773 12.3196 12.3196 12.3218 12.3218 12.3381 12.3381 12.3438 12.3438 14.2396 14.2396 14.2500 14.2500 14.2574 14.2574 k = 0.5000 0.3045 0.2048 ( 3764 PWs) bands (ev): 1.1497 1.1497 1.1518 1.1518 1.1526 1.1526 1.1546 1.1546 5.7459 5.7459 5.7462 5.7462 5.7464 5.7464 5.7465 5.7465 9.0462 9.0462 9.0628 9.0628 9.0638 9.0638 9.0894 9.0894 9.4794 9.4794 9.4852 9.4852 9.4910 9.4910 9.4933 9.4933 10.9518 10.9518 10.9536 10.9536 10.9722 10.9722 10.9723 10.9723 12.0347 12.0347 12.0440 12.0440 12.0609 12.0609 12.0684 12.0684 12.3204 12.3204 12.3224 12.3224 12.3389 12.3389 12.3439 12.3439 14.3010 14.3010 14.3121 14.3121 14.3187 14.3187 k = 0.5000 0.3045 0.2151 ( 3760 PWs) bands (ev): 1.1526 1.1526 1.1547 1.1547 1.1551 1.1551 1.1571 1.1571 5.7250 5.7250 5.7253 5.7253 5.7255 5.7255 5.7256 5.7256 9.0752 9.0752 9.0906 9.0906 9.0929 9.0929 9.1169 9.1169 9.4790 9.4790 9.4849 9.4849 9.4902 9.4902 9.4920 9.4920 10.9599 10.9599 10.9614 10.9614 10.9810 10.9810 10.9810 10.9810 12.0275 12.0275 12.0356 12.0356 12.0537 12.0537 12.0602 12.0602 12.3212 12.3212 12.3230 12.3230 12.3397 12.3397 12.3439 12.3439 14.3631 14.3631 14.3749 14.3749 14.3804 14.3804 k = 0.5000 0.3045 0.2253 ( 3760 PWs) bands (ev): 1.1552 1.1552 1.1572 1.1572 1.1573 1.1573 1.1594 1.1594 5.7070 5.7070 5.7073 5.7073 5.7075 5.7075 5.7076 5.7076 9.1003 9.1003 9.1135 9.1135 9.1193 9.1193 9.1403 9.1403 9.4788 9.4788 9.4847 9.4847 9.4894 9.4894 9.4905 9.4905 10.9671 10.9671 10.9684 10.9684 10.9888 10.9888 10.9889 10.9889 12.0211 12.0211 12.0281 12.0281 12.0473 12.0473 12.0529 12.0529 12.3219 12.3219 12.3234 12.3234 12.3404 12.3404 12.3439 12.3439 14.4248 14.4248 14.4368 14.4368 14.4413 14.4413 k = 0.5000 0.3045 0.2356 ( 3764 PWs) bands (ev): 1.1574 1.1574 1.1590 1.1590 1.1595 1.1595 1.1612 1.1612 5.6922 5.6922 5.6924 5.6924 5.6926 5.6926 5.6927 5.6927 9.1214 9.1214 9.1322 9.1322 9.1416 9.1416 9.1592 9.1592 9.4788 9.4788 9.4846 9.4846 9.4885 9.4885 9.4889 9.4889 10.9733 10.9733 10.9744 10.9744 10.9955 10.9955 10.9956 10.9956 12.0159 12.0159 12.0215 12.0215 12.0420 12.0420 12.0465 12.0465 12.3226 12.3226 12.3238 12.3238 12.3410 12.3410 12.3439 12.3439 14.4845 14.4845 14.4963 14.4963 14.4997 14.4997 k = 0.5000 0.3045 0.2458 ( 3764 PWs) bands (ev): 1.1591 1.1591 1.1604 1.1604 1.1613 1.1613 1.1626 1.1626 5.6806 5.6806 5.6807 5.6807 5.6809 5.6809 5.6809 5.6809 9.1384 9.1384 9.1466 9.1466 9.1599 9.1599 9.1735 9.1735 9.4791 9.4791 9.4846 9.4846 9.4872 9.4872 9.4876 9.4876 10.9784 10.9784 10.9792 10.9792 11.0009 11.0009 11.0011 11.0011 12.0118 12.0118 12.0161 12.0161 12.0379 12.0379 12.0413 12.0413 12.3231 12.3231 12.3241 12.3241 12.3416 12.3416 12.3437 12.3437 14.5396 14.5396 14.5503 14.5503 14.5528 14.5528 k = 0.5000 0.3045 0.2561 ( 3760 PWs) bands (ev): 1.1605 1.1605 1.1613 1.1613 1.1627 1.1627 1.1635 1.1635 5.6723 5.6723 5.6724 5.6724 5.6725 5.6725 5.6725 5.6725 9.1510 9.1510 9.1566 9.1566 9.1738 9.1738 9.1831 9.1831 9.4798 9.4798 9.4847 9.4847 9.4854 9.4854 9.4868 9.4868 10.9822 10.9822 10.9828 10.9828 11.0050 11.0050 11.0051 11.0051 12.0091 12.0091 12.0120 12.0120 12.0351 12.0351 12.0374 12.0374 12.3236 12.3236 12.3242 12.3242 12.3422 12.3422 12.3436 12.3436 14.5866 14.5866 14.5951 14.5951 14.5965 14.5965 k = 0.5000 0.3045 0.2663 ( 3756 PWs) bands (ev): 1.1614 1.1614 1.1618 1.1618 1.1636 1.1636 1.1640 1.1640 5.6672 5.6672 5.6673 5.6673 5.6674 5.6674 5.6674 5.6674 9.1592 9.1592 9.1620 9.1620 9.1832 9.1832 9.1880 9.1880 9.4808 9.4808 9.4837 9.4837 9.4850 9.4850 9.4861 9.4861 10.9846 10.9846 10.9849 10.9849 11.0075 11.0075 11.0076 11.0076 12.0078 12.0078 12.0092 12.0092 12.0336 12.0336 12.0348 12.0348 12.3239 12.3239 12.3242 12.3242 12.3426 12.3426 12.3433 12.3433 14.6206 14.6206 14.6254 14.6254 14.6260 14.6260 k = 0.5000 0.3045 0.2765 ( 3752 PWs) bands (ev): 1.1618 1.1618 1.1618 1.1618 1.1641 1.1641 1.1641 1.1641 5.6656 5.6656 5.6656 5.6656 5.6657 5.6657 5.6657 5.6657 9.1629 9.1629 9.1629 9.1629 9.1879 9.1879 9.1879 9.1879 9.4822 9.4822 9.4822 9.4822 9.4855 9.4855 9.4855 9.4855 10.9855 10.9855 10.9855 10.9855 11.0084 11.0084 11.0084 11.0084 12.0078 12.0078 12.0078 12.0078 12.0335 12.0335 12.0335 12.0335 12.3241 12.3241 12.3241 12.3241 12.3430 12.3430 12.3430 12.3430 14.6364 14.6364 14.6364 14.6365 14.6365 14.6365 Writing output data file FeAs.save init_run : 0.16s CPU 0.30s WALL ( 1 calls) electrons : 302.95s CPU 307.29s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.01s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 302.94s CPU 307.27s 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 : 0.05s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.08s WALL ( 432 calls) cegterg : 273.07s CPU 276.69s WALL ( 695 calls) Called by sum_band: Called by *egterg: h_psi : 129.97s CPU 132.13s WALL ( 11737 calls) s_psi : 19.70s CPU 19.73s WALL ( 11737 calls) g_psi : 0.39s CPU 0.34s WALL ( 10610 calls) cdiaghg : 112.73s CPU 114.25s WALL ( 11042 calls) cegterg:over : 11.16s CPU 11.20s WALL ( 10610 calls) cegterg:upda : 9.60s CPU 9.76s WALL ( 10610 calls) cegterg:last : 4.69s CPU 4.76s WALL ( 1767 calls) cdiaghg:chol : 6.39s CPU 6.53s WALL ( 11042 calls) cdiaghg:inve : 4.44s CPU 4.72s WALL ( 11042 calls) cdiaghg:para : 7.56s CPU 7.89s WALL ( 22084 calls) Called by h_psi: h_psi:vloc : 104.36s CPU 106.33s WALL ( 11737 calls) h_psi:vnl : 25.21s CPU 25.45s WALL ( 11737 calls) add_vuspsi : 13.31s CPU 13.45s WALL ( 11737 calls) General routines calbec : 11.88s CPU 11.96s WALL ( 11737 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 98.72s CPU 100.63s WALL ( 1408916 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.30s WALL ( 864 calls) Parallel routines fft_scatter : 37.51s CPU 38.20s WALL ( 1408939 calls) PWSCF : 5m25.38s CPU 5m42.55s WALL This run was terminated on: 13:12:54 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=