Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 19:33:59 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: ./AlO2.save/ 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 31 18 5 2157 942 155 Max 32 19 6 2170 971 166 Sum 1149 671 201 77989 34519 5771 bravais-lattice index = 14 lattice parameter (alat) = 5.3668 a.u. unit-cell volume = 791.8321 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.366822 celldm(2)= 1.549296 celldm(3)= 3.306338 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 1.549296 0.000000 ) a(3) = ( 0.000000 0.000000 3.306338 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.645455 -0.000000 ) b(3) = ( 0.000000 0.000000 0.302449 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Al 3.00 26.98150 Al( 1.00) 8 Sym. Ops., with inversion, found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.7746479 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.6531690 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.7746479 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.6531690 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.7746479 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.6531690 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.7746479 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.6531690 ) 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= 448 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 2) = ( 0.0089286 -0.0000000 -0.0000000), wk = 0.0022321 k( 3) = ( 0.0178571 -0.0000000 -0.0000000), wk = 0.0022321 k( 4) = ( 0.0267857 -0.0000000 -0.0000000), wk = 0.0022321 k( 5) = ( 0.0357143 -0.0000000 -0.0000000), wk = 0.0022321 k( 6) = ( 0.0446429 -0.0000000 -0.0000000), wk = 0.0022321 k( 7) = ( 0.0535714 -0.0000000 -0.0000000), wk = 0.0022321 k( 8) = ( 0.0625000 -0.0000000 -0.0000000), wk = 0.0022321 k( 9) = ( 0.0714286 -0.0000000 -0.0000000), wk = 0.0022321 k( 10) = ( 0.0803571 -0.0000000 -0.0000000), wk = 0.0022321 k( 11) = ( 0.0892857 -0.0000000 -0.0000000), wk = 0.0022321 k( 12) = ( 0.0982143 -0.0000000 -0.0000000), wk = 0.0022321 k( 13) = ( 0.1071429 -0.0000000 -0.0000000), wk = 0.0022321 k( 14) = ( 0.1160714 -0.0000000 -0.0000000), wk = 0.0022321 k( 15) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0022321 k( 16) = ( 0.1339286 -0.0000000 -0.0000000), wk = 0.0022321 k( 17) = ( 0.1428571 -0.0000000 -0.0000000), wk = 0.0022321 k( 18) = ( 0.1517857 -0.0000000 -0.0000000), wk = 0.0022321 k( 19) = ( 0.1607143 -0.0000000 -0.0000000), wk = 0.0022321 k( 20) = ( 0.1696429 -0.0000000 -0.0000000), wk = 0.0022321 k( 21) = ( 0.1785714 -0.0000000 -0.0000000), wk = 0.0022321 k( 22) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0022321 k( 23) = ( 0.1964286 -0.0000000 -0.0000000), wk = 0.0022321 k( 24) = ( 0.2053571 -0.0000000 -0.0000000), wk = 0.0022321 k( 25) = ( 0.2142857 -0.0000000 -0.0000000), wk = 0.0022321 k( 26) = ( 0.2232143 -0.0000000 -0.0000000), wk = 0.0022321 k( 27) = ( 0.2321429 -0.0000000 -0.0000000), wk = 0.0022321 k( 28) = ( 0.2410714 -0.0000000 -0.0000000), wk = 0.0022321 k( 29) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0022321 k( 30) = ( 0.2589286 -0.0000000 -0.0000000), wk = 0.0022321 k( 31) = ( 0.2678571 -0.0000000 -0.0000000), wk = 0.0022321 k( 32) = ( 0.2767857 -0.0000000 -0.0000000), wk = 0.0022321 k( 33) = ( 0.2857143 -0.0000000 -0.0000000), wk = 0.0022321 k( 34) = ( 0.2946429 -0.0000000 -0.0000000), wk = 0.0022321 k( 35) = ( 0.3035714 -0.0000000 -0.0000000), wk = 0.0022321 k( 36) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0022321 k( 37) = ( 0.3214286 -0.0000000 -0.0000000), wk = 0.0022321 k( 38) = ( 0.3303571 -0.0000000 -0.0000000), wk = 0.0022321 k( 39) = ( 0.3392857 -0.0000000 -0.0000000), wk = 0.0022321 k( 40) = ( 0.3482143 -0.0000000 -0.0000000), wk = 0.0022321 k( 41) = ( 0.3571429 -0.0000000 -0.0000000), wk = 0.0022321 k( 42) = ( 0.3660714 -0.0000000 -0.0000000), wk = 0.0022321 k( 43) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0022321 k( 44) = ( 0.3839286 -0.0000000 -0.0000000), wk = 0.0022321 k( 45) = ( 0.3928571 -0.0000000 -0.0000000), wk = 0.0022321 k( 46) = ( 0.4017857 -0.0000000 -0.0000000), wk = 0.0022321 k( 47) = ( 0.4107143 -0.0000000 -0.0000000), wk = 0.0022321 k( 48) = ( 0.4196429 -0.0000000 -0.0000000), wk = 0.0022321 k( 49) = ( 0.4285714 -0.0000000 -0.0000000), wk = 0.0022321 k( 50) = ( 0.4375000 -0.0000000 -0.0000000), wk = 0.0022321 k( 51) = ( 0.4464286 -0.0000000 -0.0000000), wk = 0.0022321 k( 52) = ( 0.4553571 -0.0000000 -0.0000000), wk = 0.0022321 k( 53) = ( 0.4642857 -0.0000000 -0.0000000), wk = 0.0022321 k( 54) = ( 0.4732143 -0.0000000 -0.0000000), wk = 0.0022321 k( 55) = ( 0.4821429 -0.0000000 -0.0000000), wk = 0.0022321 k( 56) = ( 0.4910714 -0.0000000 -0.0000000), wk = 0.0022321 k( 57) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0022321 k( 58) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0022321 k( 59) = ( 0.5000000 0.0089646 -0.0000000), wk = 0.0022321 k( 60) = ( 0.5000000 0.0179293 -0.0000000), wk = 0.0022321 k( 61) = ( 0.5000000 0.0268939 -0.0000000), wk = 0.0022321 k( 62) = ( 0.5000000 0.0358586 -0.0000000), wk = 0.0022321 k( 63) = ( 0.5000000 0.0448232 -0.0000000), wk = 0.0022321 k( 64) = ( 0.5000000 0.0537879 -0.0000000), wk = 0.0022321 k( 65) = ( 0.5000000 0.0627525 -0.0000000), wk = 0.0022321 k( 66) = ( 0.5000000 0.0717172 -0.0000000), wk = 0.0022321 k( 67) = ( 0.5000000 0.0806818 -0.0000000), wk = 0.0022321 k( 68) = ( 0.5000000 0.0896465 -0.0000000), wk = 0.0022321 k( 69) = ( 0.5000000 0.0986111 -0.0000000), wk = 0.0022321 k( 70) = ( 0.5000000 0.1075758 -0.0000000), wk = 0.0022321 k( 71) = ( 0.5000000 0.1165404 -0.0000000), wk = 0.0022321 k( 72) = ( 0.5000000 0.1255050 -0.0000000), wk = 0.0022321 k( 73) = ( 0.5000000 0.1344697 -0.0000000), wk = 0.0022321 k( 74) = ( 0.5000000 0.1434343 -0.0000000), wk = 0.0022321 k( 75) = ( 0.5000000 0.1523990 -0.0000000), wk = 0.0022321 k( 76) = ( 0.5000000 0.1613636 -0.0000000), wk = 0.0022321 k( 77) = ( 0.5000000 0.1703283 -0.0000000), wk = 0.0022321 k( 78) = ( 0.5000000 0.1792929 -0.0000000), wk = 0.0022321 k( 79) = ( 0.5000000 0.1882576 -0.0000000), wk = 0.0022321 k( 80) = ( 0.5000000 0.1972222 -0.0000000), wk = 0.0022321 k( 81) = ( 0.5000000 0.2061869 -0.0000000), wk = 0.0022321 k( 82) = ( 0.5000000 0.2151515 -0.0000000), wk = 0.0022321 k( 83) = ( 0.5000000 0.2241162 -0.0000000), wk = 0.0022321 k( 84) = ( 0.5000000 0.2330808 -0.0000000), wk = 0.0022321 k( 85) = ( 0.5000000 0.2420455 -0.0000000), wk = 0.0022321 k( 86) = ( 0.5000000 0.2510101 -0.0000000), wk = 0.0022321 k( 87) = ( 0.5000000 0.2599747 -0.0000000), wk = 0.0022321 k( 88) = ( 0.5000000 0.2689394 -0.0000000), wk = 0.0022321 k( 89) = ( 0.5000000 0.2779040 -0.0000000), wk = 0.0022321 k( 90) = ( 0.5000000 0.2868687 -0.0000000), wk = 0.0022321 k( 91) = ( 0.5000000 0.2958333 -0.0000000), wk = 0.0022321 k( 92) = ( 0.5000000 0.3047980 -0.0000000), wk = 0.0022321 k( 93) = ( 0.5000000 0.3137626 -0.0000000), wk = 0.0022321 k( 94) = ( 0.5000000 0.3227273 -0.0000000), wk = 0.0022321 k( 95) = ( 0.5000000 0.3227273 -0.0000000), wk = 0.0022321 k( 96) = ( 0.4910714 0.3227273 -0.0000000), wk = 0.0022321 k( 97) = ( 0.4821429 0.3227273 -0.0000000), wk = 0.0022321 k( 98) = ( 0.4732143 0.3227273 -0.0000000), wk = 0.0022321 k( 99) = ( 0.4642857 0.3227273 -0.0000000), wk = 0.0022321 k( 100) = ( 0.4553571 0.3227273 -0.0000000), wk = 0.0022321 k( 101) = ( 0.4464286 0.3227273 -0.0000000), wk = 0.0022321 k( 102) = ( 0.4375000 0.3227273 -0.0000000), wk = 0.0022321 k( 103) = ( 0.4285714 0.3227273 -0.0000000), wk = 0.0022321 k( 104) = ( 0.4196429 0.3227273 -0.0000000), wk = 0.0022321 k( 105) = ( 0.4107143 0.3227273 -0.0000000), wk = 0.0022321 k( 106) = ( 0.4017857 0.3227273 -0.0000000), wk = 0.0022321 k( 107) = ( 0.3928571 0.3227273 -0.0000000), wk = 0.0022321 k( 108) = ( 0.3839286 0.3227273 -0.0000000), wk = 0.0022321 k( 109) = ( 0.3750000 0.3227273 -0.0000000), wk = 0.0022321 k( 110) = ( 0.3660714 0.3227273 -0.0000000), wk = 0.0022321 k( 111) = ( 0.3571429 0.3227273 -0.0000000), wk = 0.0022321 k( 112) = ( 0.3482143 0.3227273 -0.0000000), wk = 0.0022321 k( 113) = ( 0.3392857 0.3227273 -0.0000000), wk = 0.0022321 k( 114) = ( 0.3303571 0.3227273 -0.0000000), wk = 0.0022321 k( 115) = ( 0.3214286 0.3227273 -0.0000000), wk = 0.0022321 k( 116) = ( 0.3125000 0.3227273 -0.0000000), wk = 0.0022321 k( 117) = ( 0.3035714 0.3227273 -0.0000000), wk = 0.0022321 k( 118) = ( 0.2946429 0.3227273 -0.0000000), wk = 0.0022321 k( 119) = ( 0.2857143 0.3227273 -0.0000000), wk = 0.0022321 k( 120) = ( 0.2767857 0.3227273 -0.0000000), wk = 0.0022321 k( 121) = ( 0.2678571 0.3227273 -0.0000000), wk = 0.0022321 k( 122) = ( 0.2589286 0.3227273 -0.0000000), wk = 0.0022321 k( 123) = ( 0.2500000 0.3227273 -0.0000000), wk = 0.0022321 k( 124) = ( 0.2410714 0.3227273 -0.0000000), wk = 0.0022321 k( 125) = ( 0.2321429 0.3227273 -0.0000000), wk = 0.0022321 k( 126) = ( 0.2232143 0.3227273 -0.0000000), wk = 0.0022321 k( 127) = ( 0.2142857 0.3227273 -0.0000000), wk = 0.0022321 k( 128) = ( 0.2053571 0.3227273 -0.0000000), wk = 0.0022321 k( 129) = ( 0.1964286 0.3227273 -0.0000000), wk = 0.0022321 k( 130) = ( 0.1875000 0.3227273 -0.0000000), wk = 0.0022321 k( 131) = ( 0.1785714 0.3227273 -0.0000000), wk = 0.0022321 k( 132) = ( 0.1696429 0.3227273 -0.0000000), wk = 0.0022321 k( 133) = ( 0.1607143 0.3227273 -0.0000000), wk = 0.0022321 k( 134) = ( 0.1517857 0.3227273 -0.0000000), wk = 0.0022321 k( 135) = ( 0.1428571 0.3227273 -0.0000000), wk = 0.0022321 k( 136) = ( 0.1339286 0.3227273 -0.0000000), wk = 0.0022321 k( 137) = ( 0.1250000 0.3227273 -0.0000000), wk = 0.0022321 k( 138) = ( 0.1160714 0.3227273 -0.0000000), wk = 0.0022321 k( 139) = ( 0.1071429 0.3227273 -0.0000000), wk = 0.0022321 k( 140) = ( 0.0982143 0.3227273 -0.0000000), wk = 0.0022321 k( 141) = ( 0.0892857 0.3227273 -0.0000000), wk = 0.0022321 k( 142) = ( 0.0803571 0.3227273 -0.0000000), wk = 0.0022321 k( 143) = ( 0.0714286 0.3227273 -0.0000000), wk = 0.0022321 k( 144) = ( 0.0625000 0.3227273 -0.0000000), wk = 0.0022321 k( 145) = ( 0.0535714 0.3227273 -0.0000000), wk = 0.0022321 k( 146) = ( 0.0446429 0.3227273 -0.0000000), wk = 0.0022321 k( 147) = ( 0.0357143 0.3227273 -0.0000000), wk = 0.0022321 k( 148) = ( 0.0267857 0.3227273 -0.0000000), wk = 0.0022321 k( 149) = ( 0.0178571 0.3227273 -0.0000000), wk = 0.0022321 k( 150) = ( 0.0089286 0.3227273 -0.0000000), wk = 0.0022321 k( 151) = ( 0.0000000 0.3227273 -0.0000000), wk = 0.0022321 k( 152) = ( 0.0000000 0.3227273 -0.0000000), wk = 0.0022321 k( 153) = ( 0.0000000 0.3137626 -0.0000000), wk = 0.0022321 k( 154) = ( 0.0000000 0.3047980 -0.0000000), wk = 0.0022321 k( 155) = ( 0.0000000 0.2958333 -0.0000000), wk = 0.0022321 k( 156) = ( 0.0000000 0.2868687 -0.0000000), wk = 0.0022321 k( 157) = ( 0.0000000 0.2779040 -0.0000000), wk = 0.0022321 k( 158) = ( 0.0000000 0.2689394 -0.0000000), wk = 0.0022321 k( 159) = ( 0.0000000 0.2599747 -0.0000000), wk = 0.0022321 k( 160) = ( 0.0000000 0.2510101 -0.0000000), wk = 0.0022321 k( 161) = ( 0.0000000 0.2420455 -0.0000000), wk = 0.0022321 k( 162) = ( 0.0000000 0.2330808 -0.0000000), wk = 0.0022321 k( 163) = ( 0.0000000 0.2241162 -0.0000000), wk = 0.0022321 k( 164) = ( 0.0000000 0.2151515 -0.0000000), wk = 0.0022321 k( 165) = ( 0.0000000 0.2061869 -0.0000000), wk = 0.0022321 k( 166) = ( 0.0000000 0.1972222 -0.0000000), wk = 0.0022321 k( 167) = ( 0.0000000 0.1882576 -0.0000000), wk = 0.0022321 k( 168) = ( 0.0000000 0.1792929 -0.0000000), wk = 0.0022321 k( 169) = ( 0.0000000 0.1703283 -0.0000000), wk = 0.0022321 k( 170) = ( 0.0000000 0.1613636 -0.0000000), wk = 0.0022321 k( 171) = ( 0.0000000 0.1523990 -0.0000000), wk = 0.0022321 k( 172) = ( 0.0000000 0.1434343 -0.0000000), wk = 0.0022321 k( 173) = ( 0.0000000 0.1344697 -0.0000000), wk = 0.0022321 k( 174) = ( 0.0000000 0.1255050 -0.0000000), wk = 0.0022321 k( 175) = ( 0.0000000 0.1165404 -0.0000000), wk = 0.0022321 k( 176) = ( 0.0000000 0.1075758 -0.0000000), wk = 0.0022321 k( 177) = ( 0.0000000 0.0986111 -0.0000000), wk = 0.0022321 k( 178) = ( 0.0000000 0.0896465 -0.0000000), wk = 0.0022321 k( 179) = ( 0.0000000 0.0806818 -0.0000000), wk = 0.0022321 k( 180) = ( 0.0000000 0.0717172 -0.0000000), wk = 0.0022321 k( 181) = ( 0.0000000 0.0627525 -0.0000000), wk = 0.0022321 k( 182) = ( 0.0000000 0.0537879 -0.0000000), wk = 0.0022321 k( 183) = ( 0.0000000 0.0448232 -0.0000000), wk = 0.0022321 k( 184) = ( 0.0000000 0.0358586 -0.0000000), wk = 0.0022321 k( 185) = ( 0.0000000 0.0268939 -0.0000000), wk = 0.0022321 k( 186) = ( 0.0000000 0.0179293 -0.0000000), wk = 0.0022321 k( 187) = ( 0.0000000 0.0089646 -0.0000000), wk = 0.0022321 k( 188) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 189) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 190) = ( 0.0000000 0.0000000 0.0088956), wk = 0.0022321 k( 191) = ( 0.0000000 0.0000000 0.0177911), wk = 0.0022321 k( 192) = ( 0.0000000 0.0000000 0.0266867), wk = 0.0022321 k( 193) = ( 0.0000000 0.0000000 0.0355823), wk = 0.0022321 k( 194) = ( 0.0000000 0.0000000 0.0444779), wk = 0.0022321 k( 195) = ( 0.0000000 0.0000000 0.0533734), wk = 0.0022321 k( 196) = ( 0.0000000 0.0000000 0.0622690), wk = 0.0022321 k( 197) = ( 0.0000000 0.0000000 0.0711646), wk = 0.0022321 k( 198) = ( 0.0000000 0.0000000 0.0800601), wk = 0.0022321 k( 199) = ( 0.0000000 0.0000000 0.0889557), wk = 0.0022321 k( 200) = ( 0.0000000 0.0000000 0.0978513), wk = 0.0022321 k( 201) = ( 0.0000000 0.0000000 0.1067469), wk = 0.0022321 k( 202) = ( 0.0000000 0.0000000 0.1156424), wk = 0.0022321 k( 203) = ( 0.0000000 0.0000000 0.1245380), wk = 0.0022321 k( 204) = ( 0.0000000 0.0000000 0.1334336), wk = 0.0022321 k( 205) = ( 0.0000000 0.0000000 0.1423291), wk = 0.0022321 k( 206) = ( 0.0000000 0.0000000 0.1512247), wk = 0.0022321 k( 207) = ( 0.0000000 0.0000000 0.1512247), wk = 0.0022321 k( 208) = ( 0.0089286 -0.0000000 0.1512247), wk = 0.0022321 k( 209) = ( 0.0178571 -0.0000000 0.1512247), wk = 0.0022321 k( 210) = ( 0.0267857 -0.0000000 0.1512247), wk = 0.0022321 k( 211) = ( 0.0357143 -0.0000000 0.1512247), wk = 0.0022321 k( 212) = ( 0.0446429 -0.0000000 0.1512247), wk = 0.0022321 k( 213) = ( 0.0535714 -0.0000000 0.1512247), wk = 0.0022321 k( 214) = ( 0.0625000 -0.0000000 0.1512247), wk = 0.0022321 k( 215) = ( 0.0714286 -0.0000000 0.1512247), wk = 0.0022321 k( 216) = ( 0.0803571 -0.0000000 0.1512247), wk = 0.0022321 k( 217) = ( 0.0892857 -0.0000000 0.1512247), wk = 0.0022321 k( 218) = ( 0.0982143 -0.0000000 0.1512247), wk = 0.0022321 k( 219) = ( 0.1071429 -0.0000000 0.1512247), wk = 0.0022321 k( 220) = ( 0.1160714 -0.0000000 0.1512247), wk = 0.0022321 k( 221) = ( 0.1250000 -0.0000000 0.1512247), wk = 0.0022321 k( 222) = ( 0.1339286 -0.0000000 0.1512247), wk = 0.0022321 k( 223) = ( 0.1428571 -0.0000000 0.1512247), wk = 0.0022321 k( 224) = ( 0.1517857 -0.0000000 0.1512247), wk = 0.0022321 k( 225) = ( 0.1607143 -0.0000000 0.1512247), wk = 0.0022321 k( 226) = ( 0.1696429 -0.0000000 0.1512247), wk = 0.0022321 k( 227) = ( 0.1785714 -0.0000000 0.1512247), wk = 0.0022321 k( 228) = ( 0.1875000 -0.0000000 0.1512247), wk = 0.0022321 k( 229) = ( 0.1964286 -0.0000000 0.1512247), wk = 0.0022321 k( 230) = ( 0.2053571 -0.0000000 0.1512247), wk = 0.0022321 k( 231) = ( 0.2142857 -0.0000000 0.1512247), wk = 0.0022321 k( 232) = ( 0.2232143 -0.0000000 0.1512247), wk = 0.0022321 k( 233) = ( 0.2321429 -0.0000000 0.1512247), wk = 0.0022321 k( 234) = ( 0.2410714 -0.0000000 0.1512247), wk = 0.0022321 k( 235) = ( 0.2500000 -0.0000000 0.1512247), wk = 0.0022321 k( 236) = ( 0.2589286 -0.0000000 0.1512247), wk = 0.0022321 k( 237) = ( 0.2678571 -0.0000000 0.1512247), wk = 0.0022321 k( 238) = ( 0.2767857 -0.0000000 0.1512247), wk = 0.0022321 k( 239) = ( 0.2857143 -0.0000000 0.1512247), wk = 0.0022321 k( 240) = ( 0.2946429 -0.0000000 0.1512247), wk = 0.0022321 k( 241) = ( 0.3035714 -0.0000000 0.1512247), wk = 0.0022321 k( 242) = ( 0.3125000 -0.0000000 0.1512247), wk = 0.0022321 k( 243) = ( 0.3214286 -0.0000000 0.1512247), wk = 0.0022321 k( 244) = ( 0.3303571 -0.0000000 0.1512247), wk = 0.0022321 k( 245) = ( 0.3392857 -0.0000000 0.1512247), wk = 0.0022321 k( 246) = ( 0.3482143 -0.0000000 0.1512247), wk = 0.0022321 k( 247) = ( 0.3571429 -0.0000000 0.1512247), wk = 0.0022321 k( 248) = ( 0.3660714 -0.0000000 0.1512247), wk = 0.0022321 k( 249) = ( 0.3750000 -0.0000000 0.1512247), wk = 0.0022321 k( 250) = ( 0.3839286 -0.0000000 0.1512247), wk = 0.0022321 k( 251) = ( 0.3928571 -0.0000000 0.1512247), wk = 0.0022321 k( 252) = ( 0.4017857 -0.0000000 0.1512247), wk = 0.0022321 k( 253) = ( 0.4107143 -0.0000000 0.1512247), wk = 0.0022321 k( 254) = ( 0.4196429 -0.0000000 0.1512247), wk = 0.0022321 k( 255) = ( 0.4285714 -0.0000000 0.1512247), wk = 0.0022321 k( 256) = ( 0.4375000 -0.0000000 0.1512247), wk = 0.0022321 k( 257) = ( 0.4464286 -0.0000000 0.1512247), wk = 0.0022321 k( 258) = ( 0.4553571 -0.0000000 0.1512247), wk = 0.0022321 k( 259) = ( 0.4642857 -0.0000000 0.1512247), wk = 0.0022321 k( 260) = ( 0.4732143 -0.0000000 0.1512247), wk = 0.0022321 k( 261) = ( 0.4821429 -0.0000000 0.1512247), wk = 0.0022321 k( 262) = ( 0.4910714 -0.0000000 0.1512247), wk = 0.0022321 k( 263) = ( 0.5000000 -0.0000000 0.1512247), wk = 0.0022321 k( 264) = ( 0.5000000 -0.0000000 0.1512247), wk = 0.0022321 k( 265) = ( 0.5000000 0.0089646 0.1512247), wk = 0.0022321 k( 266) = ( 0.5000000 0.0179293 0.1512247), wk = 0.0022321 k( 267) = ( 0.5000000 0.0268939 0.1512247), wk = 0.0022321 k( 268) = ( 0.5000000 0.0358586 0.1512247), wk = 0.0022321 k( 269) = ( 0.5000000 0.0448232 0.1512247), wk = 0.0022321 k( 270) = ( 0.5000000 0.0537879 0.1512247), wk = 0.0022321 k( 271) = ( 0.5000000 0.0627525 0.1512247), wk = 0.0022321 k( 272) = ( 0.5000000 0.0717172 0.1512247), wk = 0.0022321 k( 273) = ( 0.5000000 0.0806818 0.1512247), wk = 0.0022321 k( 274) = ( 0.5000000 0.0896465 0.1512247), wk = 0.0022321 k( 275) = ( 0.5000000 0.0986111 0.1512247), wk = 0.0022321 k( 276) = ( 0.5000000 0.1075758 0.1512247), wk = 0.0022321 k( 277) = ( 0.5000000 0.1165404 0.1512247), wk = 0.0022321 k( 278) = ( 0.5000000 0.1255050 0.1512247), wk = 0.0022321 k( 279) = ( 0.5000000 0.1344697 0.1512247), wk = 0.0022321 k( 280) = ( 0.5000000 0.1434343 0.1512247), wk = 0.0022321 k( 281) = ( 0.5000000 0.1523990 0.1512247), wk = 0.0022321 k( 282) = ( 0.5000000 0.1613636 0.1512247), wk = 0.0022321 k( 283) = ( 0.5000000 0.1703283 0.1512247), wk = 0.0022321 k( 284) = ( 0.5000000 0.1792929 0.1512247), wk = 0.0022321 k( 285) = ( 0.5000000 0.1882576 0.1512247), wk = 0.0022321 k( 286) = ( 0.5000000 0.1972222 0.1512247), wk = 0.0022321 k( 287) = ( 0.5000000 0.2061869 0.1512247), wk = 0.0022321 k( 288) = ( 0.5000000 0.2151515 0.1512247), wk = 0.0022321 k( 289) = ( 0.5000000 0.2241162 0.1512247), wk = 0.0022321 k( 290) = ( 0.5000000 0.2330808 0.1512247), wk = 0.0022321 k( 291) = ( 0.5000000 0.2420455 0.1512247), wk = 0.0022321 k( 292) = ( 0.5000000 0.2510101 0.1512247), wk = 0.0022321 k( 293) = ( 0.5000000 0.2599747 0.1512247), wk = 0.0022321 k( 294) = ( 0.5000000 0.2689394 0.1512247), wk = 0.0022321 k( 295) = ( 0.5000000 0.2779040 0.1512247), wk = 0.0022321 k( 296) = ( 0.5000000 0.2868687 0.1512247), wk = 0.0022321 k( 297) = ( 0.5000000 0.2958333 0.1512247), wk = 0.0022321 k( 298) = ( 0.5000000 0.3047980 0.1512247), wk = 0.0022321 k( 299) = ( 0.5000000 0.3137626 0.1512247), wk = 0.0022321 k( 300) = ( 0.5000000 0.3227273 0.1512247), wk = 0.0022321 k( 301) = ( 0.5000000 0.3227273 0.1512247), wk = 0.0022321 k( 302) = ( 0.4910714 0.3227273 0.1512247), wk = 0.0022321 k( 303) = ( 0.4821429 0.3227273 0.1512247), wk = 0.0022321 k( 304) = ( 0.4732143 0.3227273 0.1512247), wk = 0.0022321 k( 305) = ( 0.4642857 0.3227273 0.1512247), wk = 0.0022321 k( 306) = ( 0.4553571 0.3227273 0.1512247), wk = 0.0022321 k( 307) = ( 0.4464286 0.3227273 0.1512247), wk = 0.0022321 k( 308) = ( 0.4375000 0.3227273 0.1512247), wk = 0.0022321 k( 309) = ( 0.4285714 0.3227273 0.1512247), wk = 0.0022321 k( 310) = ( 0.4196429 0.3227273 0.1512247), wk = 0.0022321 k( 311) = ( 0.4107143 0.3227273 0.1512247), wk = 0.0022321 k( 312) = ( 0.4017857 0.3227273 0.1512247), wk = 0.0022321 k( 313) = ( 0.3928571 0.3227273 0.1512247), wk = 0.0022321 k( 314) = ( 0.3839286 0.3227273 0.1512247), wk = 0.0022321 k( 315) = ( 0.3750000 0.3227273 0.1512247), wk = 0.0022321 k( 316) = ( 0.3660714 0.3227273 0.1512247), wk = 0.0022321 k( 317) = ( 0.3571429 0.3227273 0.1512247), wk = 0.0022321 k( 318) = ( 0.3482143 0.3227273 0.1512247), wk = 0.0022321 k( 319) = ( 0.3392857 0.3227273 0.1512247), wk = 0.0022321 k( 320) = ( 0.3303571 0.3227273 0.1512247), wk = 0.0022321 k( 321) = ( 0.3214286 0.3227273 0.1512247), wk = 0.0022321 k( 322) = ( 0.3125000 0.3227273 0.1512247), wk = 0.0022321 k( 323) = ( 0.3035714 0.3227273 0.1512247), wk = 0.0022321 k( 324) = ( 0.2946429 0.3227273 0.1512247), wk = 0.0022321 k( 325) = ( 0.2857143 0.3227273 0.1512247), wk = 0.0022321 k( 326) = ( 0.2767857 0.3227273 0.1512247), wk = 0.0022321 k( 327) = ( 0.2678571 0.3227273 0.1512247), wk = 0.0022321 k( 328) = ( 0.2589286 0.3227273 0.1512247), wk = 0.0022321 k( 329) = ( 0.2500000 0.3227273 0.1512247), wk = 0.0022321 k( 330) = ( 0.2410714 0.3227273 0.1512247), wk = 0.0022321 k( 331) = ( 0.2321429 0.3227273 0.1512247), wk = 0.0022321 k( 332) = ( 0.2232143 0.3227273 0.1512247), wk = 0.0022321 k( 333) = ( 0.2142857 0.3227273 0.1512247), wk = 0.0022321 k( 334) = ( 0.2053571 0.3227273 0.1512247), wk = 0.0022321 k( 335) = ( 0.1964286 0.3227273 0.1512247), wk = 0.0022321 k( 336) = ( 0.1875000 0.3227273 0.1512247), wk = 0.0022321 k( 337) = ( 0.1785714 0.3227273 0.1512247), wk = 0.0022321 k( 338) = ( 0.1696429 0.3227273 0.1512247), wk = 0.0022321 k( 339) = ( 0.1607143 0.3227273 0.1512247), wk = 0.0022321 k( 340) = ( 0.1517857 0.3227273 0.1512247), wk = 0.0022321 k( 341) = ( 0.1428571 0.3227273 0.1512247), wk = 0.0022321 k( 342) = ( 0.1339286 0.3227273 0.1512247), wk = 0.0022321 k( 343) = ( 0.1250000 0.3227273 0.1512247), wk = 0.0022321 k( 344) = ( 0.1160714 0.3227273 0.1512247), wk = 0.0022321 k( 345) = ( 0.1071429 0.3227273 0.1512247), wk = 0.0022321 k( 346) = ( 0.0982143 0.3227273 0.1512247), wk = 0.0022321 k( 347) = ( 0.0892857 0.3227273 0.1512247), wk = 0.0022321 k( 348) = ( 0.0803571 0.3227273 0.1512247), wk = 0.0022321 k( 349) = ( 0.0714286 0.3227273 0.1512247), wk = 0.0022321 k( 350) = ( 0.0625000 0.3227273 0.1512247), wk = 0.0022321 k( 351) = ( 0.0535714 0.3227273 0.1512247), wk = 0.0022321 k( 352) = ( 0.0446429 0.3227273 0.1512247), wk = 0.0022321 k( 353) = ( 0.0357143 0.3227273 0.1512247), wk = 0.0022321 k( 354) = ( 0.0267857 0.3227273 0.1512247), wk = 0.0022321 k( 355) = ( 0.0178571 0.3227273 0.1512247), wk = 0.0022321 k( 356) = ( 0.0089286 0.3227273 0.1512247), wk = 0.0022321 k( 357) = ( 0.0000000 0.3227273 0.1512247), wk = 0.0022321 k( 358) = ( 0.0000000 0.3227273 0.1512247), wk = 0.0022321 k( 359) = ( 0.0000000 0.3137626 0.1512247), wk = 0.0022321 k( 360) = ( 0.0000000 0.3047980 0.1512247), wk = 0.0022321 k( 361) = ( 0.0000000 0.2958333 0.1512247), wk = 0.0022321 k( 362) = ( 0.0000000 0.2868687 0.1512247), wk = 0.0022321 k( 363) = ( 0.0000000 0.2779040 0.1512247), wk = 0.0022321 k( 364) = ( 0.0000000 0.2689394 0.1512247), wk = 0.0022321 k( 365) = ( 0.0000000 0.2599747 0.1512247), wk = 0.0022321 k( 366) = ( 0.0000000 0.2510101 0.1512247), wk = 0.0022321 k( 367) = ( 0.0000000 0.2420455 0.1512247), wk = 0.0022321 k( 368) = ( 0.0000000 0.2330808 0.1512247), wk = 0.0022321 k( 369) = ( 0.0000000 0.2241162 0.1512247), wk = 0.0022321 k( 370) = ( 0.0000000 0.2151515 0.1512247), wk = 0.0022321 k( 371) = ( 0.0000000 0.2061869 0.1512247), wk = 0.0022321 k( 372) = ( 0.0000000 0.1972222 0.1512247), wk = 0.0022321 k( 373) = ( 0.0000000 0.1882576 0.1512247), wk = 0.0022321 k( 374) = ( 0.0000000 0.1792929 0.1512247), wk = 0.0022321 k( 375) = ( 0.0000000 0.1703283 0.1512247), wk = 0.0022321 k( 376) = ( 0.0000000 0.1613636 0.1512247), wk = 0.0022321 k( 377) = ( 0.0000000 0.1523990 0.1512247), wk = 0.0022321 k( 378) = ( 0.0000000 0.1434343 0.1512247), wk = 0.0022321 k( 379) = ( 0.0000000 0.1344697 0.1512247), wk = 0.0022321 k( 380) = ( 0.0000000 0.1255050 0.1512247), wk = 0.0022321 k( 381) = ( 0.0000000 0.1165404 0.1512247), wk = 0.0022321 k( 382) = ( 0.0000000 0.1075758 0.1512247), wk = 0.0022321 k( 383) = ( 0.0000000 0.0986111 0.1512247), wk = 0.0022321 k( 384) = ( 0.0000000 0.0896465 0.1512247), wk = 0.0022321 k( 385) = ( 0.0000000 0.0806818 0.1512247), wk = 0.0022321 k( 386) = ( 0.0000000 0.0717172 0.1512247), wk = 0.0022321 k( 387) = ( 0.0000000 0.0627525 0.1512247), wk = 0.0022321 k( 388) = ( 0.0000000 0.0537879 0.1512247), wk = 0.0022321 k( 389) = ( 0.0000000 0.0448232 0.1512247), wk = 0.0022321 k( 390) = ( 0.0000000 0.0358586 0.1512247), wk = 0.0022321 k( 391) = ( 0.0000000 0.0268939 0.1512247), wk = 0.0022321 k( 392) = ( 0.0000000 0.0179293 0.1512247), wk = 0.0022321 k( 393) = ( 0.0000000 0.0089646 0.1512247), wk = 0.0022321 k( 394) = ( 0.0000000 0.0000000 0.1512247), wk = 0.0022321 k( 395) = ( 0.0000000 0.3227273 -0.0000000), wk = 0.0022321 k( 396) = ( 0.0000000 0.3227273 0.0088956), wk = 0.0022321 k( 397) = ( 0.0000000 0.3227273 0.0177911), wk = 0.0022321 k( 398) = ( 0.0000000 0.3227273 0.0266867), wk = 0.0022321 k( 399) = ( 0.0000000 0.3227273 0.0355823), wk = 0.0022321 k( 400) = ( 0.0000000 0.3227273 0.0444779), wk = 0.0022321 k( 401) = ( 0.0000000 0.3227273 0.0533734), wk = 0.0022321 k( 402) = ( 0.0000000 0.3227273 0.0622690), wk = 0.0022321 k( 403) = ( 0.0000000 0.3227273 0.0711646), wk = 0.0022321 k( 404) = ( 0.0000000 0.3227273 0.0800601), wk = 0.0022321 k( 405) = ( 0.0000000 0.3227273 0.0889557), wk = 0.0022321 k( 406) = ( 0.0000000 0.3227273 0.0978513), wk = 0.0022321 k( 407) = ( 0.0000000 0.3227273 0.1067469), wk = 0.0022321 k( 408) = ( 0.0000000 0.3227273 0.1156424), wk = 0.0022321 k( 409) = ( 0.0000000 0.3227273 0.1245380), wk = 0.0022321 k( 410) = ( 0.0000000 0.3227273 0.1334336), wk = 0.0022321 k( 411) = ( 0.0000000 0.3227273 0.1423291), wk = 0.0022321 k( 412) = ( 0.0000000 0.3227273 0.1512247), wk = 0.0022321 k( 413) = ( 0.5000000 -0.0000000 0.1512247), wk = 0.0022321 k( 414) = ( 0.5000000 -0.0000000 0.1423291), wk = 0.0022321 k( 415) = ( 0.5000000 -0.0000000 0.1334336), wk = 0.0022321 k( 416) = ( 0.5000000 -0.0000000 0.1245380), wk = 0.0022321 k( 417) = ( 0.5000000 -0.0000000 0.1156424), wk = 0.0022321 k( 418) = ( 0.5000000 -0.0000000 0.1067469), wk = 0.0022321 k( 419) = ( 0.5000000 -0.0000000 0.0978513), wk = 0.0022321 k( 420) = ( 0.5000000 -0.0000000 0.0889557), wk = 0.0022321 k( 421) = ( 0.5000000 -0.0000000 0.0800601), wk = 0.0022321 k( 422) = ( 0.5000000 -0.0000000 0.0711646), wk = 0.0022321 k( 423) = ( 0.5000000 -0.0000000 0.0622690), wk = 0.0022321 k( 424) = ( 0.5000000 -0.0000000 0.0533734), wk = 0.0022321 k( 425) = ( 0.5000000 -0.0000000 0.0444779), wk = 0.0022321 k( 426) = ( 0.5000000 -0.0000000 0.0355823), wk = 0.0022321 k( 427) = ( 0.5000000 -0.0000000 0.0266867), wk = 0.0022321 k( 428) = ( 0.5000000 -0.0000000 0.0177911), wk = 0.0022321 k( 429) = ( 0.5000000 -0.0000000 0.0088956), wk = 0.0022321 k( 430) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0022321 k( 431) = ( 0.5000000 0.3227273 -0.0000000), wk = 0.0022321 k( 432) = ( 0.5000000 0.3227273 0.0088956), wk = 0.0022321 k( 433) = ( 0.5000000 0.3227273 0.0177911), wk = 0.0022321 k( 434) = ( 0.5000000 0.3227273 0.0266867), wk = 0.0022321 k( 435) = ( 0.5000000 0.3227273 0.0355823), wk = 0.0022321 k( 436) = ( 0.5000000 0.3227273 0.0444779), wk = 0.0022321 k( 437) = ( 0.5000000 0.3227273 0.0533734), wk = 0.0022321 k( 438) = ( 0.5000000 0.3227273 0.0622690), wk = 0.0022321 k( 439) = ( 0.5000000 0.3227273 0.0711646), wk = 0.0022321 k( 440) = ( 0.5000000 0.3227273 0.0800601), wk = 0.0022321 k( 441) = ( 0.5000000 0.3227273 0.0889557), wk = 0.0022321 k( 442) = ( 0.5000000 0.3227273 0.0978513), wk = 0.0022321 k( 443) = ( 0.5000000 0.3227273 0.1067469), wk = 0.0022321 k( 444) = ( 0.5000000 0.3227273 0.1156424), wk = 0.0022321 k( 445) = ( 0.5000000 0.3227273 0.1245380), wk = 0.0022321 k( 446) = ( 0.5000000 0.3227273 0.1334336), wk = 0.0022321 k( 447) = ( 0.5000000 0.3227273 0.1423291), wk = 0.0022321 k( 448) = ( 0.5000000 0.3227273 0.1512247), wk = 0.0022321 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 2) = ( 0.0089286 0.0000000 0.0000000), wk = 0.0022321 k( 3) = ( 0.0178571 0.0000000 0.0000000), wk = 0.0022321 k( 4) = ( 0.0267857 0.0000000 0.0000000), wk = 0.0022321 k( 5) = ( 0.0357143 0.0000000 0.0000000), wk = 0.0022321 k( 6) = ( 0.0446429 0.0000000 0.0000000), wk = 0.0022321 k( 7) = ( 0.0535714 0.0000000 0.0000000), wk = 0.0022321 k( 8) = ( 0.0625000 0.0000000 0.0000000), wk = 0.0022321 k( 9) = ( 0.0714286 0.0000000 0.0000000), wk = 0.0022321 k( 10) = ( 0.0803571 -0.0000000 -0.0000000), wk = 0.0022321 k( 11) = ( 0.0892857 0.0000000 -0.0000000), wk = 0.0022321 k( 12) = ( 0.0982143 -0.0000000 0.0000000), wk = 0.0022321 k( 13) = ( 0.1071429 0.0000000 0.0000000), wk = 0.0022321 k( 14) = ( 0.1160714 0.0000000 0.0000000), wk = 0.0022321 k( 15) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0022321 k( 16) = ( 0.1339286 -0.0000000 -0.0000000), wk = 0.0022321 k( 17) = ( 0.1428571 0.0000000 0.0000000), wk = 0.0022321 k( 18) = ( 0.1517857 0.0000000 0.0000000), wk = 0.0022321 k( 19) = ( 0.1607143 0.0000000 0.0000000), wk = 0.0022321 k( 20) = ( 0.1696429 0.0000000 0.0000000), wk = 0.0022321 k( 21) = ( 0.1785714 0.0000000 0.0000000), wk = 0.0022321 k( 22) = ( 0.1875000 0.0000000 0.0000000), wk = 0.0022321 k( 23) = ( 0.1964286 -0.0000000 0.0000000), wk = 0.0022321 k( 24) = ( 0.2053571 -0.0000000 0.0000000), wk = 0.0022321 k( 25) = ( 0.2142857 -0.0000000 0.0000000), wk = 0.0022321 k( 26) = ( 0.2232143 0.0000000 -0.0000000), wk = 0.0022321 k( 27) = ( 0.2321429 0.0000000 0.0000000), wk = 0.0022321 k( 28) = ( 0.2410714 0.0000000 0.0000000), wk = 0.0022321 k( 29) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0022321 k( 30) = ( 0.2589286 0.0000000 0.0000000), wk = 0.0022321 k( 31) = ( 0.2678571 -0.0000000 -0.0000000), wk = 0.0022321 k( 32) = ( 0.2767857 0.0000000 0.0000000), wk = 0.0022321 k( 33) = ( 0.2857143 0.0000000 0.0000000), wk = 0.0022321 k( 34) = ( 0.2946429 0.0000000 0.0000000), wk = 0.0022321 k( 35) = ( 0.3035714 -0.0000000 0.0000000), wk = 0.0022321 k( 36) = ( 0.3125000 0.0000000 0.0000000), wk = 0.0022321 k( 37) = ( 0.3214286 0.0000000 0.0000000), wk = 0.0022321 k( 38) = ( 0.3303571 -0.0000000 0.0000000), wk = 0.0022321 k( 39) = ( 0.3392857 0.0000000 0.0000000), wk = 0.0022321 k( 40) = ( 0.3482143 0.0000000 0.0000000), wk = 0.0022321 k( 41) = ( 0.3571429 0.0000000 0.0000000), wk = 0.0022321 k( 42) = ( 0.3660714 0.0000000 0.0000000), wk = 0.0022321 k( 43) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0022321 k( 44) = ( 0.3839286 -0.0000000 0.0000000), wk = 0.0022321 k( 45) = ( 0.3928571 -0.0000000 0.0000000), wk = 0.0022321 k( 46) = ( 0.4017857 0.0000000 0.0000000), wk = 0.0022321 k( 47) = ( 0.4107143 -0.0000000 -0.0000000), wk = 0.0022321 k( 48) = ( 0.4196429 0.0000000 0.0000000), wk = 0.0022321 k( 49) = ( 0.4285714 0.0000000 0.0000000), wk = 0.0022321 k( 50) = ( 0.4375000 0.0000000 0.0000000), wk = 0.0022321 k( 51) = ( 0.4464286 0.0000000 0.0000000), wk = 0.0022321 k( 52) = ( 0.4553571 0.0000000 0.0000000), wk = 0.0022321 k( 53) = ( 0.4642857 0.0000000 0.0000000), wk = 0.0022321 k( 54) = ( 0.4732143 0.0000000 0.0000000), wk = 0.0022321 k( 55) = ( 0.4821429 0.0000000 0.0000000), wk = 0.0022321 k( 56) = ( 0.4910714 0.0000000 -0.0000000), wk = 0.0022321 k( 57) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0022321 k( 58) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0022321 k( 59) = ( 0.5000000 0.0138889 0.0000000), wk = 0.0022321 k( 60) = ( 0.5000000 0.0277778 -0.0000000), wk = 0.0022321 k( 61) = ( 0.5000000 0.0416667 0.0000000), wk = 0.0022321 k( 62) = ( 0.5000000 0.0555556 0.0000000), wk = 0.0022321 k( 63) = ( 0.5000000 0.0694444 0.0000000), wk = 0.0022321 k( 64) = ( 0.5000000 0.0833333 0.0000000), wk = 0.0022321 k( 65) = ( 0.5000000 0.0972222 0.0000000), wk = 0.0022321 k( 66) = ( 0.5000000 0.1111111 0.0000000), wk = 0.0022321 k( 67) = ( 0.5000000 0.1250000 0.0000000), wk = 0.0022321 k( 68) = ( 0.5000000 0.1388889 -0.0000000), wk = 0.0022321 k( 69) = ( 0.5000000 0.1527778 0.0000000), wk = 0.0022321 k( 70) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0022321 k( 71) = ( 0.5000000 0.1805556 0.0000000), wk = 0.0022321 k( 72) = ( 0.5000000 0.1944444 0.0000000), wk = 0.0022321 k( 73) = ( 0.5000000 0.2083333 -0.0000000), wk = 0.0022321 k( 74) = ( 0.5000000 0.2222222 0.0000000), wk = 0.0022321 k( 75) = ( 0.5000000 0.2361111 0.0000000), wk = 0.0022321 k( 76) = ( 0.5000000 0.2500000 0.0000000), wk = 0.0022321 k( 77) = ( 0.5000000 0.2638889 0.0000000), wk = 0.0022321 k( 78) = ( 0.5000000 0.2777778 -0.0000000), wk = 0.0022321 k( 79) = ( 0.5000000 0.2916667 0.0000000), wk = 0.0022321 k( 80) = ( 0.5000000 0.3055556 0.0000000), wk = 0.0022321 k( 81) = ( 0.5000000 0.3194444 0.0000000), wk = 0.0022321 k( 82) = ( 0.5000000 0.3333333 0.0000000), wk = 0.0022321 k( 83) = ( 0.5000000 0.3472222 0.0000000), wk = 0.0022321 k( 84) = ( 0.5000000 0.3611111 -0.0000000), wk = 0.0022321 k( 85) = ( 0.5000000 0.3750000 0.0000000), wk = 0.0022321 k( 86) = ( 0.5000000 0.3888889 0.0000000), wk = 0.0022321 k( 87) = ( 0.5000000 0.4027778 0.0000000), wk = 0.0022321 k( 88) = ( 0.5000000 0.4166667 -0.0000000), wk = 0.0022321 k( 89) = ( 0.5000000 0.4305556 0.0000000), wk = 0.0022321 k( 90) = ( 0.5000000 0.4444444 0.0000000), wk = 0.0022321 k( 91) = ( 0.5000000 0.4583333 -0.0000000), wk = 0.0022321 k( 92) = ( 0.5000000 0.4722222 0.0000000), wk = 0.0022321 k( 93) = ( 0.5000000 0.4861111 -0.0000000), wk = 0.0022321 k( 94) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022321 k( 95) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022321 k( 96) = ( 0.4910714 0.5000000 0.0000000), wk = 0.0022321 k( 97) = ( 0.4821429 0.5000000 0.0000000), wk = 0.0022321 k( 98) = ( 0.4732143 0.5000000 0.0000000), wk = 0.0022321 k( 99) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0022321 k( 100) = ( 0.4553571 0.5000000 0.0000000), wk = 0.0022321 k( 101) = ( 0.4464286 0.5000000 0.0000000), wk = 0.0022321 k( 102) = ( 0.4375000 0.5000000 0.0000000), wk = 0.0022321 k( 103) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0022321 k( 104) = ( 0.4196429 0.5000000 0.0000000), wk = 0.0022321 k( 105) = ( 0.4107143 0.5000000 0.0000000), wk = 0.0022321 k( 106) = ( 0.4017857 0.5000000 -0.0000000), wk = 0.0022321 k( 107) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0022321 k( 108) = ( 0.3839286 0.5000000 0.0000000), wk = 0.0022321 k( 109) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0022321 k( 110) = ( 0.3660714 0.5000000 0.0000000), wk = 0.0022321 k( 111) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0022321 k( 112) = ( 0.3482143 0.5000000 0.0000000), wk = 0.0022321 k( 113) = ( 0.3392857 0.5000000 0.0000000), wk = 0.0022321 k( 114) = ( 0.3303571 0.5000000 0.0000000), wk = 0.0022321 k( 115) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0022321 k( 116) = ( 0.3125000 0.5000000 0.0000000), wk = 0.0022321 k( 117) = ( 0.3035714 0.5000000 0.0000000), wk = 0.0022321 k( 118) = ( 0.2946429 0.5000000 0.0000000), wk = 0.0022321 k( 119) = ( 0.2857143 0.5000000 0.0000000), wk = 0.0022321 k( 120) = ( 0.2767857 0.5000000 0.0000000), wk = 0.0022321 k( 121) = ( 0.2678571 0.5000000 0.0000000), wk = 0.0022321 k( 122) = ( 0.2589286 0.5000000 0.0000000), wk = 0.0022321 k( 123) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0022321 k( 124) = ( 0.2410714 0.5000000 0.0000000), wk = 0.0022321 k( 125) = ( 0.2321429 0.5000000 0.0000000), wk = 0.0022321 k( 126) = ( 0.2232143 0.5000000 0.0000000), wk = 0.0022321 k( 127) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0022321 k( 128) = ( 0.2053571 0.5000000 0.0000000), wk = 0.0022321 k( 129) = ( 0.1964286 0.5000000 0.0000000), wk = 0.0022321 k( 130) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0022321 k( 131) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0022321 k( 132) = ( 0.1696429 0.5000000 0.0000000), wk = 0.0022321 k( 133) = ( 0.1607143 0.5000000 0.0000000), wk = 0.0022321 k( 134) = ( 0.1517857 0.5000000 0.0000000), wk = 0.0022321 k( 135) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0022321 k( 136) = ( 0.1339286 0.5000000 0.0000000), wk = 0.0022321 k( 137) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0022321 k( 138) = ( 0.1160714 0.5000000 0.0000000), wk = 0.0022321 k( 139) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0022321 k( 140) = ( 0.0982143 0.5000000 0.0000000), wk = 0.0022321 k( 141) = ( 0.0892857 0.5000000 0.0000000), wk = 0.0022321 k( 142) = ( 0.0803571 0.5000000 0.0000000), wk = 0.0022321 k( 143) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0022321 k( 144) = ( 0.0625000 0.5000000 0.0000000), wk = 0.0022321 k( 145) = ( 0.0535714 0.5000000 0.0000000), wk = 0.0022321 k( 146) = ( 0.0446429 0.5000000 0.0000000), wk = 0.0022321 k( 147) = ( 0.0357143 0.5000000 0.0000000), wk = 0.0022321 k( 148) = ( 0.0267857 0.5000000 0.0000000), wk = 0.0022321 k( 149) = ( 0.0178571 0.5000000 0.0000000), wk = 0.0022321 k( 150) = ( 0.0089286 0.5000000 0.0000000), wk = 0.0022321 k( 151) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022321 k( 152) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022321 k( 153) = ( 0.0000000 0.4861111 0.0000000), wk = 0.0022321 k( 154) = ( 0.0000000 0.4722222 0.0000000), wk = 0.0022321 k( 155) = ( 0.0000000 0.4583333 -0.0000000), wk = 0.0022321 k( 156) = ( 0.0000000 0.4444444 0.0000000), wk = 0.0022321 k( 157) = ( 0.0000000 0.4305556 -0.0000000), wk = 0.0022321 k( 158) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0022321 k( 159) = ( 0.0000000 0.4027778 -0.0000000), wk = 0.0022321 k( 160) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0022321 k( 161) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0022321 k( 162) = ( 0.0000000 0.3611111 0.0000000), wk = 0.0022321 k( 163) = ( 0.0000000 0.3472222 -0.0000000), wk = 0.0022321 k( 164) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0022321 k( 165) = ( 0.0000000 0.3194444 0.0000000), wk = 0.0022321 k( 166) = ( 0.0000000 0.3055556 0.0000000), wk = 0.0022321 k( 167) = ( 0.0000000 0.2916667 0.0000000), wk = 0.0022321 k( 168) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0022321 k( 169) = ( 0.0000000 0.2638889 -0.0000000), wk = 0.0022321 k( 170) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0022321 k( 171) = ( 0.0000000 0.2361111 0.0000000), wk = 0.0022321 k( 172) = ( 0.0000000 0.2222222 0.0000000), wk = 0.0022321 k( 173) = ( 0.0000000 0.2083333 -0.0000000), wk = 0.0022321 k( 174) = ( 0.0000000 0.1944444 -0.0000000), wk = 0.0022321 k( 175) = ( 0.0000000 0.1805556 0.0000000), wk = 0.0022321 k( 176) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0022321 k( 177) = ( 0.0000000 0.1527778 0.0000000), wk = 0.0022321 k( 178) = ( 0.0000000 0.1388889 0.0000000), wk = 0.0022321 k( 179) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0022321 k( 180) = ( 0.0000000 0.1111111 0.0000000), wk = 0.0022321 k( 181) = ( 0.0000000 0.0972222 -0.0000000), wk = 0.0022321 k( 182) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0022321 k( 183) = ( 0.0000000 0.0694444 0.0000000), wk = 0.0022321 k( 184) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0022321 k( 185) = ( 0.0000000 0.0416667 0.0000000), wk = 0.0022321 k( 186) = ( 0.0000000 0.0277778 -0.0000000), wk = 0.0022321 k( 187) = ( 0.0000000 0.0138889 -0.0000000), wk = 0.0022321 k( 188) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 189) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 190) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0022321 k( 191) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0022321 k( 192) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0022321 k( 193) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0022321 k( 194) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0022321 k( 195) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0022321 k( 196) = ( 0.0000000 0.0000000 0.2058823), wk = 0.0022321 k( 197) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0022321 k( 198) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0022321 k( 199) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0022321 k( 200) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0022321 k( 201) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0022321 k( 202) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0022321 k( 203) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0022321 k( 204) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0022321 k( 205) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0022321 k( 206) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022321 k( 207) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022321 k( 208) = ( 0.0089286 0.0000000 0.5000000), wk = 0.0022321 k( 209) = ( 0.0178571 0.0000000 0.5000000), wk = 0.0022321 k( 210) = ( 0.0267857 0.0000000 0.5000000), wk = 0.0022321 k( 211) = ( 0.0357143 0.0000000 0.5000000), wk = 0.0022321 k( 212) = ( 0.0446429 0.0000000 0.5000000), wk = 0.0022321 k( 213) = ( 0.0535714 0.0000000 0.5000000), wk = 0.0022321 k( 214) = ( 0.0625000 0.0000000 0.5000000), wk = 0.0022321 k( 215) = ( 0.0714286 0.0000000 0.5000000), wk = 0.0022321 k( 216) = ( 0.0803571 -0.0000000 0.5000000), wk = 0.0022321 k( 217) = ( 0.0892857 0.0000000 0.5000000), wk = 0.0022321 k( 218) = ( 0.0982143 -0.0000000 0.5000000), wk = 0.0022321 k( 219) = ( 0.1071429 0.0000000 0.5000000), wk = 0.0022321 k( 220) = ( 0.1160714 0.0000000 0.5000000), wk = 0.0022321 k( 221) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0022321 k( 222) = ( 0.1339286 -0.0000000 0.5000000), wk = 0.0022321 k( 223) = ( 0.1428571 0.0000000 0.5000000), wk = 0.0022321 k( 224) = ( 0.1517857 0.0000000 0.5000000), wk = 0.0022321 k( 225) = ( 0.1607143 0.0000000 0.5000000), wk = 0.0022321 k( 226) = ( 0.1696429 0.0000000 0.5000000), wk = 0.0022321 k( 227) = ( 0.1785714 0.0000000 0.5000000), wk = 0.0022321 k( 228) = ( 0.1875000 0.0000000 0.5000000), wk = 0.0022321 k( 229) = ( 0.1964286 -0.0000000 0.5000000), wk = 0.0022321 k( 230) = ( 0.2053571 -0.0000000 0.5000000), wk = 0.0022321 k( 231) = ( 0.2142857 -0.0000000 0.5000000), wk = 0.0022321 k( 232) = ( 0.2232143 0.0000000 0.5000000), wk = 0.0022321 k( 233) = ( 0.2321429 0.0000000 0.5000000), wk = 0.0022321 k( 234) = ( 0.2410714 0.0000000 0.5000000), wk = 0.0022321 k( 235) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0022321 k( 236) = ( 0.2589286 0.0000000 0.5000000), wk = 0.0022321 k( 237) = ( 0.2678571 -0.0000000 0.5000000), wk = 0.0022321 k( 238) = ( 0.2767857 0.0000000 0.5000000), wk = 0.0022321 k( 239) = ( 0.2857143 0.0000000 0.5000000), wk = 0.0022321 k( 240) = ( 0.2946429 0.0000000 0.5000000), wk = 0.0022321 k( 241) = ( 0.3035714 -0.0000000 0.5000000), wk = 0.0022321 k( 242) = ( 0.3125000 0.0000000 0.5000000), wk = 0.0022321 k( 243) = ( 0.3214286 0.0000000 0.5000000), wk = 0.0022321 k( 244) = ( 0.3303571 -0.0000000 0.5000000), wk = 0.0022321 k( 245) = ( 0.3392857 0.0000000 0.5000000), wk = 0.0022321 k( 246) = ( 0.3482143 0.0000000 0.5000000), wk = 0.0022321 k( 247) = ( 0.3571429 0.0000000 0.5000000), wk = 0.0022321 k( 248) = ( 0.3660714 0.0000000 0.5000000), wk = 0.0022321 k( 249) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0022321 k( 250) = ( 0.3839286 -0.0000000 0.5000000), wk = 0.0022321 k( 251) = ( 0.3928571 -0.0000000 0.5000000), wk = 0.0022321 k( 252) = ( 0.4017857 0.0000000 0.5000000), wk = 0.0022321 k( 253) = ( 0.4107143 -0.0000000 0.5000000), wk = 0.0022321 k( 254) = ( 0.4196429 0.0000000 0.5000000), wk = 0.0022321 k( 255) = ( 0.4285714 0.0000000 0.5000000), wk = 0.0022321 k( 256) = ( 0.4375000 0.0000000 0.5000000), wk = 0.0022321 k( 257) = ( 0.4464286 0.0000000 0.5000000), wk = 0.0022321 k( 258) = ( 0.4553571 0.0000000 0.5000000), wk = 0.0022321 k( 259) = ( 0.4642857 0.0000000 0.5000000), wk = 0.0022321 k( 260) = ( 0.4732143 0.0000000 0.5000000), wk = 0.0022321 k( 261) = ( 0.4821429 0.0000000 0.5000000), wk = 0.0022321 k( 262) = ( 0.4910714 0.0000000 0.5000000), wk = 0.0022321 k( 263) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022321 k( 264) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022321 k( 265) = ( 0.5000000 0.0138889 0.5000000), wk = 0.0022321 k( 266) = ( 0.5000000 0.0277778 0.5000000), wk = 0.0022321 k( 267) = ( 0.5000000 0.0416667 0.5000000), wk = 0.0022321 k( 268) = ( 0.5000000 0.0555556 0.5000000), wk = 0.0022321 k( 269) = ( 0.5000000 0.0694444 0.5000000), wk = 0.0022321 k( 270) = ( 0.5000000 0.0833333 0.5000000), wk = 0.0022321 k( 271) = ( 0.5000000 0.0972222 0.5000000), wk = 0.0022321 k( 272) = ( 0.5000000 0.1111111 0.5000000), wk = 0.0022321 k( 273) = ( 0.5000000 0.1250000 0.5000000), wk = 0.0022321 k( 274) = ( 0.5000000 0.1388889 0.5000000), wk = 0.0022321 k( 275) = ( 0.5000000 0.1527778 0.5000000), wk = 0.0022321 k( 276) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0022321 k( 277) = ( 0.5000000 0.1805556 0.5000000), wk = 0.0022321 k( 278) = ( 0.5000000 0.1944444 0.5000000), wk = 0.0022321 k( 279) = ( 0.5000000 0.2083333 0.5000000), wk = 0.0022321 k( 280) = ( 0.5000000 0.2222222 0.5000000), wk = 0.0022321 k( 281) = ( 0.5000000 0.2361111 0.5000000), wk = 0.0022321 k( 282) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0022321 k( 283) = ( 0.5000000 0.2638889 0.5000000), wk = 0.0022321 k( 284) = ( 0.5000000 0.2777778 0.5000000), wk = 0.0022321 k( 285) = ( 0.5000000 0.2916667 0.5000000), wk = 0.0022321 k( 286) = ( 0.5000000 0.3055556 0.5000000), wk = 0.0022321 k( 287) = ( 0.5000000 0.3194444 0.5000000), wk = 0.0022321 k( 288) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0022321 k( 289) = ( 0.5000000 0.3472222 0.5000000), wk = 0.0022321 k( 290) = ( 0.5000000 0.3611111 0.5000000), wk = 0.0022321 k( 291) = ( 0.5000000 0.3750000 0.5000000), wk = 0.0022321 k( 292) = ( 0.5000000 0.3888889 0.5000000), wk = 0.0022321 k( 293) = ( 0.5000000 0.4027778 0.5000000), wk = 0.0022321 k( 294) = ( 0.5000000 0.4166667 0.5000000), wk = 0.0022321 k( 295) = ( 0.5000000 0.4305556 0.5000000), wk = 0.0022321 k( 296) = ( 0.5000000 0.4444444 0.5000000), wk = 0.0022321 k( 297) = ( 0.5000000 0.4583333 0.5000000), wk = 0.0022321 k( 298) = ( 0.5000000 0.4722222 0.5000000), wk = 0.0022321 k( 299) = ( 0.5000000 0.4861111 0.5000000), wk = 0.0022321 k( 300) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022321 k( 301) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022321 k( 302) = ( 0.4910714 0.5000000 0.5000000), wk = 0.0022321 k( 303) = ( 0.4821429 0.5000000 0.5000000), wk = 0.0022321 k( 304) = ( 0.4732143 0.5000000 0.5000000), wk = 0.0022321 k( 305) = ( 0.4642857 0.5000000 0.5000000), wk = 0.0022321 k( 306) = ( 0.4553571 0.5000000 0.5000000), wk = 0.0022321 k( 307) = ( 0.4464286 0.5000000 0.5000000), wk = 0.0022321 k( 308) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0022321 k( 309) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0022321 k( 310) = ( 0.4196429 0.5000000 0.5000000), wk = 0.0022321 k( 311) = ( 0.4107143 0.5000000 0.5000000), wk = 0.0022321 k( 312) = ( 0.4017857 0.5000000 0.5000000), wk = 0.0022321 k( 313) = ( 0.3928571 0.5000000 0.5000000), wk = 0.0022321 k( 314) = ( 0.3839286 0.5000000 0.5000000), wk = 0.0022321 k( 315) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0022321 k( 316) = ( 0.3660714 0.5000000 0.5000000), wk = 0.0022321 k( 317) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0022321 k( 318) = ( 0.3482143 0.5000000 0.5000000), wk = 0.0022321 k( 319) = ( 0.3392857 0.5000000 0.5000000), wk = 0.0022321 k( 320) = ( 0.3303571 0.5000000 0.5000000), wk = 0.0022321 k( 321) = ( 0.3214286 0.5000000 0.5000000), wk = 0.0022321 k( 322) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0022321 k( 323) = ( 0.3035714 0.5000000 0.5000000), wk = 0.0022321 k( 324) = ( 0.2946429 0.5000000 0.5000000), wk = 0.0022321 k( 325) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0022321 k( 326) = ( 0.2767857 0.5000000 0.5000000), wk = 0.0022321 k( 327) = ( 0.2678571 0.5000000 0.5000000), wk = 0.0022321 k( 328) = ( 0.2589286 0.5000000 0.5000000), wk = 0.0022321 k( 329) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0022321 k( 330) = ( 0.2410714 0.5000000 0.5000000), wk = 0.0022321 k( 331) = ( 0.2321429 0.5000000 0.5000000), wk = 0.0022321 k( 332) = ( 0.2232143 0.5000000 0.5000000), wk = 0.0022321 k( 333) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0022321 k( 334) = ( 0.2053571 0.5000000 0.5000000), wk = 0.0022321 k( 335) = ( 0.1964286 0.5000000 0.5000000), wk = 0.0022321 k( 336) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0022321 k( 337) = ( 0.1785714 0.5000000 0.5000000), wk = 0.0022321 k( 338) = ( 0.1696429 0.5000000 0.5000000), wk = 0.0022321 k( 339) = ( 0.1607143 0.5000000 0.5000000), wk = 0.0022321 k( 340) = ( 0.1517857 0.5000000 0.5000000), wk = 0.0022321 k( 341) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0022321 k( 342) = ( 0.1339286 0.5000000 0.5000000), wk = 0.0022321 k( 343) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0022321 k( 344) = ( 0.1160714 0.5000000 0.5000000), wk = 0.0022321 k( 345) = ( 0.1071429 0.5000000 0.5000000), wk = 0.0022321 k( 346) = ( 0.0982143 0.5000000 0.5000000), wk = 0.0022321 k( 347) = ( 0.0892857 0.5000000 0.5000000), wk = 0.0022321 k( 348) = ( 0.0803571 0.5000000 0.5000000), wk = 0.0022321 k( 349) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0022321 k( 350) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0022321 k( 351) = ( 0.0535714 0.5000000 0.5000000), wk = 0.0022321 k( 352) = ( 0.0446429 0.5000000 0.5000000), wk = 0.0022321 k( 353) = ( 0.0357143 0.5000000 0.5000000), wk = 0.0022321 k( 354) = ( 0.0267857 0.5000000 0.5000000), wk = 0.0022321 k( 355) = ( 0.0178571 0.5000000 0.5000000), wk = 0.0022321 k( 356) = ( 0.0089286 0.5000000 0.5000000), wk = 0.0022321 k( 357) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022321 k( 358) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022321 k( 359) = ( 0.0000000 0.4861111 0.5000000), wk = 0.0022321 k( 360) = ( 0.0000000 0.4722222 0.5000000), wk = 0.0022321 k( 361) = ( 0.0000000 0.4583333 0.5000000), wk = 0.0022321 k( 362) = ( 0.0000000 0.4444444 0.5000000), wk = 0.0022321 k( 363) = ( 0.0000000 0.4305556 0.5000000), wk = 0.0022321 k( 364) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0022321 k( 365) = ( 0.0000000 0.4027778 0.5000000), wk = 0.0022321 k( 366) = ( 0.0000000 0.3888889 0.5000000), wk = 0.0022321 k( 367) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0022321 k( 368) = ( 0.0000000 0.3611111 0.5000000), wk = 0.0022321 k( 369) = ( 0.0000000 0.3472222 0.5000000), wk = 0.0022321 k( 370) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0022321 k( 371) = ( 0.0000000 0.3194444 0.5000000), wk = 0.0022321 k( 372) = ( 0.0000000 0.3055556 0.5000000), wk = 0.0022321 k( 373) = ( 0.0000000 0.2916667 0.5000000), wk = 0.0022321 k( 374) = ( 0.0000000 0.2777778 0.5000000), wk = 0.0022321 k( 375) = ( 0.0000000 0.2638889 0.5000000), wk = 0.0022321 k( 376) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0022321 k( 377) = ( 0.0000000 0.2361111 0.5000000), wk = 0.0022321 k( 378) = ( 0.0000000 0.2222222 0.5000000), wk = 0.0022321 k( 379) = ( 0.0000000 0.2083333 0.5000000), wk = 0.0022321 k( 380) = ( 0.0000000 0.1944444 0.5000000), wk = 0.0022321 k( 381) = ( 0.0000000 0.1805556 0.5000000), wk = 0.0022321 k( 382) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0022321 k( 383) = ( 0.0000000 0.1527778 0.5000000), wk = 0.0022321 k( 384) = ( 0.0000000 0.1388889 0.5000000), wk = 0.0022321 k( 385) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0022321 k( 386) = ( 0.0000000 0.1111111 0.5000000), wk = 0.0022321 k( 387) = ( 0.0000000 0.0972222 0.5000000), wk = 0.0022321 k( 388) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0022321 k( 389) = ( 0.0000000 0.0694444 0.5000000), wk = 0.0022321 k( 390) = ( 0.0000000 0.0555556 0.5000000), wk = 0.0022321 k( 391) = ( 0.0000000 0.0416667 0.5000000), wk = 0.0022321 k( 392) = ( 0.0000000 0.0277778 0.5000000), wk = 0.0022321 k( 393) = ( 0.0000000 0.0138889 0.5000000), wk = 0.0022321 k( 394) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022321 k( 395) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022321 k( 396) = ( 0.0000000 0.5000000 0.0294118), wk = 0.0022321 k( 397) = ( 0.0000000 0.5000000 0.0588235), wk = 0.0022321 k( 398) = ( 0.0000000 0.5000000 0.0882353), wk = 0.0022321 k( 399) = ( 0.0000000 0.5000000 0.1176471), wk = 0.0022321 k( 400) = ( 0.0000000 0.5000000 0.1470588), wk = 0.0022321 k( 401) = ( 0.0000000 0.5000000 0.1764706), wk = 0.0022321 k( 402) = ( 0.0000000 0.5000000 0.2058823), wk = 0.0022321 k( 403) = ( 0.0000000 0.5000000 0.2352941), wk = 0.0022321 k( 404) = ( 0.0000000 0.5000000 0.2647059), wk = 0.0022321 k( 405) = ( 0.0000000 0.5000000 0.2941177), wk = 0.0022321 k( 406) = ( 0.0000000 0.5000000 0.3235294), wk = 0.0022321 k( 407) = ( 0.0000000 0.5000000 0.3529412), wk = 0.0022321 k( 408) = ( 0.0000000 0.5000000 0.3823529), wk = 0.0022321 k( 409) = ( 0.0000000 0.5000000 0.4117647), wk = 0.0022321 k( 410) = ( 0.0000000 0.5000000 0.4411765), wk = 0.0022321 k( 411) = ( 0.0000000 0.5000000 0.4705882), wk = 0.0022321 k( 412) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022321 k( 413) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022321 k( 414) = ( 0.5000000 0.0000000 0.4705882), wk = 0.0022321 k( 415) = ( 0.5000000 0.0000000 0.4411765), wk = 0.0022321 k( 416) = ( 0.5000000 0.0000000 0.4117647), wk = 0.0022321 k( 417) = ( 0.5000000 0.0000000 0.3823529), wk = 0.0022321 k( 418) = ( 0.5000000 0.0000000 0.3529412), wk = 0.0022321 k( 419) = ( 0.5000000 0.0000000 0.3235294), wk = 0.0022321 k( 420) = ( 0.5000000 0.0000000 0.2941177), wk = 0.0022321 k( 421) = ( 0.5000000 0.0000000 0.2647059), wk = 0.0022321 k( 422) = ( 0.5000000 0.0000000 0.2352941), wk = 0.0022321 k( 423) = ( 0.5000000 0.0000000 0.2058823), wk = 0.0022321 k( 424) = ( 0.5000000 0.0000000 0.1764706), wk = 0.0022321 k( 425) = ( 0.5000000 0.0000000 0.1470588), wk = 0.0022321 k( 426) = ( 0.5000000 0.0000000 0.1176471), wk = 0.0022321 k( 427) = ( 0.5000000 0.0000000 0.0882353), wk = 0.0022321 k( 428) = ( 0.5000000 0.0000000 0.0588235), wk = 0.0022321 k( 429) = ( 0.5000000 0.0000000 0.0294118), wk = 0.0022321 k( 430) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0022321 k( 431) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022321 k( 432) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0022321 k( 433) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0022321 k( 434) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0022321 k( 435) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0022321 k( 436) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0022321 k( 437) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0022321 k( 438) = ( 0.5000000 0.5000000 0.2058823), wk = 0.0022321 k( 439) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0022321 k( 440) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0022321 k( 441) = ( 0.5000000 0.5000000 0.2941177), wk = 0.0022321 k( 442) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0022321 k( 443) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0022321 k( 444) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0022321 k( 445) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0022321 k( 446) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0022321 k( 447) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0022321 k( 448) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022321 Dense grid: 77989 G-vectors FFT dimensions: ( 32, 48, 108) Smooth grid: 34519 G-vectors FFT dimensions: ( 24, 40, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.29 Mb ( 264, 72) NL pseudopotentials 0.50 Mb ( 132, 248) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.02 Mb ( 2170) G-vector shells 0.01 Mb ( 1101) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.16 Mb ( 264, 288) Each subspace H/S matrix 0.08 Mb ( 72, 72) Each matrix 0.54 Mb ( 248, 2, 72) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./AlO2.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.3 secs Computing kpt #: 2 total cpu time spent up to now is 3.2 secs Computing kpt #: 3 total cpu time spent up to now is 4.0 secs Computing kpt #: 4 total cpu time spent up to now is 4.8 secs Computing kpt #: 5 total cpu time spent up to now is 5.6 secs Computing kpt #: 6 total cpu time spent up to now is 6.4 secs Computing kpt #: 7 total cpu time spent up to now is 7.2 secs Computing kpt #: 8 total cpu time spent up to now is 8.0 secs Computing kpt #: 9 total cpu time spent up to now is 8.8 secs Computing kpt #: 10 total cpu time spent up to now is 9.5 secs Computing kpt #: 11 total cpu time spent up to now is 10.3 secs Computing kpt #: 12 total cpu time spent up to now is 11.1 secs Computing kpt #: 13 total cpu time spent up to now is 11.9 secs Computing kpt #: 14 total cpu time spent up to now is 12.7 secs Computing kpt #: 15 total cpu time spent up to now is 13.4 secs Computing kpt #: 16 total cpu time spent up to now is 14.2 secs Computing kpt #: 17 total cpu time spent up to now is 14.9 secs Computing kpt #: 18 total cpu time spent up to now is 15.7 secs Computing kpt #: 19 total cpu time spent up to now is 16.4 secs Computing kpt #: 20 total cpu time spent up to now is 17.2 secs Computing kpt #: 21 total cpu time spent up to now is 18.1 secs Computing kpt #: 22 total cpu time spent up to now is 18.9 secs Computing kpt #: 23 total cpu time spent up to now is 19.7 secs Computing kpt #: 24 total cpu time spent up to now is 20.6 secs Computing kpt #: 25 total cpu time spent up to now is 21.4 secs Computing kpt #: 26 total cpu time spent up to now is 22.3 secs Computing kpt #: 27 total cpu time spent up to now is 23.2 secs Computing kpt #: 28 total cpu time spent up to now is 24.1 secs Computing kpt #: 29 total cpu time spent up to now is 25.0 secs Computing kpt #: 30 total cpu time spent up to now is 26.2 secs Computing kpt #: 31 total cpu time spent up to now is 27.3 secs Computing kpt #: 32 total cpu time spent up to now is 28.3 secs Computing kpt #: 33 total cpu time spent up to now is 29.3 secs Computing kpt #: 34 total cpu time spent up to now is 30.4 secs Computing kpt #: 35 total cpu time spent up to now is 31.4 secs Computing kpt #: 36 total cpu time spent up to now is 32.4 secs Computing kpt #: 37 total cpu time spent up to now is 33.4 secs Computing kpt #: 38 total cpu time spent up to now is 34.4 secs Computing kpt #: 39 total cpu time spent up to now is 35.4 secs Computing kpt #: 40 total cpu time spent up to now is 36.4 secs Computing kpt #: 41 total cpu time spent up to now is 37.4 secs Computing kpt #: 42 total cpu time spent up to now is 38.3 secs Computing kpt #: 43 total cpu time spent up to now is 39.3 secs Computing kpt #: 44 total cpu time spent up to now is 40.2 secs Computing kpt #: 45 total cpu time spent up to now is 41.1 secs Computing kpt #: 46 total cpu time spent up to now is 42.0 secs Computing kpt #: 47 total cpu time spent up to now is 42.9 secs Computing kpt #: 48 total cpu time spent up to now is 43.8 secs Computing kpt #: 49 total cpu time spent up to now is 44.8 secs Computing kpt #: 50 total cpu time spent up to now is 45.7 secs Computing kpt #: 51 total cpu time spent up to now is 46.7 secs Computing kpt #: 52 total cpu time spent up to now is 47.6 secs Computing kpt #: 53 total cpu time spent up to now is 48.6 secs Computing kpt #: 54 total cpu time spent up to now is 49.7 secs Computing kpt #: 55 total cpu time spent up to now is 50.9 secs Computing kpt #: 56 total cpu time spent up to now is 52.2 secs Computing kpt #: 57 total cpu time spent up to now is 53.4 secs Computing kpt #: 58 total cpu time spent up to now is 54.6 secs Computing kpt #: 59 total cpu time spent up to now is 55.7 secs Computing kpt #: 60 total cpu time spent up to now is 56.8 secs Computing kpt #: 61 total cpu time spent up to now is 57.9 secs Computing kpt #: 62 total cpu time spent up to now is 59.0 secs Computing kpt #: 63 total cpu time spent up to now is 60.0 secs Computing kpt #: 64 total cpu time spent up to now is 60.9 secs Computing kpt #: 65 total cpu time spent up to now is 61.9 secs Computing kpt #: 66 total cpu time spent up to now is 62.7 secs Computing kpt #: 67 total cpu time spent up to now is 63.6 secs Computing kpt #: 68 total cpu time spent up to now is 64.4 secs Computing kpt #: 69 total cpu time spent up to now is 65.3 secs Computing kpt #: 70 total cpu time spent up to now is 66.2 secs Computing kpt #: 71 total cpu time spent up to now is 67.0 secs Computing kpt #: 72 total cpu time spent up to now is 67.9 secs Computing kpt #: 73 total cpu time spent up to now is 68.7 secs Computing kpt #: 74 total cpu time spent up to now is 69.5 secs Computing kpt #: 75 total cpu time spent up to now is 70.4 secs Computing kpt #: 76 total cpu time spent up to now is 71.3 secs Computing kpt #: 77 total cpu time spent up to now is 72.0 secs Computing kpt #: 78 total cpu time spent up to now is 72.9 secs Computing kpt #: 79 total cpu time spent up to now is 73.7 secs Computing kpt #: 80 total cpu time spent up to now is 74.6 secs Computing kpt #: 81 total cpu time spent up to now is 75.4 secs Computing kpt #: 82 total cpu time spent up to now is 76.1 secs Computing kpt #: 83 total cpu time spent up to now is 76.9 secs Computing kpt #: 84 total cpu time spent up to now is 77.7 secs Computing kpt #: 85 total cpu time spent up to now is 78.4 secs Computing kpt #: 86 total cpu time spent up to now is 79.2 secs Computing kpt #: 87 total cpu time spent up to now is 80.0 secs Computing kpt #: 88 total cpu time spent up to now is 80.7 secs Computing kpt #: 89 total cpu time spent up to now is 81.5 secs Computing kpt #: 90 total cpu time spent up to now is 82.2 secs Computing kpt #: 91 total cpu time spent up to now is 83.0 secs Computing kpt #: 92 total cpu time spent up to now is 83.7 secs Computing kpt #: 93 total cpu time spent up to now is 84.5 secs Computing kpt #: 94 total cpu time spent up to now is 85.2 secs Computing kpt #: 95 total cpu time spent up to now is 86.0 secs Computing kpt #: 96 total cpu time spent up to now is 86.7 secs Computing kpt #: 97 total cpu time spent up to now is 87.5 secs Computing kpt #: 98 total cpu time spent up to now is 88.2 secs Computing kpt #: 99 total cpu time spent up to now is 89.0 secs Computing kpt #: 100 total cpu time spent up to now is 89.7 secs Computing kpt #: 101 total cpu time spent up to now is 90.5 secs Computing kpt #: 102 total cpu time spent up to now is 91.2 secs Computing kpt #: 103 total cpu time spent up to now is 92.0 secs Computing kpt #: 104 total cpu time spent up to now is 92.8 secs Computing kpt #: 105 total cpu time spent up to now is 93.5 secs Computing kpt #: 106 total cpu time spent up to now is 94.3 secs Computing kpt #: 107 total cpu time spent up to now is 95.1 secs Computing kpt #: 108 total cpu time spent up to now is 95.9 secs Computing kpt #: 109 total cpu time spent up to now is 96.6 secs Computing kpt #: 110 total cpu time spent up to now is 97.5 secs Computing kpt #: 111 total cpu time spent up to now is 98.2 secs Computing kpt #: 112 total cpu time spent up to now is 99.1 secs Computing kpt #: 113 total cpu time spent up to now is 99.9 secs Computing kpt #: 114 total cpu time spent up to now is 100.7 secs Computing kpt #: 115 total cpu time spent up to now is 101.5 secs Computing kpt #: 116 total cpu time spent up to now is 102.3 secs Computing kpt #: 117 total cpu time spent up to now is 103.2 secs Computing kpt #: 118 total cpu time spent up to now is 104.0 secs Computing kpt #: 119 total cpu time spent up to now is 104.9 secs Computing kpt #: 120 total cpu time spent up to now is 105.7 secs Computing kpt #: 121 total cpu time spent up to now is 106.6 secs Computing kpt #: 122 total cpu time spent up to now is 107.4 secs Computing kpt #: 123 total cpu time spent up to now is 108.3 secs Computing kpt #: 124 total cpu time spent up to now is 109.0 secs Computing kpt #: 125 total cpu time spent up to now is 109.8 secs Computing kpt #: 126 total cpu time spent up to now is 110.6 secs Computing kpt #: 127 total cpu time spent up to now is 111.5 secs Computing kpt #: 128 total cpu time spent up to now is 112.2 secs Computing kpt #: 129 total cpu time spent up to now is 112.9 secs Computing kpt #: 130 total cpu time spent up to now is 113.8 secs Computing kpt #: 131 total cpu time spent up to now is 114.6 secs Computing kpt #: 132 total cpu time spent up to now is 115.4 secs Computing kpt #: 133 total cpu time spent up to now is 116.3 secs Computing kpt #: 134 total cpu time spent up to now is 117.1 secs Computing kpt #: 135 total cpu time spent up to now is 117.9 secs Computing kpt #: 136 total cpu time spent up to now is 118.8 secs Computing kpt #: 137 total cpu time spent up to now is 119.6 secs Computing kpt #: 138 total cpu time spent up to now is 120.4 secs Computing kpt #: 139 total cpu time spent up to now is 121.2 secs Computing kpt #: 140 total cpu time spent up to now is 122.1 secs Computing kpt #: 141 total cpu time spent up to now is 122.9 secs Computing kpt #: 142 total cpu time spent up to now is 123.7 secs Computing kpt #: 143 total cpu time spent up to now is 124.5 secs Computing kpt #: 144 total cpu time spent up to now is 125.4 secs Computing kpt #: 145 total cpu time spent up to now is 126.2 secs Computing kpt #: 146 total cpu time spent up to now is 127.0 secs Computing kpt #: 147 total cpu time spent up to now is 127.8 secs Computing kpt #: 148 total cpu time spent up to now is 128.7 secs Computing kpt #: 149 total cpu time spent up to now is 129.5 secs Computing kpt #: 150 total cpu time spent up to now is 130.3 secs Computing kpt #: 151 total cpu time spent up to now is 131.1 secs Computing kpt #: 152 total cpu time spent up to now is 132.0 secs Computing kpt #: 153 total cpu time spent up to now is 132.8 secs Computing kpt #: 154 total cpu time spent up to now is 133.6 secs Computing kpt #: 155 total cpu time spent up to now is 134.4 secs Computing kpt #: 156 total cpu time spent up to now is 135.3 secs Computing kpt #: 157 total cpu time spent up to now is 136.1 secs Computing kpt #: 158 total cpu time spent up to now is 136.9 secs Computing kpt #: 159 total cpu time spent up to now is 137.8 secs Computing kpt #: 160 total cpu time spent up to now is 138.6 secs Computing kpt #: 161 total cpu time spent up to now is 139.5 secs Computing kpt #: 162 total cpu time spent up to now is 140.4 secs Computing kpt #: 163 total cpu time spent up to now is 141.2 secs Computing kpt #: 164 total cpu time spent up to now is 142.0 secs Computing kpt #: 165 total cpu time spent up to now is 142.9 secs Computing kpt #: 166 total cpu time spent up to now is 143.7 secs Computing kpt #: 167 total cpu time spent up to now is 144.5 secs Computing kpt #: 168 total cpu time spent up to now is 145.3 secs Computing kpt #: 169 total cpu time spent up to now is 146.2 secs Computing kpt #: 170 total cpu time spent up to now is 147.0 secs Computing kpt #: 171 total cpu time spent up to now is 147.8 secs Computing kpt #: 172 total cpu time spent up to now is 148.6 secs Computing kpt #: 173 total cpu time spent up to now is 149.4 secs Computing kpt #: 174 total cpu time spent up to now is 150.2 secs Computing kpt #: 175 total cpu time spent up to now is 151.0 secs Computing kpt #: 176 total cpu time spent up to now is 151.8 secs Computing kpt #: 177 total cpu time spent up to now is 152.7 secs Computing kpt #: 178 total cpu time spent up to now is 153.5 secs Computing kpt #: 179 total cpu time spent up to now is 154.2 secs Computing kpt #: 180 total cpu time spent up to now is 154.9 secs Computing kpt #: 181 total cpu time spent up to now is 155.6 secs Computing kpt #: 182 total cpu time spent up to now is 156.4 secs Computing kpt #: 183 total cpu time spent up to now is 157.2 secs Computing kpt #: 184 total cpu time spent up to now is 158.0 secs Computing kpt #: 185 total cpu time spent up to now is 158.8 secs Computing kpt #: 186 total cpu time spent up to now is 159.6 secs Computing kpt #: 187 total cpu time spent up to now is 160.3 secs Computing kpt #: 188 total cpu time spent up to now is 161.1 secs Computing kpt #: 189 total cpu time spent up to now is 161.9 secs Computing kpt #: 190 total cpu time spent up to now is 162.7 secs Computing kpt #: 191 total cpu time spent up to now is 163.5 secs Computing kpt #: 192 total cpu time spent up to now is 164.3 secs Computing kpt #: 193 total cpu time spent up to now is 165.1 secs Computing kpt #: 194 total cpu time spent up to now is 165.9 secs Computing kpt #: 195 total cpu time spent up to now is 166.7 secs Computing kpt #: 196 total cpu time spent up to now is 167.5 secs Computing kpt #: 197 total cpu time spent up to now is 168.3 secs Computing kpt #: 198 total cpu time spent up to now is 169.1 secs Computing kpt #: 199 total cpu time spent up to now is 169.9 secs Computing kpt #: 200 total cpu time spent up to now is 170.7 secs Computing kpt #: 201 total cpu time spent up to now is 171.6 secs Computing kpt #: 202 total cpu time spent up to now is 172.4 secs Computing kpt #: 203 total cpu time spent up to now is 173.2 secs Computing kpt #: 204 total cpu time spent up to now is 174.1 secs Computing kpt #: 205 total cpu time spent up to now is 174.9 secs Computing kpt #: 206 total cpu time spent up to now is 175.7 secs Computing kpt #: 207 total cpu time spent up to now is 176.5 secs Computing kpt #: 208 total cpu time spent up to now is 177.4 secs Computing kpt #: 209 total cpu time spent up to now is 178.2 secs Computing kpt #: 210 total cpu time spent up to now is 179.0 secs Computing kpt #: 211 total cpu time spent up to now is 179.9 secs Computing kpt #: 212 total cpu time spent up to now is 180.7 secs Computing kpt #: 213 total cpu time spent up to now is 181.5 secs Computing kpt #: 214 total cpu time spent up to now is 182.3 secs Computing kpt #: 215 total cpu time spent up to now is 183.2 secs Computing kpt #: 216 total cpu time spent up to now is 184.0 secs Computing kpt #: 217 total cpu time spent up to now is 185.0 secs Computing kpt #: 218 total cpu time spent up to now is 186.0 secs Computing kpt #: 219 total cpu time spent up to now is 186.9 secs Computing kpt #: 220 total cpu time spent up to now is 187.7 secs Computing kpt #: 221 total cpu time spent up to now is 188.5 secs Computing kpt #: 222 total cpu time spent up to now is 189.4 secs Computing kpt #: 223 total cpu time spent up to now is 190.2 secs Computing kpt #: 224 total cpu time spent up to now is 191.0 secs Computing kpt #: 225 total cpu time spent up to now is 191.9 secs Computing kpt #: 226 total cpu time spent up to now is 192.8 secs Computing kpt #: 227 total cpu time spent up to now is 193.7 secs Computing kpt #: 228 total cpu time spent up to now is 194.6 secs Computing kpt #: 229 total cpu time spent up to now is 195.6 secs Computing kpt #: 230 total cpu time spent up to now is 196.6 secs Computing kpt #: 231 total cpu time spent up to now is 197.7 secs Computing kpt #: 232 total cpu time spent up to now is 198.9 secs Computing kpt #: 233 total cpu time spent up to now is 200.3 secs Computing kpt #: 234 total cpu time spent up to now is 201.7 secs Computing kpt #: 235 total cpu time spent up to now is 202.9 secs Computing kpt #: 236 total cpu time spent up to now is 204.2 secs Computing kpt #: 237 total cpu time spent up to now is 205.4 secs Computing kpt #: 238 total cpu time spent up to now is 206.6 secs Computing kpt #: 239 total cpu time spent up to now is 207.7 secs Computing kpt #: 240 total cpu time spent up to now is 208.8 secs Computing kpt #: 241 total cpu time spent up to now is 209.9 secs Computing kpt #: 242 total cpu time spent up to now is 210.9 secs Computing kpt #: 243 total cpu time spent up to now is 212.0 secs Computing kpt #: 244 total cpu time spent up to now is 212.9 secs Computing kpt #: 245 total cpu time spent up to now is 213.9 secs Computing kpt #: 246 total cpu time spent up to now is 214.8 secs Computing kpt #: 247 total cpu time spent up to now is 215.7 secs Computing kpt #: 248 total cpu time spent up to now is 216.7 secs Computing kpt #: 249 total cpu time spent up to now is 217.6 secs Computing kpt #: 250 total cpu time spent up to now is 218.6 secs Computing kpt #: 251 total cpu time spent up to now is 219.5 secs Computing kpt #: 252 total cpu time spent up to now is 220.4 secs Computing kpt #: 253 total cpu time spent up to now is 221.4 secs Computing kpt #: 254 total cpu time spent up to now is 222.3 secs Computing kpt #: 255 total cpu time spent up to now is 223.2 secs Computing kpt #: 256 total cpu time spent up to now is 224.1 secs Computing kpt #: 257 total cpu time spent up to now is 225.0 secs Computing kpt #: 258 total cpu time spent up to now is 225.9 secs Computing kpt #: 259 total cpu time spent up to now is 226.8 secs Computing kpt #: 260 total cpu time spent up to now is 227.7 secs Computing kpt #: 261 total cpu time spent up to now is 228.5 secs Computing kpt #: 262 total cpu time spent up to now is 229.4 secs Computing kpt #: 263 total cpu time spent up to now is 230.3 secs Computing kpt #: 264 total cpu time spent up to now is 231.1 secs Computing kpt #: 265 total cpu time spent up to now is 232.0 secs Computing kpt #: 266 total cpu time spent up to now is 232.9 secs Computing kpt #: 267 total cpu time spent up to now is 233.7 secs Computing kpt #: 268 total cpu time spent up to now is 234.6 secs Computing kpt #: 269 total cpu time spent up to now is 235.5 secs Computing kpt #: 270 total cpu time spent up to now is 236.3 secs Computing kpt #: 271 total cpu time spent up to now is 237.2 secs Computing kpt #: 272 total cpu time spent up to now is 238.0 secs Computing kpt #: 273 total cpu time spent up to now is 238.9 secs Computing kpt #: 274 total cpu time spent up to now is 239.7 secs Computing kpt #: 275 total cpu time spent up to now is 240.6 secs Computing kpt #: 276 total cpu time spent up to now is 241.5 secs Computing kpt #: 277 total cpu time spent up to now is 242.3 secs Computing kpt #: 278 total cpu time spent up to now is 243.2 secs Computing kpt #: 279 total cpu time spent up to now is 244.0 secs Computing kpt #: 280 total cpu time spent up to now is 244.9 secs Computing kpt #: 281 total cpu time spent up to now is 245.7 secs Computing kpt #: 282 total cpu time spent up to now is 246.5 secs Computing kpt #: 283 total cpu time spent up to now is 247.3 secs Computing kpt #: 284 total cpu time spent up to now is 248.1 secs Computing kpt #: 285 total cpu time spent up to now is 248.9 secs Computing kpt #: 286 total cpu time spent up to now is 249.8 secs Computing kpt #: 287 total cpu time spent up to now is 250.5 secs Computing kpt #: 288 total cpu time spent up to now is 251.3 secs Computing kpt #: 289 total cpu time spent up to now is 252.1 secs Computing kpt #: 290 total cpu time spent up to now is 252.9 secs Computing kpt #: 291 total cpu time spent up to now is 253.6 secs Computing kpt #: 292 total cpu time spent up to now is 254.4 secs Computing kpt #: 293 total cpu time spent up to now is 255.2 secs Computing kpt #: 294 total cpu time spent up to now is 255.9 secs Computing kpt #: 295 total cpu time spent up to now is 256.7 secs Computing kpt #: 296 total cpu time spent up to now is 257.5 secs Computing kpt #: 297 total cpu time spent up to now is 258.2 secs Computing kpt #: 298 total cpu time spent up to now is 259.0 secs Computing kpt #: 299 total cpu time spent up to now is 259.7 secs Computing kpt #: 300 total cpu time spent up to now is 260.5 secs Computing kpt #: 301 total cpu time spent up to now is 261.3 secs Computing kpt #: 302 total cpu time spent up to now is 262.0 secs Computing kpt #: 303 total cpu time spent up to now is 262.8 secs Computing kpt #: 304 total cpu time spent up to now is 263.6 secs Computing kpt #: 305 total cpu time spent up to now is 264.4 secs Computing kpt #: 306 total cpu time spent up to now is 265.2 secs Computing kpt #: 307 total cpu time spent up to now is 266.0 secs Computing kpt #: 308 total cpu time spent up to now is 266.9 secs Computing kpt #: 309 total cpu time spent up to now is 267.7 secs Computing kpt #: 310 total cpu time spent up to now is 268.5 secs Computing kpt #: 311 total cpu time spent up to now is 269.4 secs Computing kpt #: 312 total cpu time spent up to now is 270.2 secs Computing kpt #: 313 total cpu time spent up to now is 271.1 secs Computing kpt #: 314 total cpu time spent up to now is 271.9 secs Computing kpt #: 315 total cpu time spent up to now is 272.8 secs Computing kpt #: 316 total cpu time spent up to now is 273.6 secs Computing kpt #: 317 total cpu time spent up to now is 274.5 secs Computing kpt #: 318 total cpu time spent up to now is 275.3 secs Computing kpt #: 319 total cpu time spent up to now is 276.2 secs Computing kpt #: 320 total cpu time spent up to now is 277.0 secs Computing kpt #: 321 total cpu time spent up to now is 277.9 secs Computing kpt #: 322 total cpu time spent up to now is 278.7 secs Computing kpt #: 323 total cpu time spent up to now is 279.5 secs Computing kpt #: 324 total cpu time spent up to now is 280.4 secs Computing kpt #: 325 total cpu time spent up to now is 281.3 secs Computing kpt #: 326 total cpu time spent up to now is 282.1 secs Computing kpt #: 327 total cpu time spent up to now is 282.9 secs Computing kpt #: 328 total cpu time spent up to now is 283.6 secs Computing kpt #: 329 total cpu time spent up to now is 284.4 secs Computing kpt #: 330 total cpu time spent up to now is 285.1 secs Computing kpt #: 331 total cpu time spent up to now is 285.9 secs Computing kpt #: 332 total cpu time spent up to now is 286.6 secs Computing kpt #: 333 total cpu time spent up to now is 287.4 secs Computing kpt #: 334 total cpu time spent up to now is 288.2 secs Computing kpt #: 335 total cpu time spent up to now is 288.9 secs Computing kpt #: 336 total cpu time spent up to now is 289.7 secs Computing kpt #: 337 total cpu time spent up to now is 290.4 secs Computing kpt #: 338 total cpu time spent up to now is 291.1 secs Computing kpt #: 339 total cpu time spent up to now is 291.9 secs Computing kpt #: 340 total cpu time spent up to now is 292.6 secs Computing kpt #: 341 total cpu time spent up to now is 293.4 secs Computing kpt #: 342 total cpu time spent up to now is 294.1 secs Computing kpt #: 343 total cpu time spent up to now is 294.9 secs Computing kpt #: 344 total cpu time spent up to now is 295.6 secs Computing kpt #: 345 total cpu time spent up to now is 296.4 secs Computing kpt #: 346 total cpu time spent up to now is 297.1 secs Computing kpt #: 347 total cpu time spent up to now is 297.8 secs Computing kpt #: 348 total cpu time spent up to now is 298.6 secs Computing kpt #: 349 total cpu time spent up to now is 299.3 secs Computing kpt #: 350 total cpu time spent up to now is 300.1 secs Computing kpt #: 351 total cpu time spent up to now is 300.8 secs Computing kpt #: 352 total cpu time spent up to now is 301.6 secs Computing kpt #: 353 total cpu time spent up to now is 302.4 secs Computing kpt #: 354 total cpu time spent up to now is 303.1 secs Computing kpt #: 355 total cpu time spent up to now is 303.9 secs Computing kpt #: 356 total cpu time spent up to now is 304.6 secs Computing kpt #: 357 total cpu time spent up to now is 305.4 secs Computing kpt #: 358 total cpu time spent up to now is 306.1 secs Computing kpt #: 359 total cpu time spent up to now is 306.9 secs Computing kpt #: 360 total cpu time spent up to now is 307.6 secs Computing kpt #: 361 total cpu time spent up to now is 308.4 secs Computing kpt #: 362 total cpu time spent up to now is 309.1 secs Computing kpt #: 363 total cpu time spent up to now is 309.9 secs Computing kpt #: 364 total cpu time spent up to now is 310.7 secs Computing kpt #: 365 total cpu time spent up to now is 311.5 secs Computing kpt #: 366 total cpu time spent up to now is 312.4 secs Computing kpt #: 367 total cpu time spent up to now is 313.2 secs Computing kpt #: 368 total cpu time spent up to now is 314.0 secs Computing kpt #: 369 total cpu time spent up to now is 314.8 secs Computing kpt #: 370 total cpu time spent up to now is 315.7 secs Computing kpt #: 371 total cpu time spent up to now is 316.5 secs Computing kpt #: 372 total cpu time spent up to now is 317.3 secs Computing kpt #: 373 total cpu time spent up to now is 318.1 secs Computing kpt #: 374 total cpu time spent up to now is 318.9 secs Computing kpt #: 375 total cpu time spent up to now is 319.8 secs Computing kpt #: 376 total cpu time spent up to now is 320.6 secs Computing kpt #: 377 total cpu time spent up to now is 321.4 secs Computing kpt #: 378 total cpu time spent up to now is 322.2 secs Computing kpt #: 379 total cpu time spent up to now is 323.0 secs Computing kpt #: 380 total cpu time spent up to now is 323.9 secs Computing kpt #: 381 total cpu time spent up to now is 324.7 secs Computing kpt #: 382 total cpu time spent up to now is 325.5 secs Computing kpt #: 383 total cpu time spent up to now is 326.3 secs Computing kpt #: 384 total cpu time spent up to now is 327.1 secs Computing kpt #: 385 total cpu time spent up to now is 328.0 secs Computing kpt #: 386 total cpu time spent up to now is 328.8 secs Computing kpt #: 387 total cpu time spent up to now is 329.6 secs Computing kpt #: 388 total cpu time spent up to now is 330.4 secs Computing kpt #: 389 total cpu time spent up to now is 331.2 secs Computing kpt #: 390 total cpu time spent up to now is 332.1 secs Computing kpt #: 391 total cpu time spent up to now is 332.9 secs Computing kpt #: 392 total cpu time spent up to now is 333.7 secs Computing kpt #: 393 total cpu time spent up to now is 334.5 secs Computing kpt #: 394 total cpu time spent up to now is 335.4 secs Computing kpt #: 395 total cpu time spent up to now is 336.2 secs Computing kpt #: 396 total cpu time spent up to now is 337.0 secs Computing kpt #: 397 total cpu time spent up to now is 337.9 secs Computing kpt #: 398 total cpu time spent up to now is 338.7 secs Computing kpt #: 399 total cpu time spent up to now is 339.5 secs Computing kpt #: 400 total cpu time spent up to now is 340.4 secs Computing kpt #: 401 total cpu time spent up to now is 341.2 secs Computing kpt #: 402 total cpu time spent up to now is 342.0 secs Computing kpt #: 403 total cpu time spent up to now is 342.8 secs Computing kpt #: 404 total cpu time spent up to now is 343.6 secs Computing kpt #: 405 total cpu time spent up to now is 344.4 secs Computing kpt #: 406 total cpu time spent up to now is 345.2 secs Computing kpt #: 407 total cpu time spent up to now is 345.9 secs Computing kpt #: 408 total cpu time spent up to now is 346.7 secs Computing kpt #: 409 total cpu time spent up to now is 347.4 secs Computing kpt #: 410 total cpu time spent up to now is 348.2 secs Computing kpt #: 411 total cpu time spent up to now is 348.9 secs Computing kpt #: 412 total cpu time spent up to now is 349.7 secs Computing kpt #: 413 total cpu time spent up to now is 350.7 secs Computing kpt #: 414 total cpu time spent up to now is 351.6 secs Computing kpt #: 415 total cpu time spent up to now is 352.4 secs Computing kpt #: 416 total cpu time spent up to now is 353.3 secs Computing kpt #: 417 total cpu time spent up to now is 354.2 secs Computing kpt #: 418 total cpu time spent up to now is 355.0 secs Computing kpt #: 419 total cpu time spent up to now is 355.9 secs Computing kpt #: 420 total cpu time spent up to now is 356.8 secs Computing kpt #: 421 total cpu time spent up to now is 357.6 secs Computing kpt #: 422 total cpu time spent up to now is 358.7 secs Computing kpt #: 423 total cpu time spent up to now is 359.9 secs Computing kpt #: 424 total cpu time spent up to now is 361.0 secs Computing kpt #: 425 total cpu time spent up to now is 362.3 secs Computing kpt #: 426 total cpu time spent up to now is 363.4 secs Computing kpt #: 427 total cpu time spent up to now is 364.6 secs Computing kpt #: 428 total cpu time spent up to now is 365.8 secs Computing kpt #: 429 total cpu time spent up to now is 367.0 secs Computing kpt #: 430 total cpu time spent up to now is 368.1 secs Computing kpt #: 431 total cpu time spent up to now is 368.9 secs Computing kpt #: 432 total cpu time spent up to now is 369.6 secs Computing kpt #: 433 total cpu time spent up to now is 370.4 secs Computing kpt #: 434 total cpu time spent up to now is 371.1 secs Computing kpt #: 435 total cpu time spent up to now is 371.9 secs Computing kpt #: 436 total cpu time spent up to now is 372.6 secs Computing kpt #: 437 total cpu time spent up to now is 373.4 secs Computing kpt #: 438 total cpu time spent up to now is 374.1 secs Computing kpt #: 439 total cpu time spent up to now is 374.9 secs Computing kpt #: 440 total cpu time spent up to now is 375.6 secs Computing kpt #: 441 total cpu time spent up to now is 376.4 secs Computing kpt #: 442 total cpu time spent up to now is 377.1 secs Computing kpt #: 443 total cpu time spent up to now is 377.9 secs Computing kpt #: 444 total cpu time spent up to now is 378.7 secs Computing kpt #: 445 total cpu time spent up to now is 379.4 secs Computing kpt #: 446 total cpu time spent up to now is 380.2 secs Computing kpt #: 447 total cpu time spent up to now is 380.9 secs Computing kpt #: 448 total cpu time spent up to now is 381.7 secs ethr = 1.67E-08, avg # of iterations = 23.5 total cpu time spent up to now is 381.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4295 PWs) bands (ev): -13.8001 -13.8001 -13.1407 -13.1407 -12.8764 -12.8764 -11.7677 -11.7677 -11.6546 -11.6546 -11.5551 -11.5551 -11.1211 -11.1211 -10.9257 -10.9257 -1.0255 -1.0255 -0.4999 -0.4999 0.5814 0.5814 1.2817 1.2817 1.4237 1.4237 1.6428 1.6428 1.8920 1.8920 2.5470 2.5470 2.5840 2.5840 2.9043 2.9043 2.9720 2.9720 3.4366 3.4366 3.4533 3.4533 3.5038 3.5038 3.7631 3.7631 3.9328 3.9328 4.0295 4.0295 4.0556 4.0556 4.7626 4.7626 4.8616 4.8616 4.8854 4.8854 5.2572 5.2572 5.2574 5.2574 5.3110 5.3110 11.9078 11.9078 14.0265 14.0265 14.5698 14.5698 14.7343 14.7343 k = 0.0089-0.0000-0.0000 ( 4303 PWs) bands (ev): -13.7994 -13.7994 -13.1401 -13.1401 -12.8758 -12.8758 -11.7675 -11.7675 -11.6543 -11.6543 -11.5549 -11.5549 -11.1210 -11.1210 -10.9256 -10.9256 -1.0248 -1.0248 -0.4992 -0.4992 0.5820 0.5820 1.2818 1.2818 1.4242 1.4242 1.6432 1.6432 1.8926 1.8926 2.5427 2.5427 2.5817 2.5817 2.8807 2.8807 2.9925 2.9925 3.4359 3.4359 3.4540 3.4540 3.5055 3.5055 3.7606 3.7606 3.9306 3.9306 4.0297 4.0297 4.0525 4.0525 4.7625 4.7625 4.8604 4.8604 4.8828 4.8828 5.2570 5.2570 5.2575 5.2575 5.3111 5.3111 11.9115 11.9115 14.0289 14.0289 14.5734 14.5734 14.7367 14.7367 k = 0.0179-0.0000-0.0000 ( 4301 PWs) bands (ev): -13.7972 -13.7972 -13.1383 -13.1383 -12.8741 -12.8741 -11.7668 -11.7668 -11.6532 -11.6532 -11.5543 -11.5543 -11.1208 -11.1208 -10.9254 -10.9254 -1.0226 -1.0226 -0.4973 -0.4973 0.5836 0.5836 1.2822 1.2822 1.4255 1.4255 1.6442 1.6442 1.8942 1.8942 2.5302 2.5302 2.5748 2.5748 2.8370 2.8370 3.0269 3.0269 3.4336 3.4336 3.4561 3.4561 3.5104 3.5104 3.7530 3.7530 3.9242 3.9242 4.0302 4.0302 4.0430 4.0430 4.7622 4.7622 4.8570 4.8570 4.8750 4.8750 5.2560 5.2560 5.2583 5.2583 5.3113 5.3113 11.9223 11.9223 14.0359 14.0359 14.5844 14.5844 14.7439 14.7439 k = 0.0268-0.0000-0.0000 ( 4293 PWs) bands (ev): -13.7936 -13.7936 -13.1354 -13.1354 -12.8711 -12.8711 -11.7658 -11.7658 -11.6515 -11.6515 -11.5532 -11.5532 -11.1203 -11.1203 -10.9249 -10.9249 -1.0189 -1.0189 -0.4940 -0.4940 0.5863 0.5863 1.2827 1.2827 1.4278 1.4278 1.6458 1.6458 1.8969 1.8969 2.5096 2.5096 2.5635 2.5635 2.7876 2.7876 3.0608 3.0608 3.4298 3.4298 3.4598 3.4598 3.5182 3.5182 3.7404 3.7404 3.9137 3.9137 4.0273 4.0273 4.0309 4.0309 4.7616 4.7616 4.8513 4.8513 4.8621 4.8621 5.2542 5.2542 5.2595 5.2595 5.3116 5.3116 11.9403 11.9403 14.0477 14.0477 14.6027 14.6027 14.7559 14.7559 k = 0.0357-0.0000-0.0000 ( 4293 PWs) bands (ev): -13.7885 -13.7885 -13.1313 -13.1313 -12.8670 -12.8670 -11.7643 -11.7643 -11.6490 -11.6490 -11.5518 -11.5518 -11.1197 -11.1197 -10.9243 -10.9243 -1.0137 -1.0137 -0.4895 -0.4895 0.5901 0.5901 1.2834 1.2834 1.4308 1.4308 1.6481 1.6481 1.9007 1.9007 2.4815 2.4815 2.5478 2.5478 2.7349 2.7349 3.0915 3.0915 3.4244 3.4244 3.4652 3.4652 3.5285 3.5285 3.7229 3.7229 3.8995 3.8995 4.0058 4.0058 4.0316 4.0316 4.7607 4.7607 4.8430 4.8430 4.8448 4.8448 5.2516 5.2516 5.2611 5.2611 5.3120 5.3120 11.9654 11.9654 14.0640 14.0640 14.6280 14.6280 14.7725 14.7725 k = 0.0446-0.0000-0.0000 ( 4297 PWs) bands (ev): -13.7819 -13.7819 -13.1260 -13.1260 -12.8618 -12.8618 -11.7624 -11.7624 -11.6459 -11.6459 -11.5500 -11.5500 -11.1190 -11.1190 -10.9236 -10.9236 -1.0071 -1.0071 -0.4836 -0.4836 0.5949 0.5949 1.2842 1.2842 1.4347 1.4347 1.6507 1.6507 1.9056 1.9056 2.4465 2.4465 2.5280 2.5280 2.6797 2.6797 3.1183 3.1183 3.4172 3.4172 3.4726 3.4726 3.5407 3.5407 3.7005 3.7005 3.8821 3.8821 3.9786 3.9786 4.0321 4.0321 4.7592 4.7592 4.8219 4.8219 4.8339 4.8339 5.2482 5.2482 5.2630 5.2630 5.3124 5.3124 11.9972 11.9972 14.0849 14.0849 14.6604 14.6604 14.7936 14.7936 k = 0.0536-0.0000-0.0000 ( 4295 PWs) bands (ev): -13.7739 -13.7739 -13.1196 -13.1196 -12.8554 -12.8554 -11.7602 -11.7602 -11.6421 -11.6421 -11.5477 -11.5477 -11.1180 -11.1180 -10.9227 -10.9227 -0.9991 -0.9991 -0.4766 -0.4766 0.6008 0.6008 1.2851 1.2851 1.4393 1.4393 1.6536 1.6536 1.9115 1.9115 2.4052 2.4052 2.5042 2.5042 2.6227 2.6227 3.1406 3.1406 3.4081 3.4081 3.4821 3.4821 3.5539 3.5539 3.6735 3.6735 3.8618 3.8618 3.9462 3.9462 4.0323 4.0323 4.7568 4.7568 4.7957 4.7957 4.8223 4.8223 5.2441 5.2441 5.2648 5.2648 5.3129 5.3129 12.0357 12.0357 14.1100 14.1100 14.6995 14.6995 14.8188 14.8188 k = 0.0625-0.0000-0.0000 ( 4287 PWs) bands (ev): -13.7645 -13.7645 -13.1120 -13.1120 -12.8478 -12.8478 -11.7575 -11.7575 -11.6377 -11.6377 -11.5451 -11.5451 -11.1170 -11.1170 -10.9216 -10.9216 -0.9896 -0.9896 -0.4682 -0.4682 0.6077 0.6077 1.2862 1.2862 1.4444 1.4444 1.6566 1.6566 1.9184 1.9184 2.3583 2.3583 2.4768 2.4768 2.5643 2.5643 3.1582 3.1582 3.3972 3.3972 3.4938 3.4938 3.5673 3.5673 3.6420 3.6420 3.8394 3.8394 3.9089 3.9089 4.0321 4.0321 4.7513 4.7513 4.7679 4.7679 4.8091 4.8091 5.2390 5.2390 5.2666 5.2666 5.3133 5.3133 12.0806 12.0806 14.1394 14.1394 14.7452 14.7452 14.8480 14.8480 k = 0.0714-0.0000-0.0000 ( 4283 PWs) bands (ev): -13.7536 -13.7536 -13.1033 -13.1033 -12.8392 -12.8392 -11.7545 -11.7545 -11.6325 -11.6325 -11.5421 -11.5421 -11.1158 -11.1158 -10.9204 -10.9204 -0.9787 -0.9787 -0.4587 -0.4587 0.6156 0.6156 1.2872 1.2872 1.4501 1.4501 1.6594 1.6594 1.9263 1.9263 2.3064 2.3064 2.4460 2.4460 2.5050 2.5050 3.1710 3.1710 3.3841 3.3841 3.5076 3.5076 3.5796 3.5796 3.6064 3.6064 3.8158 3.8158 3.8672 3.8672 4.0316 4.0316 4.7267 4.7267 4.7549 4.7549 4.7947 4.7947 5.2331 5.2331 5.2681 5.2681 5.3135 5.3135 12.1316 12.1316 14.1728 14.1728 14.7971 14.7971 14.8809 14.8809 k = 0.0804-0.0000-0.0000 ( 4287 PWs) bands (ev): -13.7413 -13.7413 -13.0934 -13.0934 -12.8294 -12.8294 -11.7512 -11.7512 -11.6268 -11.6268 -11.5388 -11.5388 -11.1145 -11.1145 -10.9191 -10.9191 -0.9664 -0.9664 -0.4479 -0.4479 0.6244 0.6244 1.2882 1.2882 1.4560 1.4560 1.6614 1.6614 1.9353 1.9353 2.2501 2.2501 2.4123 2.4123 2.4455 2.4455 3.1791 3.1791 3.3688 3.3688 3.5233 3.5233 3.5662 3.5662 3.5897 3.5897 3.7927 3.7927 3.8213 3.8213 4.0307 4.0307 4.6903 4.6903 4.7496 4.7496 4.7793 4.7793 5.2262 5.2262 5.2691 5.2691 5.3136 5.3136 12.1883 12.1883 14.2099 14.2099 14.8550 14.8550 14.9171 14.9171 k = 0.0893-0.0000-0.0000 ( 4283 PWs) bands (ev): -13.7276 -13.7276 -13.0825 -13.0825 -12.8185 -12.8185 -11.7475 -11.7475 -11.6204 -11.6204 -11.5351 -11.5351 -11.1130 -11.1130 -10.9177 -10.9177 -0.9528 -0.9528 -0.4360 -0.4360 0.6342 0.6342 1.2890 1.2890 1.4621 1.4621 1.6621 1.6621 1.9452 1.9452 2.1899 2.1899 2.3759 2.3759 2.3867 2.3867 3.1826 3.1826 3.3508 3.3508 3.5230 3.5230 3.5406 3.5406 3.5937 3.5937 3.7715 3.7715 3.7729 3.7729 4.0294 4.0294 4.6504 4.6504 4.7436 4.7436 4.7637 4.7637 5.2184 5.2184 5.2695 5.2695 5.3134 5.3134 12.2505 12.2505 14.2507 14.2507 14.9186 14.9186 14.9563 14.9563 k = 0.0982-0.0000-0.0000 ( 4279 PWs) bands (ev): -13.7125 -13.7125 -13.0705 -13.0705 -12.8066 -12.8066 -11.7436 -11.7436 -11.6133 -11.6133 -11.5311 -11.5311 -11.1115 -11.1115 -10.9162 -10.9162 -0.9378 -0.9378 -0.4230 -0.4230 0.6450 0.6450 1.2895 1.2895 1.4680 1.4680 1.6607 1.6607 1.9560 1.9560 2.1264 2.1264 2.3280 2.3280 2.3389 2.3389 3.1819 3.1819 3.3296 3.3296 3.4769 3.4769 3.5587 3.5587 3.5890 3.5890 3.7189 3.7189 3.7593 3.7593 4.0277 4.0277 4.6080 4.6080 4.7349 4.7349 4.7495 4.7495 5.2097 5.2097 5.2692 5.2692 5.3129 5.3129 12.3179 12.3179 14.2947 14.2947 14.9874 14.9874 14.9981 14.9981 k = 0.1071-0.0000-0.0000 ( 4279 PWs) bands (ev): -13.6961 -13.6961 -13.0574 -13.0574 -12.7936 -12.7936 -11.7394 -11.7394 -11.6057 -11.6057 -11.5267 -11.5267 -11.1099 -11.1099 -10.9147 -10.9147 -0.9214 -0.9214 -0.4089 -0.4089 0.6565 0.6565 1.2897 1.2897 1.4733 1.4733 1.6561 1.6561 1.9677 1.9677 2.0600 2.0600 2.2734 2.2734 2.2994 2.2994 3.1773 3.1773 3.3043 3.3043 3.4288 3.4288 3.5691 3.5691 3.5816 3.5816 3.6632 3.6632 3.7550 3.7550 4.0254 4.0254 4.5639 4.5639 4.7215 4.7215 4.7390 4.7390 5.2000 5.2000 5.2680 5.2680 5.3120 5.3120 12.3900 12.3900 14.3418 14.3418 15.0419 15.0419 15.0612 15.0612 k = 0.1161-0.0000-0.0000 ( 4273 PWs) bands (ev): -13.6783 -13.6783 -13.0432 -13.0432 -12.7795 -12.7795 -11.7350 -11.7350 -11.5975 -11.5975 -11.5221 -11.5221 -11.1082 -11.1082 -10.9131 -10.9131 -0.9038 -0.9038 -0.3937 -0.3937 0.6689 0.6689 1.2894 1.2894 1.4777 1.4777 1.6468 1.6468 1.9799 1.9799 1.9915 1.9915 2.2229 2.2229 2.2594 2.2594 3.1691 3.1691 3.2736 3.2736 3.3804 3.3804 3.5442 3.5442 3.5986 3.5986 3.6058 3.6058 3.7591 3.7591 4.0227 4.0227 4.5185 4.5185 4.7053 4.7053 4.7303 4.7303 5.1894 5.1894 5.2658 5.2658 5.3107 5.3107 12.4666 12.4666 14.3918 14.3918 15.0875 15.0875 15.1394 15.1394 k = 0.1250-0.0000-0.0000 ( 4277 PWs) bands (ev): -13.6591 -13.6591 -13.0281 -13.0281 -12.7645 -12.7645 -11.7303 -11.7303 -11.5887 -11.5887 -11.5171 -11.5171 -11.1064 -11.1064 -10.9115 -10.9115 -0.8850 -0.8850 -0.3776 -0.3776 0.6821 0.6821 1.2882 1.2882 1.4807 1.4807 1.6313 1.6313 1.9203 1.9203 1.9936 1.9936 2.1785 2.1785 2.2197 2.2197 3.1575 3.1575 3.2352 3.2352 3.3339 3.3339 3.5096 3.5096 3.5444 3.5444 3.6195 3.6195 3.7689 3.7689 4.0196 4.0196 4.4724 4.4724 4.6885 4.6885 4.7216 4.7216 5.1778 5.1778 5.2625 5.2625 5.3090 5.3090 12.5473 12.5473 14.4442 14.4442 15.1344 15.1344 15.2218 15.2218 k = 0.1339-0.0000-0.0000 ( 4279 PWs) bands (ev): -13.6387 -13.6387 -13.0119 -13.0119 -12.7485 -12.7485 -11.7256 -11.7256 -11.5794 -11.5794 -11.5119 -11.5119 -11.1047 -11.1047 -10.9099 -10.9099 -0.8649 -0.8649 -0.3605 -0.3605 0.6960 0.6960 1.2860 1.2860 1.4816 1.4816 1.6079 1.6079 1.8482 1.8482 2.0076 2.0076 2.1420 2.1420 2.1811 2.1811 3.1426 3.1426 3.1877 3.1877 3.2910 3.2910 3.4696 3.4696 3.4822 3.4822 3.6396 3.6396 3.7819 3.7819 4.0159 4.0159 4.4260 4.4260 4.6719 4.6719 4.7122 4.7122 5.1652 5.1652 5.2581 5.2581 5.3067 5.3067 12.6318 12.6318 14.4989 14.4989 15.1820 15.1820 15.3080 15.3080 k = 0.1429-0.0000-0.0000 ( 4279 PWs) bands (ev): -13.6169 -13.6169 -12.9948 -12.9948 -12.7315 -12.7315 -11.7207 -11.7207 -11.5695 -11.5695 -11.5065 -11.5065 -11.1028 -11.1028 -10.9084 -10.9084 -0.8437 -0.8437 -0.3426 -0.3426 0.7105 0.7105 1.2823 1.2823 1.4796 1.4796 1.5757 1.5757 1.7753 1.7753 2.0221 2.0221 2.1147 2.1147 2.1446 2.1446 3.1243 3.1243 3.1321 3.1321 3.2512 3.2512 3.4183 3.4183 3.4264 3.4264 3.6596 3.6596 3.7969 3.7969 4.0116 4.0116 4.3799 4.3799 4.6559 4.6559 4.7020 4.7020 5.1516 5.1516 5.2525 5.2525 5.3038 5.3038 12.7197 12.7197 14.5555 14.5555 15.2299 15.2299 15.3974 15.3974 k = 0.1518-0.0000-0.0000 ( 4280 PWs) bands (ev): -13.5939 -13.5939 -12.9767 -12.9767 -12.7137 -12.7137 -11.7158 -11.7158 -11.5591 -11.5591 -11.5008 -11.5008 -11.1010 -11.1010 -10.9069 -10.9069 -0.8213 -0.8213 -0.3239 -0.3239 0.7256 0.7256 1.2765 1.2765 1.4740 1.4740 1.5345 1.5345 1.7026 1.7026 2.0371 2.0371 2.0968 2.0968 2.1114 2.1114 3.0693 3.0693 3.1039 3.1039 3.2127 3.2127 3.3537 3.3537 3.3805 3.3805 3.6794 3.6794 3.8127 3.8127 4.0069 4.0069 4.3344 4.3344 4.6410 4.6410 4.6908 4.6908 5.1370 5.1370 5.2457 5.2457 5.3004 5.3004 12.8108 12.8108 14.6137 14.6137 15.2777 15.2777 15.4898 15.4898 k = 0.1607-0.0000-0.0000 ( 4280 PWs) bands (ev): -13.5696 -13.5696 -12.9577 -12.9577 -12.6949 -12.6949 -11.7109 -11.7109 -11.5483 -11.5483 -11.4950 -11.4950 -11.0992 -11.0992 -10.9055 -10.9055 -0.7979 -0.7979 -0.3046 -0.3046 0.7412 0.7412 1.2675 1.2675 1.4636 1.4636 1.4853 1.4853 1.6311 1.6311 2.0520 2.0520 2.0811 2.0811 2.0895 2.0895 3.0026 3.0026 3.0802 3.0802 3.1737 3.1737 3.2883 3.2883 3.3331 3.3331 3.6989 3.6989 3.8291 3.8291 4.0017 4.0017 4.2900 4.2900 4.6273 4.6273 4.6786 4.6786 5.1215 5.1215 5.2376 5.2376 5.2964 5.2964 12.9047 12.9047 14.6733 14.6733 15.3248 15.3248 15.5847 15.5847 k = 0.1696-0.0000-0.0000 ( 4288 PWs) bands (ev): -13.5441 -13.5441 -12.9378 -12.9378 -12.6753 -12.6753 -11.7060 -11.7060 -11.5370 -11.5370 -11.4889 -11.4889 -11.0974 -11.0974 -10.9042 -10.9042 -0.7734 -0.7734 -0.2846 -0.2846 0.7573 0.7573 1.2536 1.2536 1.4279 1.4279 1.4497 1.4497 1.5629 1.5629 2.0546 2.0546 2.0696 2.0696 2.0883 2.0883 2.9328 2.9328 3.0539 3.0539 3.1335 3.1335 3.2227 3.2227 3.2845 3.2845 3.7181 3.7181 3.8455 3.8455 3.9959 3.9959 4.2470 4.2470 4.6149 4.6149 4.6653 4.6653 5.1049 5.1049 5.2282 5.2282 5.2917 5.2917 13.0012 13.0012 14.7339 14.7339 15.3708 15.3708 15.6817 15.6817 k = 0.1786-0.0000-0.0000 ( 4278 PWs) bands (ev): -13.5174 -13.5174 -12.9171 -12.9171 -12.6550 -12.6550 -11.7012 -11.7012 -11.5252 -11.5252 -11.4827 -11.4827 -11.0957 -11.0957 -10.9031 -10.9031 -0.7481 -0.7481 -0.2643 -0.2643 0.7736 0.7736 1.2323 1.2323 1.3668 1.3668 1.4290 1.4290 1.5005 1.5005 2.0365 2.0365 2.0828 2.0828 2.0949 2.0949 2.8608 2.8608 3.0251 3.0251 3.0915 3.0915 3.1572 3.1572 3.2354 3.2354 3.7368 3.7368 3.8617 3.8617 3.9898 3.9898 4.2057 4.2057 4.6041 4.6041 4.6509 4.6509 5.0874 5.0874 5.2176 5.2176 5.2864 5.2864 13.0999 13.0999 14.7954 14.7954 15.4153 15.4153 15.7804 15.7804 k = 0.1875-0.0000-0.0000 ( 4280 PWs) bands (ev): -13.4895 -13.4895 -12.8955 -12.8955 -12.6338 -12.6338 -11.6965 -11.6965 -11.5131 -11.5131 -11.4764 -11.4764 -11.0940 -11.0940 -10.9021 -10.9021 -0.7218 -0.7218 -0.2436 -0.2436 0.7902 0.7902 1.2001 1.2001 1.3018 1.3018 1.4032 1.4032 1.4476 1.4476 2.0227 2.0227 2.0961 2.0961 2.1070 2.1070 2.7875 2.7875 2.9940 2.9940 3.0475 3.0475 3.0925 3.0925 3.1860 3.1860 3.7552 3.7552 3.8775 3.8775 3.9835 3.9835 4.1663 4.1663 4.5949 4.5949 4.6354 4.6354 5.0688 5.0688 5.2057 5.2057 5.2804 5.2804 13.2007 13.2007 14.8573 14.8573 15.4578 15.4578 15.8804 15.8804 k = 0.1964-0.0000-0.0000 ( 4292 PWs) bands (ev): -13.4606 -13.4606 -12.8732 -12.8732 -12.6120 -12.6120 -11.6921 -11.6921 -11.5006 -11.5006 -11.4700 -11.4700 -11.0923 -11.0923 -10.9014 -10.9014 -0.6948 -0.6948 -0.2227 -0.2227 0.8069 0.8069 1.1548 1.1548 1.2344 1.2344 1.3726 1.3726 1.4065 1.4065 2.0137 2.0137 2.1102 2.1102 2.1214 2.1214 2.7138 2.7138 2.9607 2.9607 3.0013 3.0013 3.0292 3.0292 3.1367 3.1367 3.7731 3.7731 3.8923 3.8923 3.9772 3.9772 4.1291 4.1291 4.5873 4.5873 4.6187 4.6187 5.0493 5.0493 5.1926 5.1926 5.2738 5.2738 13.3033 13.3033 14.9193 14.9193 15.4979 15.4979 15.9813 15.9813 k = 0.2054-0.0000-0.0000 ( 4302 PWs) bands (ev): -13.4305 -13.4305 -12.8502 -12.8502 -12.5895 -12.5895 -11.6880 -11.6880 -11.4878 -11.4878 -11.4635 -11.4635 -11.0907 -11.0907 -10.9009 -10.9009 -0.6670 -0.6670 -0.2020 -0.2020 0.8237 0.8237 1.0974 1.0974 1.1656 1.1656 1.3380 1.3380 1.3763 1.3763 2.0085 2.0085 2.1248 2.1248 2.1370 2.1370 2.6407 2.6407 2.9256 2.9256 2.9527 2.9527 2.9685 2.9685 3.0878 3.0878 3.7907 3.7907 3.9053 3.9053 3.9719 3.9719 4.0941 4.0941 4.5812 4.5812 4.6011 4.6011 5.0287 5.0287 5.1784 5.1784 5.2664 5.2664 13.4074 13.4074 14.9814 14.9814 15.5353 15.5353 16.0826 16.0826 k = 0.2143-0.0000-0.0000 ( 4306 PWs) bands (ev): -13.3993 -13.3993 -12.8264 -12.8264 -12.5665 -12.5665 -11.6843 -11.6843 -11.4747 -11.4747 -11.4569 -11.4569 -11.0892 -11.0892 -10.9007 -10.9007 -0.6387 -0.6387 -0.1815 -0.1815 0.8402 0.8402 1.0312 1.0312 1.0964 1.0964 1.3003 1.3003 1.3536 1.3536 2.0062 2.0062 2.1364 2.1364 2.1548 2.1548 2.5700 2.5700 2.8889 2.8889 2.9008 2.9008 2.9122 2.9122 3.0396 3.0396 3.8079 3.8079 3.9147 3.9147 3.9693 3.9693 4.0614 4.0614 4.5749 4.5749 4.5841 4.5841 5.0072 5.0072 5.1630 5.1630 5.2584 5.2584 13.5129 13.5129 15.0432 15.0432 15.5696 15.5696 16.1839 16.1839 k = 0.2232-0.0000-0.0000 ( 4296 PWs) bands (ev): -13.3672 -13.3672 -12.8021 -12.8021 -12.5429 -12.5429 -11.6810 -11.6810 -11.4613 -11.4613 -11.4502 -11.4502 -11.0878 -11.0878 -10.9008 -10.9008 -0.6098 -0.6098 -0.1616 -0.1616 0.8565 0.8565 0.9597 0.9597 1.0277 1.0277 1.2606 1.2606 1.3353 1.3353 2.0053 2.0053 2.1414 2.1414 2.1755 2.1755 2.5044 2.5044 2.8471 2.8471 2.8509 2.8509 2.8601 2.8601 2.9924 2.9924 3.8248 3.8248 3.9178 3.9178 3.9720 3.9720 4.0311 4.0311 4.5593 4.5593 4.5768 4.5768 4.9848 4.9848 5.1465 5.1465 5.2497 5.2497 13.6196 13.6196 15.1044 15.1044 15.6006 15.6006 16.2847 16.2847 k = 0.2321-0.0000-0.0000 ( 4304 PWs) bands (ev): -13.3340 -13.3340 -12.7771 -12.7771 -12.5188 -12.5188 -11.6782 -11.6782 -11.4477 -11.4477 -11.4435 -11.4435 -11.0864 -11.0864 -10.9013 -10.9013 -0.5806 -0.5806 -0.1427 -0.1427 0.8723 0.8723 0.8852 0.8852 0.9602 0.9602 1.2196 1.2196 1.3191 1.3191 2.0045 2.0045 2.1358 2.1358 2.1984 2.1984 2.4481 2.4481 2.7959 2.7959 2.8081 2.8081 2.8132 2.8132 2.9463 2.9463 3.8412 3.8412 3.9141 3.9141 3.9800 3.9800 4.0036 4.0036 4.5382 4.5382 4.5752 4.5752 4.9613 4.9613 5.1289 5.1289 5.2404 5.2404 13.7272 13.7272 15.1649 15.1649 15.6280 15.6280 16.3846 16.3846 k = 0.2411-0.0000-0.0000 ( 4302 PWs) bands (ev): -13.2999 -13.2999 -12.7516 -12.7516 -12.4943 -12.4943 -11.6761 -11.6761 -11.4370 -11.4370 -11.4336 -11.4336 -11.0851 -11.0851 -10.9021 -10.9021 -0.5511 -0.5511 -0.1252 -0.1252 0.8092 0.8092 0.8876 0.8876 0.8946 0.8946 1.1783 1.1783 1.3037 1.3037 2.0020 2.0020 2.1146 2.1146 2.2226 2.2226 2.4066 2.4066 2.7486 2.7486 2.7594 2.7594 2.7734 2.7734 2.9016 2.9016 3.8574 3.8574 3.9062 3.9062 3.9760 3.9760 3.9936 3.9936 4.5153 4.5153 4.5755 4.5755 4.9369 4.9369 5.1104 5.1104 5.2304 5.2304 13.8356 13.8356 15.2244 15.2244 15.6515 15.6515 16.4828 16.4828 k = 0.2500-0.0000-0.0000 ( 4294 PWs) bands (ev): -13.2649 -13.2649 -12.7256 -12.7256 -12.4695 -12.4695 -11.6746 -11.6746 -11.4303 -11.4303 -11.4197 -11.4197 -11.0839 -11.0839 -10.9034 -10.9034 -0.5214 -0.5214 -0.1095 -0.1095 0.7327 0.7327 0.8318 0.8318 0.9020 0.9020 1.1374 1.1374 1.2882 1.2882 1.9965 1.9965 2.0749 2.0749 2.2478 2.2478 2.3822 2.3822 2.7030 2.7030 2.7162 2.7162 2.7341 2.7341 2.8585 2.8585 3.8731 3.8731 3.8958 3.8958 3.9533 3.9533 4.0060 4.0060 4.4910 4.4910 4.5774 4.5774 4.9116 4.9116 5.0909 5.0909 5.2198 5.2198 13.9446 13.9446 15.2828 15.2828 15.6712 15.6712 16.5788 16.5788 k = 0.2589-0.0000-0.0000 ( 4296 PWs) bands (ev): -13.2290 -13.2290 -12.6991 -12.6991 -12.4444 -12.4444 -11.6739 -11.6739 -11.4236 -11.4236 -11.4055 -11.4055 -11.0827 -11.0827 -10.9051 -10.9051 -0.4918 -0.4918 -0.0965 -0.0965 0.6563 0.6563 0.7726 0.7726 0.9153 0.9153 1.0976 1.0976 1.2722 1.2722 1.9865 1.9865 2.0197 2.0197 2.2732 2.2732 2.3714 2.3714 2.6572 2.6572 2.6832 2.6832 2.6956 2.6956 2.8170 2.8170 3.8831 3.8831 3.8891 3.8891 3.9323 3.9323 4.0196 4.0196 4.4654 4.4654 4.5805 4.5805 4.8855 4.8855 5.0705 5.0705 5.2086 5.2086 14.0541 14.0541 15.3398 15.3398 15.6868 15.6868 16.6425 16.6425 k = 0.2679-0.0000-0.0000 ( 4302 PWs) bands (ev): -13.1924 -13.1924 -12.6723 -12.6723 -12.4192 -12.4192 -11.6740 -11.6740 -11.4169 -11.4169 -11.3913 -11.3913 -11.0816 -11.0816 -10.9072 -10.9072 -0.4623 -0.4623 -0.0867 -0.0867 0.5804 0.5804 0.7179 0.7179 0.9274 0.9274 1.0595 1.0595 1.2554 1.2554 1.9544 1.9544 1.9711 1.9711 2.2982 2.2982 2.3669 2.3669 2.6150 2.6150 2.6566 2.6566 2.6622 2.6622 2.7773 2.7773 3.8702 3.8702 3.9021 3.9021 3.9149 3.9149 4.0333 4.0333 4.4384 4.4384 4.5848 4.5848 4.8584 4.8584 5.0493 5.0493 5.1968 5.1968 14.1639 14.1639 15.3953 15.3953 15.6985 15.6985 16.5768 16.5768 k = 0.2768-0.0000-0.0000 ( 4310 PWs) bands (ev): -13.1549 -13.1549 -12.6451 -12.6451 -12.3938 -12.3938 -11.6751 -11.6751 -11.4103 -11.4103 -11.3770 -11.3770 -11.0806 -11.0806 -10.9099 -10.9099 -0.4331 -0.4331 -0.0811 -0.0811 0.5054 0.5054 0.6687 0.6687 0.9380 0.9380 1.0236 1.0236 1.2375 1.2375 1.8840 1.8840 1.9494 1.9494 2.3213 2.3213 2.3614 2.3614 2.5808 2.5808 2.6233 2.6233 2.6477 2.6477 2.7395 2.7395 3.8560 3.8560 3.8942 3.8942 3.9205 3.9205 4.0469 4.0469 4.4100 4.4100 4.5901 4.5901 4.8306 4.8306 5.0273 5.0273 5.1845 5.1845 14.2739 14.2739 15.4492 15.4492 15.7062 15.7062 16.5111 16.5111 k = 0.2857-0.0000-0.0000 ( 4310 PWs) bands (ev): -13.1168 -13.1168 -12.6177 -12.6177 -12.3685 -12.3685 -11.6773 -11.6773 -11.4037 -11.4037 -11.3627 -11.3627 -11.0797 -11.0797 -10.9132 -10.9132 -0.4045 -0.4045 -0.0805 -0.0805 0.4317 0.4317 0.6260 0.6260 0.9467 0.9467 0.9906 0.9906 1.2186 1.2186 1.8112 1.8112 1.9218 1.9218 2.3365 2.3365 2.3523 2.3523 2.5591 2.5591 2.5939 2.5939 2.6434 2.6434 2.7036 2.7036 3.8408 3.8408 3.8795 3.8795 3.9347 3.9347 4.0602 4.0602 4.3804 4.3804 4.5963 4.5963 4.8020 4.8020 5.0046 5.0046 5.1718 5.1718 14.3839 14.3839 15.5013 15.5013 15.7102 15.7102 16.4460 16.4460 k = 0.2946-0.0000-0.0000 ( 4308 PWs) bands (ev): -13.0780 -13.0780 -12.5900 -12.5900 -12.3433 -12.3433 -11.6805 -11.6805 -11.3971 -11.3971 -11.3483 -11.3483 -11.0788 -11.0788 -10.9170 -10.9170 -0.3765 -0.3765 -0.0857 -0.0857 0.3593 0.3593 0.5906 0.5906 0.9525 0.9525 0.9615 0.9615 1.1987 1.1987 1.7377 1.7377 1.8888 1.8888 2.3180 2.3180 2.3588 2.3588 2.5522 2.5522 2.5726 2.5726 2.6473 2.6473 2.6699 2.6699 3.8249 3.8249 3.8662 3.8662 3.9490 3.9490 4.0732 4.0732 4.3494 4.3494 4.6034 4.6034 4.7727 4.7727 4.9812 4.9812 5.1586 5.1586 14.4937 14.4937 15.5517 15.5517 15.7105 15.7105 16.3817 16.3817 k = 0.3036-0.0000-0.0000 ( 4304 PWs) bands (ev): -13.0385 -13.0385 -12.5622 -12.5622 -12.3183 -12.3183 -11.6849 -11.6849 -11.3905 -11.3905 -11.3341 -11.3341 -11.0779 -11.0779 -10.9214 -10.9214 -0.3493 -0.3493 -0.0971 -0.0971 0.2886 0.2886 0.5630 0.5630 0.9337 0.9337 0.9578 0.9578 1.1777 1.1777 1.6649 1.6649 1.8516 1.8516 2.2829 2.2829 2.3616 2.3616 2.5567 2.5567 2.5644 2.5644 2.6365 2.6365 2.6602 2.6602 3.8081 3.8081 3.8547 3.8547 3.9631 3.9631 4.0856 4.0856 4.3171 4.3171 4.6111 4.6111 4.7428 4.7428 4.9572 4.9572 5.1450 5.1450 14.6034 14.6034 15.6001 15.6001 15.7075 15.7075 16.3185 16.3185 k = 0.3125-0.0000-0.0000 ( 4304 PWs) bands (ev): -12.9986 -12.9986 -12.5344 -12.5344 -12.2936 -12.2936 -11.6906 -11.6906 -11.3839 -11.3839 -11.3199 -11.3199 -11.0771 -11.0771 -10.9264 -10.9264 -0.3230 -0.3230 -0.1147 -0.1147 0.2198 0.2198 0.5434 0.5434 0.9114 0.9114 0.9586 0.9586 1.1558 1.1558 1.5938 1.5938 1.8112 1.8112 2.2412 2.2412 2.3530 2.3530 2.5653 2.5653 2.5745 2.5745 2.6067 2.6067 2.6777 2.6777 3.7906 3.7906 3.8448 3.8448 3.9769 3.9769 4.0976 4.0976 4.2836 4.2836 4.6195 4.6195 4.7124 4.7124 4.9326 4.9326 5.1310 5.1310 14.7126 14.7126 15.6466 15.6466 15.7015 15.7015 16.2565 16.2565 k = 0.3214-0.0000-0.0000 ( 4304 PWs) bands (ev): -12.9581 -12.9581 -12.5065 -12.5065 -12.2693 -12.2693 -11.6976 -11.6976 -11.3772 -11.3772 -11.3059 -11.3059 -11.0763 -11.0763 -10.9320 -10.9320 -0.2979 -0.2979 -0.1381 -0.1381 0.1529 0.1529 0.5311 0.5311 0.8931 0.8931 0.9557 0.9557 1.1331 1.1331 1.5256 1.5256 1.7686 1.7686 2.1962 2.1962 2.3351 2.3351 2.5739 2.5739 2.5856 2.5856 2.5944 2.5944 2.7008 2.7008 3.7724 3.7724 3.8366 3.8366 3.9904 3.9904 4.1091 4.1091 4.2489 4.2489 4.6281 4.6281 4.6819 4.6819 4.9075 4.9075 5.1168 5.1168 14.8214 14.8214 15.6905 15.6905 15.6933 15.6933 16.1960 16.1960 k = 0.3304-0.0000-0.0000 ( 4320 PWs) bands (ev): -12.9172 -12.9172 -12.4787 -12.4787 -12.2457 -12.2457 -11.7059 -11.7059 -11.3705 -11.3705 -11.2920 -11.2920 -11.0756 -11.0756 -10.9383 -10.9383 -0.2739 -0.2739 -0.1662 -0.1662 0.0882 0.0882 0.5255 0.5255 0.8791 0.8791 0.9483 0.9483 1.1097 1.1097 1.4611 1.4611 1.7248 1.7248 2.1497 2.1497 2.3118 2.3118 2.5492 2.5492 2.6068 2.6068 2.6181 2.6181 2.7281 2.7281 3.7534 3.7534 3.8299 3.8299 4.0037 4.0037 4.1199 4.1199 4.2130 4.2130 4.6354 4.6354 4.6528 4.6528 4.8819 4.8819 5.1023 5.1023 14.9296 14.9296 15.6814 15.6814 15.7337 15.7337 16.1372 16.1372 k = 0.3393-0.0000-0.0000 ( 4326 PWs) bands (ev): -12.8759 -12.8759 -12.4510 -12.4510 -12.2227 -12.2227 -11.7158 -11.7158 -11.3637 -11.3637 -11.2784 -11.2784 -11.0750 -11.0750 -10.9453 -10.9453 -0.2512 -0.2512 -0.1979 -0.1979 0.0257 0.0257 0.5252 0.5252 0.8697 0.8697 0.9355 0.9355 1.0858 1.0858 1.4016 1.4016 1.6805 1.6805 2.1027 2.1027 2.2865 2.2865 2.5234 2.5234 2.6346 2.6346 2.6448 2.6448 2.7589 2.7589 3.7337 3.7337 3.8245 3.8245 4.0166 4.0166 4.1300 4.1300 4.1761 4.1761 4.6171 4.6171 4.6495 4.6495 4.8559 4.8559 5.0876 5.0876 15.0370 15.0370 15.6682 15.6682 15.7743 15.7743 16.0802 16.0802 k = 0.3482-0.0000-0.0000 ( 4330 PWs) bands (ev): -12.8343 -12.8343 -12.4236 -12.4236 -12.2006 -12.2006 -11.7271 -11.7271 -11.3567 -11.3567 -11.2650 -11.2650 -11.0744 -11.0744 -10.9529 -10.9529 -0.2334 -0.2334 -0.2284 -0.2284 -0.0343 -0.0343 0.5292 0.5292 0.8648 0.8648 0.9164 0.9164 1.0616 1.0616 1.3482 1.3482 1.6365 1.6365 2.0559 2.0559 2.2611 2.2611 2.4987 2.4987 2.6648 2.6648 2.6741 2.6741 2.7925 2.7925 3.7133 3.7133 3.8203 3.8203 4.0292 4.0292 4.1355 4.1355 4.1420 4.1420 4.5866 4.5866 4.6588 4.6588 4.8295 4.8295 5.0728 5.0728 15.1436 15.1436 15.6534 15.6534 15.8131 15.8131 16.0251 16.0251 k = 0.3571-0.0000-0.0000 ( 4334 PWs) bands (ev): -12.7925 -12.7925 -12.3964 -12.3964 -12.1794 -12.1794 -11.7399 -11.7399 -11.3495 -11.3495 -11.2518 -11.2518 -11.0739 -11.0739 -10.9612 -10.9612 -0.2678 -0.2678 -0.2091 -0.2091 -0.0917 -0.0917 0.5364 0.5364 0.8645 0.8645 0.8905 0.8905 1.0372 1.0372 1.3019 1.3019 1.5931 1.5931 2.0095 2.0095 2.2366 2.2366 2.4750 2.4750 2.6964 2.6964 2.7056 2.7056 2.8283 2.8283 3.6922 3.6922 3.8169 3.8169 4.0414 4.0414 4.0985 4.0985 4.1487 4.1487 4.5559 4.5559 4.6689 4.6689 4.8029 4.8029 5.0579 5.0579 15.2490 15.2490 15.6373 15.6373 15.8500 15.8500 15.9721 15.9721 k = 0.3661-0.0000-0.0000 ( 4342 PWs) bands (ev): -12.7505 -12.7505 -12.3696 -12.3696 -12.1594 -12.1594 -11.7542 -11.7542 -11.3420 -11.3420 -11.2390 -11.2390 -11.0736 -11.0736 -10.9702 -10.9702 -0.3037 -0.3037 -0.1897 -0.1897 -0.1465 -0.1465 0.5459 0.5459 0.8565 0.8565 0.8695 0.8695 1.0128 1.0128 1.2630 1.2630 1.5509 1.5509 1.9636 1.9636 2.2139 2.2139 2.4522 2.4522 2.7288 2.7288 2.7389 2.7389 2.8660 2.8660 3.6705 3.6705 3.8143 3.8143 4.0533 4.0533 4.0586 4.0586 4.1567 4.1567 4.5256 4.5256 4.6792 4.6792 4.7760 4.7760 5.0430 5.0430 15.3533 15.3533 15.6204 15.6204 15.8852 15.8852 15.9215 15.9215 k = 0.3750-0.0000-0.0000 ( 4346 PWs) bands (ev): -12.7084 -12.7084 -12.3432 -12.3432 -12.1407 -12.1407 -11.7702 -11.7702 -11.3341 -11.3341 -11.2265 -11.2265 -11.0733 -11.0733 -10.9799 -10.9799 -0.3392 -0.3392 -0.1986 -0.1986 -0.1711 -0.1711 0.5569 0.5569 0.8172 0.8172 0.8776 0.8776 0.9887 0.9887 1.2312 1.2312 1.5102 1.5102 1.9184 1.9184 2.1933 2.1933 2.4303 2.4303 2.7621 2.7621 2.7735 2.7735 2.9052 2.9052 3.6481 3.6481 3.8119 3.8119 4.0178 4.0178 4.0649 4.0649 4.1639 4.1639 4.4961 4.4961 4.6897 4.6897 4.7490 4.7490 5.0282 5.0282 15.4561 15.4561 15.6031 15.6031 15.8728 15.8728 15.9192 15.9192 k = 0.3839-0.0000-0.0000 ( 4346 PWs) bands (ev): -12.6662 -12.6662 -12.3174 -12.3174 -12.1234 -12.1234 -11.7876 -11.7876 -11.3259 -11.3259 -11.2144 -11.2144 -11.0733 -11.0733 -10.9903 -10.9903 -0.3738 -0.3738 -0.2477 -0.2477 -0.1531 -0.1531 0.5689 0.5689 0.7723 0.7723 0.8901 0.8901 0.9648 0.9648 1.2056 1.2056 1.4712 1.4712 1.8739 1.8739 2.1751 2.1751 2.4090 2.4090 2.7964 2.7964 2.8088 2.8088 2.9455 2.9455 3.6250 3.6250 3.8093 3.8093 3.9764 3.9764 4.0760 4.0760 4.1704 4.1704 4.4680 4.4680 4.6997 4.6997 4.7224 4.7224 5.0134 5.0134 15.5574 15.5574 15.5857 15.5857 15.8269 15.8269 15.9514 15.9514 k = 0.3929-0.0000-0.0000 ( 4348 PWs) bands (ev): -12.6240 -12.6240 -12.2922 -12.2922 -12.1077 -12.1077 -11.8067 -11.8067 -11.3173 -11.3173 -11.2027 -11.2027 -11.0734 -11.0734 -11.0013 -11.0013 -0.4068 -0.4068 -0.2939 -0.2939 -0.1353 -0.1353 0.5814 0.5814 0.7236 0.7236 0.9063 0.9063 0.9415 0.9415 1.1850 1.1850 1.4343 1.4343 1.8301 1.8301 2.1596 2.1596 2.3883 2.3883 2.8316 2.8316 2.8447 2.8447 2.9866 2.9866 3.6012 3.6012 3.8062 3.8062 3.9344 3.9344 4.0868 4.0868 4.1760 4.1760 4.4416 4.4416 4.6927 4.6927 4.7128 4.7128 4.9988 4.9988 15.5686 15.5686 15.6568 15.6568 15.7836 15.7836 15.9824 15.9824 k = 0.4018-0.0000-0.0000 ( 4348 PWs) bands (ev): -12.5820 -12.5820 -12.2678 -12.2678 -12.0936 -12.0936 -11.8273 -11.8273 -11.3081 -11.3081 -11.1915 -11.1915 -11.0737 -11.0737 -11.0129 -11.0129 -0.4380 -0.4380 -0.3370 -0.3370 -0.1175 -0.1175 0.5941 0.5941 0.6725 0.6725 0.9186 0.9186 0.9261 0.9261 1.1683 1.1683 1.3997 1.3997 1.7868 1.7868 2.1468 2.1468 2.3681 2.3681 2.8678 2.8678 2.8808 2.8808 3.0282 3.0282 3.5767 3.5767 3.8019 3.8019 3.8920 3.8920 4.0971 4.0971 4.1808 4.1808 4.4176 4.4176 4.6662 4.6662 4.7228 4.7228 4.9844 4.9844 15.5521 15.5521 15.7424 15.7424 15.7547 15.7547 16.0123 16.0123 k = 0.4107-0.0000-0.0000 ( 4338 PWs) bands (ev): -12.5401 -12.5401 -12.2441 -12.2441 -12.0814 -12.0814 -11.8494 -11.8494 -11.2983 -11.2983 -11.1807 -11.1807 -11.0743 -11.0743 -11.0251 -11.0251 -0.4668 -0.4668 -0.3770 -0.3770 -0.0993 -0.0993 0.6067 0.6067 0.6204 0.6204 0.8968 0.8968 0.9485 0.9485 1.1546 1.1546 1.3676 1.3676 1.7440 1.7440 2.1369 2.1369 2.3483 2.3483 2.9049 2.9049 2.9171 2.9171 3.0700 3.0700 3.5516 3.5516 3.7959 3.7959 3.8495 3.8495 4.1071 4.1071 4.1847 4.1847 4.3963 4.3963 4.6390 4.6390 4.7335 4.7335 4.9702 4.9702 15.5366 15.5366 15.7047 15.7047 15.8494 15.8494 16.0413 16.0413 k = 0.4196-0.0000-0.0000 ( 4334 PWs) bands (ev): -12.4984 -12.4984 -12.2213 -12.2213 -12.0711 -12.0711 -11.8731 -11.8731 -11.2880 -11.2880 -11.1703 -11.1703 -11.0752 -11.0752 -11.0379 -11.0379 -0.4932 -0.4932 -0.4138 -0.4138 -0.0804 -0.0804 0.5677 0.5677 0.6194 0.6194 0.8757 0.8757 0.9733 0.9733 1.1434 1.1434 1.3383 1.3383 1.7017 1.7017 2.1298 2.1298 2.3288 2.3288 2.9427 2.9427 2.9535 2.9535 3.1117 3.1117 3.5258 3.5258 3.7876 3.7876 3.8070 3.8070 4.1165 4.1165 4.1879 4.1879 4.3784 4.3784 4.6120 4.6120 4.7443 4.7443 4.9563 4.9563 15.5222 15.5222 15.6695 15.6695 15.9419 15.9419 16.0696 16.0696 k = 0.4286-0.0000-0.0000 ( 4330 PWs) bands (ev): -12.4571 -12.4571 -12.1995 -12.1995 -12.0628 -12.0628 -11.8982 -11.8982 -11.2770 -11.2770 -11.1605 -11.1605 -11.0764 -11.0764 -11.0512 -11.0512 -0.5169 -0.5169 -0.4473 -0.4473 -0.0606 -0.0606 0.5157 0.5157 0.6317 0.6317 0.8554 0.8554 0.9998 0.9998 1.1342 1.1342 1.3122 1.3122 1.6598 1.6598 2.1255 2.1255 2.3098 2.3098 2.9810 2.9810 2.9901 2.9901 3.1526 3.1526 3.4993 3.4993 3.7646 3.7646 3.7770 3.7770 4.1256 4.1256 4.1901 4.1901 4.3644 4.3644 4.5852 4.5852 4.7552 4.7552 4.9426 4.9426 15.5094 15.5094 15.6372 15.6372 16.0315 16.0315 16.0973 16.0973 k = 0.4375-0.0000-0.0000 ( 4332 PWs) bands (ev): -12.4162 -12.4162 -12.1788 -12.1788 -12.0566 -12.0566 -11.9247 -11.9247 -11.2654 -11.2654 -11.1512 -11.1512 -11.0780 -11.0780 -11.0650 -11.0650 -0.5376 -0.5376 -0.4774 -0.4774 -0.0396 -0.0396 0.4648 0.4648 0.6437 0.6437 0.8361 0.8361 1.0273 1.0273 1.1268 1.1268 1.2899 1.2899 1.6183 1.6183 2.1240 2.1240 2.2910 2.2910 3.0192 3.0192 3.0271 3.0271 3.1924 3.1924 3.4722 3.4722 3.7236 3.7236 3.7628 3.7628 4.1341 4.1341 4.1915 4.1915 4.3547 4.3547 4.5588 4.5588 4.7660 4.7660 4.9292 4.9292 15.4983 15.4983 15.6077 15.6077 16.1176 16.1176 16.1249 16.1249 k = 0.4464-0.0000-0.0000 ( 4328 PWs) bands (ev): -12.3757 -12.3757 -12.1593 -12.1593 -12.0526 -12.0526 -11.9527 -11.9527 -11.2531 -11.2531 -11.1424 -11.1424 -11.0800 -11.0800 -11.0792 -11.0792 -0.5553 -0.5553 -0.5042 -0.5042 -0.0170 -0.0170 0.4152 0.4152 0.6555 0.6555 0.8178 0.8178 1.0545 1.0545 1.1211 1.1211 1.2721 1.2721 1.5771 1.5771 2.1250 2.1250 2.2727 2.2727 3.0566 3.0566 3.0651 3.0651 3.2299 3.2299 3.4443 3.4443 3.6843 3.6843 3.7455 3.7455 4.1422 4.1422 4.1920 4.1920 4.3493 4.3493 4.5329 4.5329 4.7769 4.7769 4.9161 4.9161 15.4891 15.4891 15.5812 15.5812 16.1521 16.1521 16.2003 16.2003 k = 0.4554-0.0000-0.0000 ( 4328 PWs) bands (ev): -12.3357 -12.3357 -12.1410 -12.1410 -12.0506 -12.0506 -11.9820 -11.9820 -11.2403 -11.2403 -11.1342 -11.1342 -11.0938 -11.0938 -11.0824 -11.0824 -0.5698 -0.5698 -0.5276 -0.5276 0.0072 0.0072 0.3673 0.3673 0.6672 0.6672 0.8004 0.8004 1.0797 1.0797 1.1170 1.1170 1.2606 1.2606 1.5363 1.5363 2.1284 2.1284 2.2548 2.2548 3.0928 3.0928 3.1042 3.1042 3.2640 3.2640 3.4157 3.4157 3.6481 3.6481 3.7251 3.7251 4.1497 4.1497 4.1918 4.1918 4.3483 4.3483 4.5077 4.5077 4.7878 4.7878 4.9033 4.9033 15.4821 15.4821 15.5576 15.5576 16.1795 16.1795 16.2787 16.2787 k = 0.4643-0.0000-0.0000 ( 4334 PWs) bands (ev): -12.2964 -12.2964 -12.1242 -12.1242 -12.0509 -12.0509 -12.0126 -12.0126 -11.2269 -11.2269 -11.1266 -11.1266 -11.1086 -11.1086 -11.0852 -11.0852 -0.5811 -0.5811 -0.5475 -0.5475 0.0334 0.0334 0.3214 0.3214 0.6788 0.6788 0.7840 0.7840 1.1001 1.1001 1.1145 1.1145 1.2576 1.2576 1.4960 1.4960 2.1341 2.1341 2.2374 2.2374 3.1280 3.1280 3.1437 3.1437 3.2921 3.2921 3.3865 3.3865 3.6171 3.6171 3.7021 3.7021 4.1567 4.1567 4.1907 4.1907 4.3515 4.3515 4.4834 4.4834 4.7987 4.7987 4.8908 4.8908 15.4774 15.4774 15.5370 15.5370 16.2072 16.2072 16.3527 16.3527 k = 0.4732-0.0000-0.0000 ( 4330 PWs) bands (ev): -12.2578 -12.2578 -12.1088 -12.1088 -12.0533 -12.0533 -12.0444 -12.0444 -11.2130 -11.2130 -11.1236 -11.1236 -11.1195 -11.1195 -11.0885 -11.0885 -0.5890 -0.5890 -0.5640 -0.5640 0.0615 0.0615 0.2775 0.2775 0.6904 0.6904 0.7686 0.7686 1.1128 1.1128 1.1142 1.1142 1.2656 1.2656 1.4563 1.4563 2.1418 2.1418 2.2206 2.2206 3.1626 3.1626 3.1828 3.1828 3.3110 3.3110 3.3566 3.3566 3.5947 3.5947 3.6770 3.6770 4.1632 4.1632 4.1889 4.1889 4.3586 4.3586 4.4601 4.4601 4.8097 4.8097 4.8786 4.8786 15.4752 15.4752 15.5194 15.5194 16.2354 16.2354 16.4215 16.4215 k = 0.4821-0.0000-0.0000 ( 4336 PWs) bands (ev): -12.2199 -12.2199 -12.0950 -12.0950 -12.0775 -12.0775 -12.0577 -12.0577 -11.1986 -11.1986 -11.1388 -11.1388 -11.1129 -11.1129 -11.0923 -11.0923 -0.5935 -0.5935 -0.5769 -0.5769 0.0919 0.0919 0.2358 0.2358 0.7022 0.7022 0.7539 0.7539 1.1139 1.1139 1.1191 1.1191 1.2845 1.2845 1.4174 1.4174 2.1515 2.1515 2.2046 2.2046 3.1964 3.1964 3.2205 3.2205 3.3163 3.3163 3.3263 3.3263 3.5846 3.5846 3.6510 3.6510 4.1691 4.1691 4.1863 4.1863 4.3692 4.3692 4.4381 4.4381 4.8208 4.8208 4.8666 4.8666 15.4756 15.4756 15.5048 15.5048 16.2642 16.2642 16.3890 16.3890 k = 0.4911-0.0000-0.0000 ( 4324 PWs) bands (ev): -12.1829 -12.1829 -12.1116 -12.1116 -12.0829 -12.0829 -12.0642 -12.0642 -11.1839 -11.1839 -11.1539 -11.1539 -11.1070 -11.1070 -11.0967 -11.0967 -0.5946 -0.5946 -0.5863 -0.5863 0.1244 0.1244 0.1964 0.1964 0.7144 0.7144 0.7401 0.7401 1.1155 1.1155 1.1195 1.1195 1.3117 1.3117 1.3798 1.3798 2.1627 2.1627 2.1895 2.1895 3.2297 3.2297 3.2555 3.2555 3.2944 3.2944 3.3078 3.3078 3.5885 3.5885 3.6258 3.6258 4.1744 4.1744 4.1831 4.1831 4.3829 4.3829 4.4177 4.4177 4.8320 4.8320 4.8549 4.8549 15.4786 15.4786 15.4932 15.4932 16.2938 16.2938 16.3561 16.3561 k = 0.5000-0.0000-0.0000 ( 4320 PWs) bands (ev): -12.1467 -12.1467 -12.1467 -12.1467 -12.0726 -12.0726 -12.0726 -12.0726 -11.1690 -11.1690 -11.1690 -11.1690 -11.1015 -11.1015 -11.1015 -11.1015 -0.5922 -0.5922 -0.5922 -0.5922 0.1592 0.1592 0.1592 0.1592 0.7270 0.7270 0.7270 0.7270 1.1177 1.1177 1.1177 1.1177 1.3442 1.3442 1.3442 1.3442 2.1755 2.1755 2.1755 2.1755 3.2621 3.2621 3.2621 3.2621 3.2861 3.2861 3.2861 3.2861 3.6037 3.6037 3.6037 3.6037 4.1791 4.1791 4.1791 4.1791 4.3992 4.3992 4.3992 4.3992 4.8434 4.8434 4.8434 4.8434 15.4845 15.4845 15.4845 15.4845 16.3244 16.3244 16.3244 16.3244 k = 0.5000-0.0000-0.0000 ( 4320 PWs) bands (ev): -12.1467 -12.1467 -12.1467 -12.1467 -12.0726 -12.0726 -12.0726 -12.0726 -11.1690 -11.1690 -11.1690 -11.1690 -11.1015 -11.1015 -11.1015 -11.1015 -0.5922 -0.5922 -0.5922 -0.5922 0.1592 0.1592 0.1592 0.1592 0.7270 0.7270 0.7270 0.7270 1.1177 1.1177 1.1177 1.1177 1.3442 1.3442 1.3442 1.3442 2.1755 2.1755 2.1755 2.1755 3.2621 3.2621 3.2621 3.2621 3.2861 3.2861 3.2861 3.2861 3.6037 3.6037 3.6037 3.6037 4.1791 4.1791 4.1791 4.1791 4.3992 4.3992 4.3992 4.3992 4.8434 4.8434 4.8434 4.8434 15.4845 15.4845 15.4845 15.4845 16.3244 16.3244 16.3244 16.3244 k = 0.5000 0.0090-0.0000 ( 4336 PWs) bands (ev): -12.1464 -12.1464 -12.1464 -12.1464 -12.0724 -12.0724 -12.0724 -12.0724 -11.1693 -11.1693 -11.1693 -11.1693 -11.1019 -11.1019 -11.1019 -11.1019 -0.5931 -0.5931 -0.5930 -0.5930 0.1578 0.1578 0.1582 0.1582 0.7276 0.7276 0.7279 0.7279 1.1177 1.1177 1.1178 1.1178 1.3431 1.3431 1.3432 1.3432 2.1772 2.1772 2.1773 2.1773 3.2550 3.2550 3.2586 3.2586 3.2893 3.2893 3.2930 3.2930 3.6037 3.6037 3.6038 3.6038 4.1797 4.1797 4.1800 4.1800 4.3996 4.3996 4.3998 4.3998 4.8436 4.8436 4.8436 4.8436 15.4843 15.4843 15.4843 15.4843 16.3160 16.3160 16.3168 16.3168 k = 0.5000 0.0179-0.0000 ( 4340 PWs) bands (ev): -12.1455 -12.1455 -12.1455 -12.1455 -12.0716 -12.0716 -12.0716 -12.0716 -11.1701 -11.1701 -11.1701 -11.1701 -11.1028 -11.1028 -11.1028 -11.1028 -0.5956 -0.5956 -0.5955 -0.5955 0.1540 0.1540 0.1546 0.1546 0.7297 0.7297 0.7303 0.7303 1.1175 1.1175 1.1177 1.1177 1.3401 1.3401 1.3405 1.3405 2.1824 2.1824 2.1826 2.1826 3.2442 3.2442 3.2487 3.2487 3.2984 3.2984 3.3031 3.3031 3.6040 3.6040 3.6043 3.6043 4.1818 4.1818 4.1826 4.1826 4.4011 4.4011 4.4016 4.4016 4.8444 4.8444 4.8444 4.8444 15.4837 15.4837 15.4837 15.4837 16.2940 16.2940 16.2955 16.2955 k = 0.5000 0.0269-0.0000 ( 4338 PWs) bands (ev): -12.1440 -12.1440 -12.1440 -12.1440 -12.0703 -12.0703 -12.0702 -12.0702 -11.1715 -11.1715 -11.1715 -11.1715 -11.1044 -11.1044 -11.1044 -11.1044 -0.5997 -0.5997 -0.5996 -0.5996 0.1478 0.1478 0.1487 0.1487 0.7333 0.7333 0.7342 0.7342 1.1166 1.1166 1.1168 1.1168 1.3361 1.3361 1.3365 1.3365 2.1907 2.1907 2.1911 2.1911 3.2329 3.2329 3.2378 3.2378 3.3081 3.3081 3.3133 3.3133 3.6048 3.6048 3.6053 3.6053 4.1854 4.1854 4.1865 4.1865 4.4037 4.4037 4.4045 4.4045 4.8456 4.8456 4.8457 4.8457 15.4827 15.4827 15.4827 15.4827 16.2629 16.2629 16.2647 16.2647 k = 0.5000 0.0359-0.0000 ( 4330 PWs) bands (ev): -12.1419 -12.1419 -12.1419 -12.1419 -12.0684 -12.0684 -12.0684 -12.0684 -11.1734 -11.1734 -11.1734 -11.1734 -11.1066 -11.1066 -11.1066 -11.1066 -0.6053 -0.6053 -0.6052 -0.6052 0.1394 0.1394 0.1406 0.1406 0.7383 0.7383 0.7394 0.7394 1.1143 1.1143 1.1145 1.1145 1.3319 1.3319 1.3325 1.3325 2.2017 2.2017 2.2023 2.2023 3.2221 3.2221 3.2274 3.2274 3.3168 3.3168 3.3225 3.3225 3.6064 3.6064 3.6072 3.6072 4.1902 4.1902 4.1916 4.1916 4.4073 4.4073 4.4083 4.4083 4.8474 4.8474 4.8475 4.8475 15.4811 15.4811 15.4812 15.4812 16.2267 16.2267 16.2288 16.2288 k = 0.5000 0.0448-0.0000 ( 4330 PWs) bands (ev): -12.1392 -12.1392 -12.1392 -12.1392 -12.0661 -12.0661 -12.0661 -12.0661 -11.1758 -11.1758 -11.1758 -11.1758 -11.1094 -11.1094 -11.1094 -11.1094 -0.6123 -0.6123 -0.6122 -0.6122 0.1290 0.1290 0.1305 0.1305 0.7445 0.7445 0.7458 0.7458 1.1094 1.1094 1.1095 1.1095 1.3290 1.3290 1.3295 1.3295 2.2148 2.2148 2.2156 2.2156 3.2125 3.2125 3.2181 3.2181 3.3240 3.3240 3.3303 3.3303 3.6092 3.6092 3.6103 3.6103 4.1959 4.1959 4.1976 4.1976 4.4117 4.4117 4.4130 4.4130 4.8498 4.8498 4.8498 4.8498 15.4789 15.4789 15.4790 15.4790 16.1883 16.1883 16.1905 16.1905 k = 0.5000 0.0538-0.0000 ( 4330 PWs) bands (ev): -12.1360 -12.1360 -12.1360 -12.1360 -12.0633 -12.0633 -12.0632 -12.0632 -11.1787 -11.1787 -11.1787 -11.1787 -11.1128 -11.1128 -11.1128 -11.1128 -0.6206 -0.6206 -0.6204 -0.6204 0.1168 0.1168 0.1185 0.1185 0.7517 0.7517 0.7532 0.7532 1.1009 1.1009 1.1010 1.1010 1.3286 1.3286 1.3290 1.3290 2.2293 2.2293 2.2304 2.2304 3.2044 3.2044 3.2104 3.2104 3.3294 3.3294 3.3363 3.3363 3.6136 3.6136 3.6151 3.6151 4.2021 4.2021 4.2042 4.2042 4.4169 4.4169 4.4185 4.4185 4.8527 4.8527 4.8527 4.8527 15.4760 15.4760 15.4761 15.4761 16.1497 16.1497 16.1518 16.1518 k = 0.5000 0.0628-0.0000 ( 4326 PWs) bands (ev): -12.1321 -12.1321 -12.1321 -12.1321 -12.0599 -12.0599 -12.0599 -12.0599 -11.1822 -11.1822 -11.1822 -11.1822 -11.1168 -11.1168 -11.1168 -11.1168 -0.6300 -0.6300 -0.6298 -0.6298 0.1030 0.1030 0.1048 0.1048 0.7599 0.7599 0.7614 0.7614 1.0882 1.0882 1.0883 1.0883 1.3316 1.3316 1.3319 1.3319 2.2447 2.2447 2.2460 2.2460 3.1984 3.1984 3.2048 3.2048 3.3330 3.3330 3.3405 3.3405 3.6199 3.6199 3.6219 3.6219 4.2086 4.2086 4.2109 4.2109 4.4227 4.4227 4.4246 4.4246 4.8561 4.8561 4.8562 4.8562 15.4722 15.4722 15.4724 15.4724 16.1121 16.1121 16.1143 16.1143 k = 0.5000 0.0717-0.0000 ( 4326 PWs) bands (ev): -12.1278 -12.1278 -12.1278 -12.1278 -12.0561 -12.0561 -12.0561 -12.0561 -11.1862 -11.1862 -11.1862 -11.1862 -11.1213 -11.1213 -11.1213 -11.1213 -0.6403 -0.6403 -0.6401 -0.6401 0.0879 0.0879 0.0898 0.0898 0.7687 0.7687 0.7703 0.7703 1.0710 1.0710 1.0713 1.0713 1.3383 1.3383 1.3384 1.3384 2.2601 2.2601 2.2617 2.2617 3.1947 3.1947 3.2016 3.2016 3.3347 3.3347 3.3429 3.3429 3.6284 3.6284 3.6308 3.6308 4.2150 4.2150 4.2176 4.2176 4.4289 4.4289 4.4311 4.4311 4.8601 4.8601 4.8602 4.8602 15.4674 15.4674 15.4677 15.4677 16.0766 16.0766 16.0787 16.0787 k = 0.5000 0.0807-0.0000 ( 4328 PWs) bands (ev): -12.1229 -12.1229 -12.1229 -12.1229 -12.0519 -12.0519 -12.0518 -12.0518 -11.1906 -11.1906 -11.1906 -11.1906 -11.1264 -11.1264 -11.1264 -11.1264 -0.6514 -0.6514 -0.6511 -0.6511 0.0716 0.0716 0.0736 0.0736 0.7779 0.7779 0.7795 0.7795 1.0499 1.0499 1.0505 1.0505 1.3484 1.3484 1.3485 1.3485 2.2750 2.2750 2.2768 2.2768 3.1938 3.1938 3.2012 3.2012 3.3349 3.3349 3.3437 3.3437 3.6392 3.6392 3.6419 3.6419 4.2211 4.2211 4.2238 4.2238 4.4355 4.4355 4.4379 4.4379 4.8647 4.8647 4.8647 4.8647 15.4616 15.4616 15.4619 15.4619 16.0438 16.0438 16.0458 16.0458 k = 0.5000 0.0896-0.0000 ( 4324 PWs) bands (ev): -12.1175 -12.1175 -12.1174 -12.1174 -12.0472 -12.0472 -12.0471 -12.0471 -11.1955 -11.1955 -11.1955 -11.1955 -11.1320 -11.1320 -11.1320 -11.1320 -0.6630 -0.6630 -0.6627 -0.6627 0.0543 0.0543 0.0565 0.0565 0.7873 0.7873 0.7889 0.7889 1.0258 1.0258 1.0266 1.0266 1.3612 1.3612 1.3615 1.3615 2.2887 2.2887 2.2908 2.2908 3.1960 3.1960 3.2039 3.2039 3.3340 3.3340 3.3434 3.3434 3.6521 3.6521 3.6552 3.6552 4.2265 4.2265 4.2294 4.2294 4.4420 4.4420 4.4447 4.4447 4.8697 4.8697 4.8697 4.8697 15.4548 15.4548 15.4552 15.4552 16.0142 16.0142 16.0160 16.0160 k = 0.5000 0.0986-0.0000 ( 4316 PWs) bands (ev): -12.1116 -12.1116 -12.1115 -12.1115 -12.0421 -12.0421 -12.0420 -12.0420 -11.2009 -11.2009 -11.2009 -11.2009 -11.1381 -11.1381 -11.1381 -11.1381 -0.6750 -0.6750 -0.6747 -0.6747 0.0363 0.0363 0.0385 0.0385 0.7965 0.7965 0.7980 0.7980 0.9996 0.9996 1.0006 1.0006 1.3764 1.3764 1.3768 1.3768 2.3007 2.3007 2.3031 2.3031 3.2014 3.2014 3.2097 3.2097 3.3324 3.3324 3.3424 3.3424 3.6671 3.6671 3.6705 3.6705 4.2311 4.2311 4.2342 4.2342 4.4485 4.4485 4.4514 4.4514 4.8751 4.8751 4.8751 4.8751 15.4470 15.4470 15.4476 15.4476 15.9880 15.9880 15.9896 15.9896 k = 0.5000 0.1076-0.0000 ( 4320 PWs) bands (ev): -12.1052 -12.1052 -12.1052 -12.1052 -12.0366 -12.0366 -12.0365 -12.0365 -11.2067 -11.2067 -11.2067 -11.2067 -11.1446 -11.1446 -11.1446 -11.1446 -0.6872 -0.6872 -0.6869 -0.6869 0.0178 0.0178 0.0200 0.0200 0.8047 0.8047 0.8060 0.8060 0.9727 0.9727 0.9739 0.9739 1.3931 1.3931 1.3936 1.3936 2.3107 2.3107 2.3132 2.3132 3.2101 3.2101 3.2188 3.2188 3.3308 3.3308 3.3412 3.3412 3.6839 3.6839 3.6876 3.6876 4.2347 4.2347 4.2379 4.2379 4.4546 4.4546 4.4578 4.4578 4.8808 4.8808 4.8809 4.8809 15.4386 15.4386 15.4392 15.4392 15.9652 15.9652 15.9666 15.9666 k = 0.5000 0.1165-0.0000 ( 4324 PWs) bands (ev): -12.0984 -12.0984 -12.0984 -12.0984 -12.0307 -12.0307 -12.0306 -12.0306 -11.2129 -11.2129 -11.2128 -11.2128 -11.1516 -11.1516 -11.1516 -11.1516 -0.6995 -0.6995 -0.6992 -0.6992 -0.0011 -0.0011 0.0011 0.0011 0.8107 0.8107 0.8117 0.8117 0.9467 0.9467 0.9482 0.9482 1.4108 1.4108 1.4115 1.4115 2.3183 2.3183 2.3209 2.3209 3.2221 3.2221 3.2311 3.2311 3.3299 3.3299 3.3406 3.3406 3.7023 3.7023 3.7063 3.7063 4.2373 4.2373 4.2405 4.2405 4.4602 4.4602 4.4636 4.4636 4.8868 4.8868 4.8868 4.8868 15.4296 15.4296 15.4304 15.4304 15.9456 15.9456 15.9469 15.9469 k = 0.5000 0.1255-0.0000 ( 4320 PWs) bands (ev): -12.0912 -12.0912 -12.0912 -12.0912 -12.0245 -12.0245 -12.0244 -12.0244 -11.2194 -11.2194 -11.2194 -11.2194 -11.1589 -11.1589 -11.1589 -11.1589 -0.7116 -0.7116 -0.7113 -0.7113 -0.0203 -0.0203 -0.0181 -0.0181 0.8119 0.8119 0.8126 0.8126 0.9246 0.9246 0.9264 0.9264 1.4292 1.4292 1.4300 1.4300 2.3232 2.3232 2.3259 2.3259 3.2371 3.2371 3.2460 3.2460 3.3303 3.3303 3.3411 3.3411 3.7222 3.7222 3.7264 3.7264 4.2388 4.2388 4.2421 4.2421 4.4651 4.4651 4.4686 4.4686 4.8927 4.8927 4.8927 4.8927 15.4206 15.4206 15.4215 15.4215 15.9292 15.9292 15.9302 15.9302 k = 0.5000 0.1345-0.0000 ( 4320 PWs) bands (ev): -12.0836 -12.0836 -12.0836 -12.0836 -12.0180 -12.0180 -12.0179 -12.0179 -11.2263 -11.2263 -11.2263 -11.2263 -11.1666 -11.1666 -11.1666 -11.1666 -0.7236 -0.7236 -0.7233 -0.7233 -0.0396 -0.0396 -0.0375 -0.0375 0.8047 0.8047 0.8051 0.8051 0.9104 0.9104 0.9125 0.9125 1.4479 1.4479 1.4486 1.4486 2.3254 2.3254 2.3282 2.3282 3.2546 3.2546 3.2631 3.2631 3.3331 3.3331 3.3434 3.3434 3.7433 3.7433 3.7476 3.7476 4.2394 4.2394 4.2426 4.2426 4.4690 4.4690 4.4727 4.4727 4.8986 4.8986 4.8986 4.8986 15.4118 15.4118 15.4128 15.4128 15.9154 15.9154 15.9163 15.9163 k = 0.5000 0.1434-0.0000 ( 4324 PWs) bands (ev): -12.0757 -12.0757 -12.0757 -12.0757 -12.0112 -12.0112 -12.0111 -12.0111 -11.2336 -11.2336 -11.2336 -11.2336 -11.1746 -11.1746 -11.1746 -11.1746 -0.7351 -0.7351 -0.7348 -0.7348 -0.0589 -0.0589 -0.0568 -0.0568 0.7873 0.7873 0.7876 0.7876 0.9061 0.9061 0.9082 0.9082 1.4665 1.4665 1.4673 1.4673 2.3249 2.3249 2.3276 2.3276 3.2739 3.2739 3.2808 3.2808 3.3396 3.3396 3.3485 3.3485 3.7652 3.7652 3.7698 3.7698 4.2391 4.2391 4.2422 4.2422 4.4719 4.4719 4.4757 4.4757 4.9041 4.9041 4.9041 4.9041 15.4038 15.4038 15.4049 15.4049 15.9039 15.9039 15.9046 15.9046 k = 0.5000 0.1524-0.0000 ( 4314 PWs) bands (ev): -12.0676 -12.0676 -12.0676 -12.0676 -12.0042 -12.0042 -12.0041 -12.0041 -11.2411 -11.2411 -11.2411 -11.2411 -11.1828 -11.1828 -11.1828 -11.1828 -0.7462 -0.7462 -0.7459 -0.7459 -0.0780 -0.0780 -0.0760 -0.0760 0.7625 0.7625 0.7628 0.7628 0.9091 0.9091 0.9110 0.9110 1.4850 1.4850 1.4858 1.4858 2.3216 2.3216 2.3242 2.3242 3.2938 3.2938 3.2974 3.2974 3.3516 3.3516 3.3573 3.3573 3.7878 3.7878 3.7926 3.7926 4.2382 4.2382 4.2411 4.2411 4.4735 4.4735 4.4774 4.4774 4.9092 4.9092 4.9092 4.9092 15.3968 15.3968 15.3981 15.3981 15.8941 15.8941 15.8947 15.8947 k = 0.5000 0.1614-0.0000 ( 4314 PWs) bands (ev): -12.0592 -12.0592 -12.0591 -12.0591 -11.9970 -11.9970 -11.9969 -11.9969 -11.2488 -11.2488 -11.2488 -11.2488 -11.1912 -11.1912 -11.1912 -11.1912 -0.7568 -0.7568 -0.7564 -0.7564 -0.0970 -0.0970 -0.0950 -0.0950 0.7339 0.7339 0.7342 0.7342 0.9159 0.9159 0.9177 0.9177 1.5032 1.5032 1.5040 1.5040 2.3156 2.3156 2.3182 2.3182 3.3118 3.3118 3.3129 3.3129 3.3702 3.3702 3.3713 3.3713 3.8107 3.8107 3.8157 3.8157 4.2369 4.2369 4.2395 4.2395 4.4737 4.4737 4.4777 4.4777 4.9136 4.9136 4.9137 4.9137 15.3914 15.3914 15.3927 15.3927 15.8858 15.8858 15.8861 15.8861 k = 0.5000 0.1703-0.0000 ( 4306 PWs) bands (ev): -12.0506 -12.0506 -12.0505 -12.0505 -11.9897 -11.9897 -11.9896 -11.9896 -11.2568 -11.2568 -11.2568 -11.2568 -11.1998 -11.1998 -11.1997 -11.1997 -0.7666 -0.7666 -0.7663 -0.7663 -0.1155 -0.1155 -0.1136 -0.1136 0.7036 0.7036 0.7040 0.7040 0.9246 0.9246 0.9262 0.9262 1.5211 1.5211 1.5219 1.5219 2.3071 2.3071 2.3095 2.3095 3.3248 3.3248 3.3303 3.3303 3.3911 3.3911 3.3943 3.3943 3.8334 3.8334 3.8387 3.8387 4.2357 4.2357 4.2380 4.2380 4.4724 4.4724 4.4765 4.4765 4.9172 4.9172 4.9173 4.9173 15.3877 15.3877 15.3891 15.3891 15.8783 15.8783 15.8786 15.8786 k = 0.5000 0.1793-0.0000 ( 4320 PWs) bands (ev): -12.0418 -12.0418 -12.0418 -12.0418 -11.9823 -11.9823 -11.9822 -11.9822 -11.2649 -11.2649 -11.2649 -11.2649 -11.2084 -11.2084 -11.2084 -11.2084 -0.7758 -0.7758 -0.7755 -0.7755 -0.1337 -0.1337 -0.1319 -0.1319 0.6730 0.6730 0.6734 0.6734 0.9340 0.9340 0.9355 0.9355 1.5387 1.5387 1.5395 1.5395 2.2962 2.2962 2.2984 2.2984 3.3379 3.3379 3.3466 3.3466 3.4157 3.4157 3.4220 3.4220 3.8554 3.8554 3.8610 3.8610 4.2351 4.2351 4.2370 4.2370 4.4696 4.4696 4.4737 4.4737 4.9197 4.9197 4.9199 4.9199 15.3861 15.3861 15.3875 15.3875 15.8715 15.8715 15.8715 15.8715 k = 0.5000 0.1883-0.0000 ( 4324 PWs) bands (ev): -12.0330 -12.0330 -12.0330 -12.0330 -11.9748 -11.9748 -11.9747 -11.9747 -11.2731 -11.2731 -11.2730 -11.2730 -11.2170 -11.2170 -11.2170 -11.2170 -0.7843 -0.7843 -0.7840 -0.7840 -0.1513 -0.1513 -0.1496 -0.1496 0.6427 0.6427 0.6431 0.6431 0.9435 0.9435 0.9448 0.9448 1.5562 1.5562 1.5569 1.5569 2.2830 2.2830 2.2850 2.2850 3.3522 3.3522 3.3630 3.3630 3.4436 3.4436 3.4519 3.4519 3.8759 3.8759 3.8819 3.8819 4.2357 4.2357 4.2370 4.2370 4.4650 4.4650 4.4691 4.4691 4.9212 4.9212 4.9213 4.9213 15.3867 15.3867 15.3882 15.3882 15.8647 15.8647 15.8648 15.8648 k = 0.5000 0.1972-0.0000 ( 4328 PWs) bands (ev): -12.0242 -12.0242 -12.0242 -12.0242 -11.9674 -11.9674 -11.9673 -11.9673 -11.2813 -11.2813 -11.2813 -11.2813 -11.2256 -11.2256 -11.2256 -11.2256 -0.7920 -0.7920 -0.7917 -0.7917 -0.1684 -0.1684 -0.1668 -0.1668 0.6131 0.6131 0.6136 0.6136 0.9528 0.9528 0.9540 0.9540 1.5736 1.5736 1.5743 1.5743 2.2676 2.2676 2.2694 2.2694 3.3683 3.3683 3.3804 3.3804 3.4735 3.4735 3.4831 3.4831 3.8942 3.8942 3.9006 3.9006 4.2381 4.2381 4.2389 4.2389 4.4589 4.4589 4.4629 4.4629 4.9214 4.9214 4.9215 4.9215 15.3896 15.3896 15.3911 15.3911 15.8579 15.8579 15.8580 15.8580 k = 0.5000 0.2062-0.0000 ( 4324 PWs) bands (ev): -12.0155 -12.0155 -12.0155 -12.0155 -11.9600 -11.9600 -11.9599 -11.9599 -11.2895 -11.2895 -11.2894 -11.2894 -11.2341 -11.2341 -11.2341 -11.2341 -0.7988 -0.7988 -0.7986 -0.7986 -0.1848 -0.1848 -0.1833 -0.1833 0.5846 0.5846 0.5851 0.5851 0.9616 0.9616 0.9626 0.9626 1.5911 1.5911 1.5918 1.5918 2.2502 2.2502 2.2518 2.2518 3.3861 3.3861 3.3992 3.3992 3.5046 3.5046 3.5152 3.5152 3.9095 3.9095 3.9162 3.9162 4.2433 4.2433 4.2434 4.2434 4.4511 4.4511 4.4551 4.4551 4.9202 4.9202 4.9204 4.9204 15.3948 15.3948 15.3964 15.3964 15.8507 15.8507 15.8510 15.8510 k = 0.5000 0.2152-0.0000 ( 4332 PWs) bands (ev): -12.0069 -12.0069 -12.0069 -12.0069 -11.9528 -11.9528 -11.9527 -11.9527 -11.2975 -11.2975 -11.2975 -11.2975 -11.2424 -11.2424 -11.2423 -11.2423 -0.8050 -0.8050 -0.8047 -0.8047 -0.2005 -0.2005 -0.1991 -0.1991 0.5575 0.5575 0.5579 0.5579 0.9698 0.9698 0.9707 0.9707 1.6089 1.6089 1.6095 1.6095 2.2311 2.2311 2.2325 2.2325 3.4057 3.4057 3.4195 3.4195 3.5363 3.5363 3.5476 3.5476 3.9209 3.9209 3.9280 3.9280 4.2510 4.2510 4.2516 4.2516 4.4418 4.4418 4.4456 4.4456 4.9176 4.9176 4.9178 4.9178 15.4024 15.4024 15.4040 15.4040 15.8429 15.8429 15.8433 15.8433 k = 0.5000 0.2241-0.0000 ( 4332 PWs) bands (ev): -11.9985 -11.9985 -11.9985 -11.9985 -11.9458 -11.9458 -11.9457 -11.9457 -11.3054 -11.3054 -11.3054 -11.3054 -11.2504 -11.2504 -11.2503 -11.2503 -0.8103 -0.8103 -0.8100 -0.8100 -0.2154 -0.2154 -0.2140 -0.2140 0.5319 0.5319 0.5323 0.5323 0.9773 0.9773 0.9781 0.9781 1.6271 1.6271 1.6276 1.6276 2.2104 2.2104 2.2116 2.2116 3.4269 3.4269 3.4411 3.4411 3.5682 3.5682 3.5800 3.5800 3.9280 3.9280 3.9354 3.9354 4.2621 4.2621 4.2634 4.2634 4.4311 4.4311 4.4346 4.4346 4.9136 4.9136 4.9138 4.9138 15.4122 15.4122 15.4138 15.4138 15.8344 15.8344 15.8349 15.8349 k = 0.5000 0.2331-0.0000 ( 4332 PWs) bands (ev): -11.9904 -11.9904 -11.9904 -11.9904 -11.9390 -11.9390 -11.9390 -11.9390 -11.3131 -11.3131 -11.3130 -11.3130 -11.2580 -11.2580 -11.2580 -11.2580 -0.8149 -0.8149 -0.8147 -0.8147 -0.2293 -0.2293 -0.2281 -0.2281 0.5080 0.5080 0.5084 0.5084 0.9840 0.9840 0.9846 0.9846 1.6458 1.6458 1.6462 1.6462 2.1883 2.1883 2.1894 2.1894 3.4493 3.4493 3.4638 3.4638 3.5999 3.5999 3.6121 3.6121 3.9308 3.9308 3.9383 3.9383 4.2765 4.2765 4.2786 4.2786 4.4193 4.4193 4.4224 4.4224 4.9082 4.9082 4.9084 4.9084 15.4241 15.4241 15.4257 15.4257 15.8250 15.8250 15.8256 15.8256 k = 0.5000 0.2420-0.0000 ( 4336 PWs) bands (ev): -11.9827 -11.9827 -11.9827 -11.9827 -11.9327 -11.9327 -11.9326 -11.9326 -11.3204 -11.3204 -11.3203 -11.3203 -11.2652 -11.2652 -11.2652 -11.2652 -0.8188 -0.8188 -0.8186 -0.8186 -0.2423 -0.2423 -0.2412 -0.2412 0.4860 0.4860 0.4863 0.4863 0.9899 0.9899 0.9904 0.9904 1.6650 1.6650 1.6654 1.6654 2.1650 2.1650 2.1660 2.1660 3.4727 3.4727 3.4872 3.4872 3.6312 3.6312 3.6437 3.6437 3.9295 3.9295 3.9370 3.9370 4.2934 4.2934 4.2964 4.2964 4.4070 4.4070 4.4094 4.4094 4.9015 4.9015 4.9016 4.9016 15.4379 15.4379 15.4395 15.4395 15.8147 15.8147 15.8155 15.8155 k = 0.5000 0.2510-0.0000 ( 4336 PWs) bands (ev): -11.9755 -11.9755 -11.9754 -11.9754 -11.9267 -11.9267 -11.9266 -11.9266 -11.3272 -11.3272 -11.3272 -11.3272 -11.2720 -11.2720 -11.2719 -11.2719 -0.8220 -0.8220 -0.8218 -0.8218 -0.2542 -0.2542 -0.2533 -0.2533 0.4660 0.4660 0.4663 0.4663 0.9949 0.9949 0.9954 0.9954 1.6849 1.6849 1.6852 1.6852 2.1410 2.1410 2.1418 2.1418 3.4966 3.4966 3.5111 3.5111 3.6617 3.6617 3.6743 3.6743 3.9246 3.9246 3.9319 3.9319 4.3110 4.3110 4.3153 4.3153 4.3954 4.3954 4.3964 4.3964 4.8935 4.8935 4.8937 4.8937 15.4533 15.4533 15.4549 15.4549 15.8035 15.8035 15.8043 15.8043 k = 0.5000 0.2600-0.0000 ( 4332 PWs) bands (ev): -11.9688 -11.9688 -11.9688 -11.9688 -11.9212 -11.9212 -11.9212 -11.9212 -11.3336 -11.3336 -11.3335 -11.3335 -11.2781 -11.2781 -11.2781 -11.2781 -0.8247 -0.8247 -0.8245 -0.8245 -0.2650 -0.2650 -0.2642 -0.2642 0.4481 0.4481 0.4484 0.4484 0.9992 0.9992 0.9996 0.9996 1.7053 1.7053 1.7056 1.7056 2.1163 2.1163 2.1170 2.1170 3.5206 3.5206 3.5349 3.5349 3.6909 3.6909 3.7036 3.7036 3.9170 3.9170 3.9238 3.9238 4.3257 4.3257 4.3322 4.3322 4.3861 4.3861 4.3873 4.3873 4.8846 4.8846 4.8848 4.8848 15.4700 15.4700 15.4716 15.4716 15.7913 15.7913 15.7922 15.7922 k = 0.5000 0.2689-0.0000 ( 4332 PWs) bands (ev): -11.9628 -11.9628 -11.9628 -11.9628 -11.9163 -11.9163 -11.9162 -11.9162 -11.3393 -11.3393 -11.3393 -11.3393 -11.2836 -11.2836 -11.2836 -11.2836 -0.8268 -0.8268 -0.8266 -0.8266 -0.2746 -0.2746 -0.2739 -0.2739 0.4324 0.4324 0.4326 0.4326 1.0028 1.0028 1.0031 1.0031 1.7261 1.7261 1.7263 1.7263 2.0914 2.0914 2.0920 2.0920 3.5443 3.5443 3.5581 3.5581 3.7185 3.7185 3.7311 3.7311 3.9075 3.9075 3.9136 3.9136 4.3312 4.3312 4.3393 4.3393 4.3856 4.3856 4.3887 4.3887 4.8751 4.8751 4.8752 4.8752 15.4877 15.4877 15.4892 15.4892 15.7784 15.7784 15.7793 15.7793 k = 0.5000 0.2779-0.0000 ( 4320 PWs) bands (ev): -11.9576 -11.9576 -11.9575 -11.9575 -11.9120 -11.9120 -11.9120 -11.9120 -11.3443 -11.3443 -11.3443 -11.3443 -11.2884 -11.2884 -11.2884 -11.2884 -0.8284 -0.8284 -0.8283 -0.8283 -0.2828 -0.2828 -0.2822 -0.2822 0.4190 0.4190 0.4192 0.4192 1.0056 1.0056 1.0059 1.0059 1.7471 1.7471 1.7473 1.7473 2.0668 2.0668 2.0673 2.0673 3.5672 3.5672 3.5801 3.5801 3.7438 3.7438 3.7562 3.7562 3.8969 3.8969 3.9020 3.9020 4.3257 4.3257 4.3329 4.3329 4.3982 4.3982 4.4007 4.4007 4.8653 4.8653 4.8654 4.8654 15.5057 15.5057 15.5071 15.5071 15.7649 15.7649 15.7658 15.7658 k = 0.5000 0.2869-0.0000 ( 4324 PWs) bands (ev): -11.9531 -11.9531 -11.9531 -11.9531 -11.9084 -11.9084 -11.9084 -11.9084 -11.3485 -11.3485 -11.3485 -11.3485 -11.2925 -11.2925 -11.2924 -11.2924 -0.8297 -0.8297 -0.8296 -0.8296 -0.2897 -0.2897 -0.2892 -0.2892 0.4080 0.4080 0.4081 0.4081 1.0079 1.0079 1.0081 1.0081 1.7677 1.7677 1.7678 1.7678 2.0430 2.0430 2.0434 2.0434 3.5885 3.5885 3.6002 3.6002 3.7661 3.7661 3.7781 3.7781 3.8862 3.8862 3.8899 3.8899 4.3157 4.3157 4.3214 4.3214 4.4149 4.4149 4.4165 4.4165 4.8558 4.8558 4.8559 4.8559 15.5234 15.5234 15.5247 15.5247 15.7513 15.7513 15.7522 15.7522 k = 0.5000 0.2958-0.0000 ( 4324 PWs) bands (ev): -11.9496 -11.9496 -11.9496 -11.9496 -11.9055 -11.9055 -11.9055 -11.9055 -11.3519 -11.3519 -11.3519 -11.3519 -11.2956 -11.2956 -11.2956 -11.2956 -0.8306 -0.8306 -0.8305 -0.8305 -0.2951 -0.2951 -0.2948 -0.2948 0.3993 0.3993 0.3994 0.3994 1.0095 1.0095 1.0097 1.0097 1.7871 1.7871 1.7872 1.7872 2.0210 2.0210 2.0213 2.0213 3.6075 3.6075 3.6174 3.6174 3.7846 3.7846 3.7958 3.7958 3.8766 3.8766 3.8784 3.8784 4.3056 4.3056 4.3098 4.3098 4.4306 4.4306 4.4316 4.4316 4.8473 4.8473 4.8474 4.8474 15.5399 15.5399 15.5411 15.5411 15.7382 15.7382 15.7391 15.7391 k = 0.5000 0.3048-0.0000 ( 4324 PWs) bands (ev): -11.9470 -11.9470 -11.9470 -11.9470 -11.9034 -11.9034 -11.9034 -11.9034 -11.3544 -11.3544 -11.3544 -11.3544 -11.2979 -11.2979 -11.2979 -11.2979 -0.8312 -0.8312 -0.8311 -0.8311 -0.2990 -0.2990 -0.2988 -0.2988 0.3931 0.3931 0.3932 0.3932 1.0107 1.0107 1.0108 1.0108 1.8039 1.8039 1.8040 1.8040 2.0022 2.0022 2.0025 2.0025 3.6231 3.6231 3.6304 3.6304 3.7987 3.7987 3.8081 3.8081 3.8690 3.8690 3.8691 3.8691 4.2973 4.2973 4.3002 4.3002 4.4431 4.4431 4.4437 4.4437 4.8405 4.8405 4.8405 4.8405 15.5540 15.5540 15.5548 15.5548 15.7270 15.7270 15.7276 15.7276 k = 0.5000 0.3138-0.0000 ( 4328 PWs) bands (ev): -11.9455 -11.9455 -11.9455 -11.9455 -11.9022 -11.9022 -11.9022 -11.9022 -11.3559 -11.3559 -11.3559 -11.3559 -11.2993 -11.2993 -11.2993 -11.2993 -0.8315 -0.8315 -0.8315 -0.8315 -0.3013 -0.3013 -0.3012 -0.3012 0.3894 0.3894 0.3894 0.3894 1.0114 1.0114 1.0114 1.0114 1.8160 1.8160 1.8160 1.8160 1.9891 1.9891 1.9892 1.9892 3.6342 3.6342 3.6381 3.6381 3.8082 3.8082 3.8139 3.8139 3.8636 3.8636 3.8641 3.8641 4.2922 4.2922 4.2936 4.2936 4.4512 4.4512 4.4514 4.4514 4.8360 4.8360 4.8360 4.8360 15.5638 15.5638 15.5642 15.5642 15.7191 15.7191 15.7195 15.7195 k = 0.5000 0.3227-0.0000 ( 4312 PWs) bands (ev): -11.9450 -11.9450 -11.9450 -11.9450 -11.9017 -11.9017 -11.9017 -11.9017 -11.3564 -11.3564 -11.3564 -11.3564 -11.2998 -11.2998 -11.2998 -11.2998 -0.8316 -0.8316 -0.8316 -0.8316 -0.3021 -0.3021 -0.3021 -0.3021 0.3882 0.3882 0.3882 0.3882 1.0116 1.0116 1.0116 1.0116 1.8205 1.8205 1.8205 1.8205 1.9843 1.9843 1.9843 1.9843 3.6394 3.6394 3.6394 3.6394 3.8135 3.8135 3.8135 3.8135 3.8622 3.8622 3.8622 3.8622 4.2909 4.2909 4.2909 4.2909 4.4540 4.4540 4.4540 4.4540 4.8345 4.8345 4.8345 4.8345 15.5675 15.5675 15.5675 15.5675 15.7163 15.7163 15.7163 15.7163 k = 0.5000 0.3227-0.0000 ( 4312 PWs) bands (ev): -11.9450 -11.9450 -11.9450 -11.9450 -11.9017 -11.9017 -11.9017 -11.9017 -11.3564 -11.3564 -11.3564 -11.3564 -11.2998 -11.2998 -11.2998 -11.2998 -0.8316 -0.8316 -0.8316 -0.8316 -0.3021 -0.3021 -0.3021 -0.3021 0.3882 0.3882 0.3882 0.3882 1.0116 1.0116 1.0116 1.0116 1.8205 1.8205 1.8205 1.8205 1.9843 1.9843 1.9843 1.9843 3.6394 3.6394 3.6394 3.6394 3.8135 3.8135 3.8135 3.8135 3.8622 3.8622 3.8622 3.8622 4.2909 4.2909 4.2909 4.2909 4.4540 4.4540 4.4540 4.4540 4.8345 4.8345 4.8345 4.8345 15.5675 15.5675 15.5675 15.5675 15.7163 15.7163 15.7163 15.7163 k = 0.4911 0.3227-0.0000 ( 4332 PWs) bands (ev): -11.9483 -11.9483 -11.9479 -11.9479 -11.9009 -11.9009 -11.9005 -11.9005 -11.3574 -11.3574 -11.3573 -11.3573 -11.2985 -11.2985 -11.2985 -11.2985 -0.8302 -0.8302 -0.8302 -0.8302 -0.3008 -0.3008 -0.3008 -0.3008 0.3895 0.3895 0.3896 0.3896 1.0128 1.0128 1.0129 1.0129 1.8056 1.8056 1.8119 1.8119 1.9927 1.9927 1.9990 1.9990 3.6383 3.6383 3.6389 3.6389 3.8131 3.8131 3.8140 3.8140 3.8612 3.8612 3.8625 3.8625 4.2911 4.2911 4.2918 4.2918 4.4535 4.4535 4.4542 4.4542 4.8348 4.8348 4.8351 4.8351 15.5684 15.5684 15.5685 15.5685 15.7171 15.7171 15.7173 15.7173 k = 0.4821 0.3227-0.0000 ( 4336 PWs) bands (ev): -11.9570 -11.9570 -11.9562 -11.9562 -11.8988 -11.8988 -11.8981 -11.8981 -11.3603 -11.3603 -11.3601 -11.3601 -11.2949 -11.2949 -11.2948 -11.2948 -0.8259 -0.8259 -0.8259 -0.8259 -0.2969 -0.2969 -0.2969 -0.2969 0.3936 0.3936 0.3938 0.3938 1.0165 1.0165 1.0167 1.0167 1.7755 1.7755 1.7852 1.7852 2.0190 2.0190 2.0287 2.0287 3.6355 3.6355 3.6367 3.6367 3.8127 3.8127 3.8146 3.8146 3.8594 3.8594 3.8620 3.8620 4.2926 4.2926 4.2940 4.2940 4.4526 4.4526 4.4540 4.4540 4.8361 4.8361 4.8366 4.8366 15.5713 15.5713 15.5714 15.5714 15.7196 15.7196 15.7201 15.7201 k = 0.4732 0.3227-0.0000 ( 4336 PWs) bands (ev): -11.9694 -11.9694 -11.9686 -11.9686 -11.8968 -11.8968 -11.8960 -11.8960 -11.3645 -11.3645 -11.3642 -11.3642 -11.2893 -11.2893 -11.2892 -11.2892 -0.8188 -0.8188 -0.8187 -0.8187 -0.2905 -0.2905 -0.2905 -0.2905 0.4003 0.4003 0.4006 0.4006 1.0225 1.0225 1.0229 1.0229 1.7385 1.7385 1.7497 1.7497 2.0539 2.0539 2.0651 2.0651 3.6312 3.6312 3.6329 3.6329 3.8122 3.8122 3.8151 3.8151 3.8573 3.8573 3.8611 3.8611 4.2952 4.2952 4.2973 4.2973 4.4513 4.4513 4.4534 4.4534 4.8383 4.8383 4.8390 4.8390 15.5762 15.5762 15.5763 15.5763 15.7239 15.7239 15.7246 15.7246 k = 0.4643 0.3227-0.0000 ( 4340 PWs) bands (ev): -11.9848 -11.9848 -11.9839 -11.9839 -11.8957 -11.8957 -11.8948 -11.8948 -11.3697 -11.3697 -11.3694 -11.3694 -11.2823 -11.2823 -11.2822 -11.2822 -0.8089 -0.8089 -0.8088 -0.8088 -0.2816 -0.2816 -0.2815 -0.2815 0.4098 0.4098 0.4102 0.4102 1.0310 1.0310 1.0314 1.0314 1.6988 1.6988 1.7108 1.7108 2.0922 2.0922 2.1042 2.1042 3.6253 3.6253 3.6276 3.6276 3.8111 3.8111 3.8149 3.8149 3.8553 3.8553 3.8602 3.8602 4.2990 4.2990 4.3017 4.3017 4.4497 4.4497 4.4524 4.4524 4.8414 4.8414 4.8423 4.8423 15.5828 15.5828 15.5829 15.5829 15.7299 15.7299 15.7308 15.7308 k = 0.4554 0.3227-0.0000 ( 4332 PWs) bands (ev): -12.0026 -12.0026 -12.0017 -12.0017 -11.8959 -11.8959 -11.8950 -11.8950 -11.3756 -11.3756 -11.3753 -11.3753 -11.2743 -11.2743 -11.2742 -11.2742 -0.7963 -0.7963 -0.7962 -0.7962 -0.2702 -0.2702 -0.2701 -0.2701 0.4217 0.4217 0.4223 0.4223 1.0416 1.0416 1.0421 1.0421 1.6583 1.6583 1.6707 1.6707 2.1318 2.1318 2.1442 2.1442 3.6179 3.6179 3.6209 3.6209 3.8091 3.8091 3.8134 3.8134 3.8542 3.8542 3.8599 3.8599 4.3037 4.3037 4.3070 4.3070 4.4479 4.4479 4.4512 4.4512 4.8452 4.8452 4.8464 4.8464 15.5911 15.5911 15.5913 15.5913 15.7375 15.7375 15.7386 15.7386 k = 0.4464 0.3227-0.0000 ( 4336 PWs) bands (ev): -12.0225 -12.0225 -12.0215 -12.0215 -11.8975 -11.8975 -11.8967 -11.8967 -11.3822 -11.3822 -11.3818 -11.3818 -11.2656 -11.2656 -11.2654 -11.2654 -0.7810 -0.7810 -0.7808 -0.7808 -0.2564 -0.2564 -0.2563 -0.2563 0.4362 0.4362 0.4368 0.4368 1.0543 1.0543 1.0549 1.0549 1.6180 1.6180 1.6307 1.6307 2.1717 2.1717 2.1844 2.1844 3.6092 3.6092 3.6127 3.6127 3.8056 3.8056 3.8100 3.8100 3.8547 3.8547 3.8606 3.8606 4.3092 4.3092 4.3130 4.3130 4.4458 4.4458 4.4497 4.4497 4.8499 4.8499 4.8512 4.8512 15.6009 15.6009 15.6011 15.6011 15.7466 15.7466 15.7480 15.7480 k = 0.4375 0.3227-0.0000 ( 4320 PWs) bands (ev): -12.0442 -12.0442 -12.0432 -12.0432 -11.9006 -11.9006 -11.8998 -11.8998 -11.3893 -11.3893 -11.3889 -11.3889 -11.2563 -11.2563 -11.2562 -11.2562 -0.7631 -0.7631 -0.7628 -0.7628 -0.2403 -0.2403 -0.2402 -0.2402 0.4530 0.4530 0.4537 0.4537 1.0688 1.0688 1.0695 1.0695 1.5788 1.5788 1.5918 1.5918 2.2114 2.2114 2.2243 2.2243 3.5993 3.5993 3.6033 3.6033 3.8006 3.8006 3.8046 3.8046 3.8571 3.8571 3.8627 3.8627 4.3155 4.3155 4.3198 4.3198 4.4435 4.4435 4.4479 4.4479 4.8552 4.8552 4.8567 4.8567 15.6121 15.6121 15.6123 15.6123 15.7572 15.7572 15.7588 15.7588 k = 0.4286 0.3227-0.0000 ( 4320 PWs) bands (ev): -12.0675 -12.0675 -12.0666 -12.0666 -11.9051 -11.9051 -11.9043 -11.9043 -11.3969 -11.3969 -11.3965 -11.3965 -11.2467 -11.2467 -11.2466 -11.2466 -0.7426 -0.7426 -0.7424 -0.7424 -0.2220 -0.2220 -0.2218 -0.2218 0.4719 0.4719 0.4728 0.4728 1.0847 1.0847 1.0856 1.0856 1.5414 1.5414 1.5546 1.5546 2.2506 2.2506 2.2636 2.2636 3.5883 3.5883 3.5929 3.5929 3.7940 3.7940 3.7973 3.7973 3.8612 3.8612 3.8663 3.8663 4.3224 4.3224 4.3271 4.3271 4.4410 4.4410 4.4459 4.4459 4.8612 4.8612 4.8627 4.8627 15.6243 15.6243 15.6245 15.6245 15.7691 15.7691 15.7710 15.7710 k = 0.4196 0.3227-0.0000 ( 4312 PWs) bands (ev): -12.0923 -12.0923 -12.0914 -12.0914 -11.9109 -11.9109 -11.9102 -11.9102 -11.4050 -11.4050 -11.4047 -11.4047 -11.2369 -11.2369 -11.2368 -11.2368 -0.7198 -0.7198 -0.7195 -0.7195 -0.2016 -0.2016 -0.2013 -0.2013 0.4927 0.4927 0.4938 0.4938 1.1018 1.1018 1.1027 1.1027 1.5068 1.5068 1.5201 1.5201 2.2891 2.2891 2.3021 2.3021 3.5764 3.5764 3.5815 3.5815 3.7859 3.7859 3.7887 3.7887 3.8666 3.8666 3.8712 3.8712 4.3298 4.3298 4.3349 4.3349 4.4384 4.4384 4.4438 4.4438 4.8676 4.8676 4.8693 4.8693 15.6372 15.6372 15.6375 15.6375 15.7823 15.7823 15.7844 15.7844 k = 0.4107 0.3227-0.0000 ( 4308 PWs) bands (ev): -12.1184 -12.1184 -12.1176 -12.1176 -11.9179 -11.9179 -11.9173 -11.9173 -11.4137 -11.4137 -11.4133 -11.4133 -11.2271 -11.2271 -11.2271 -11.2271 -0.6947 -0.6947 -0.6944 -0.6944 -0.1792 -0.1792 -0.1789 -0.1789 0.5152 0.5152 0.5165 0.5165 1.1194 1.1194 1.1202 1.1202 1.4758 1.4758 1.4892 1.4892 2.3268 2.3268 2.3399 2.3399 3.5637 3.5637 3.5693 3.5693 3.7768 3.7768 3.7790 3.7790 3.8731 3.8731 3.8772 3.8772 4.3377 4.3377 4.3430 4.3430 4.4357 4.4357 4.4415 4.4415 4.8745 4.8745 4.8762 4.8762 15.6505 15.6505 15.6507 15.6507 15.7966 15.7966 15.7988 15.7988 k = 0.4018 0.3227-0.0000 ( 4314 PWs) bands (ev): -12.1457 -12.1457 -12.1448 -12.1448 -11.9262 -11.9262 -11.9256 -11.9256 -11.4229 -11.4229 -11.4225 -11.4225 -11.2174 -11.2174 -11.2173 -11.2173 -0.6675 -0.6675 -0.6672 -0.6672 -0.1550 -0.1550 -0.1547 -0.1547 0.5389 0.5389 0.5405 0.5405 1.1367 1.1367 1.1373 1.1373 1.4498 1.4498 1.4632 1.4632 2.3637 2.3637 2.3768 2.3768 3.5505 3.5505 3.5567 3.5567 3.7667 3.7667 3.7685 3.7685 3.8804 3.8804 3.8840 3.8840 4.3459 4.3459 4.3515 4.3515 4.4329 4.4329 4.4391 4.4391 4.8817 4.8817 4.8835 4.8835 15.6636 15.6636 15.6637 15.6637 15.8118 15.8118 15.8142 15.8142 k = 0.3929 0.3227-0.0000 ( 4318 PWs) bands (ev): -12.1739 -12.1739 -12.1731 -12.1731 -11.9355 -11.9355 -11.9349 -11.9349 -11.4325 -11.4325 -11.4322 -11.4322 -11.2078 -11.2078 -11.2078 -11.2078 -0.6384 -0.6384 -0.6380 -0.6380 -0.1293 -0.1293 -0.1290 -0.1290 0.5635 0.5635 0.5653 0.5653 1.1527 1.1527 1.1529 1.1529 1.4305 1.4305 1.4435 1.4435 2.3997 2.3997 2.4128 2.4128 3.5371 3.5371 3.5437 3.5437 3.7559 3.7559 3.7573 3.7573 3.8884 3.8884 3.8916 3.8916 4.3544 4.3544 4.3602 4.3602 4.4301 4.4301 4.4367 4.4367 4.8892 4.8892 4.8910 4.8910 15.6760 15.6760 15.6760 15.6760 15.8278 15.8278 15.8304 15.8304 k = 0.3839 0.3227-0.0000 ( 4318 PWs) bands (ev): -12.2030 -12.2030 -12.2023 -12.2023 -11.9458 -11.9458 -11.9453 -11.9453 -11.4427 -11.4427 -11.4423 -11.4423 -11.1986 -11.1986 -11.1986 -11.1986 -0.6076 -0.6076 -0.6071 -0.6071 -0.1022 -0.1022 -0.1018 -0.1018 0.5885 0.5885 0.5906 0.5906 1.1660 1.1660 1.1667 1.1667 1.4193 1.4193 1.4317 1.4317 2.4348 2.4348 2.4479 2.4479 3.5235 3.5235 3.5306 3.5306 3.7445 3.7445 3.7457 3.7457 3.8968 3.8968 3.8997 3.8997 4.3633 4.3633 4.3692 4.3692 4.4273 4.4273 4.4342 4.4342 4.8968 4.8968 4.8986 4.8986 15.6870 15.6870 15.6870 15.6870 15.8445 15.8445 15.8472 15.8472 k = 0.3750 0.3227-0.0000 ( 4310 PWs) bands (ev): -12.2328 -12.2328 -12.2321 -12.2321 -11.9571 -11.9571 -11.9566 -11.9566 -11.4533 -11.4533 -11.4529 -11.4529 -11.1897 -11.1897 -11.1897 -11.1897 -0.5752 -0.5752 -0.5747 -0.5747 -0.0740 -0.0740 -0.0736 -0.0736 0.6133 0.6133 0.6156 0.6156 1.1761 1.1761 1.1780 1.1780 1.4177 1.4177 1.4290 1.4290 2.4691 2.4691 2.4821 2.4821 3.5100 3.5100 3.5176 3.5176 3.7327 3.7327 3.7337 3.7337 3.9055 3.9055 3.9082 3.9082 4.3724 4.3724 4.3785 4.3785 4.4245 4.4245 4.4317 4.4317 4.9046 4.9046 4.9063 4.9063 15.6958 15.6958 15.6960 15.6960 15.8616 15.8616 15.8645 15.8645 k = 0.3661 0.3227-0.0000 ( 4316 PWs) bands (ev): -12.2633 -12.2633 -12.2626 -12.2626 -11.9692 -11.9692 -11.9688 -11.9688 -11.4644 -11.4644 -11.4640 -11.4640 -11.1812 -11.1812 -11.1812 -11.1812 -0.5416 -0.5416 -0.5410 -0.5410 -0.0451 -0.0451 -0.0446 -0.0446 0.6372 0.6372 0.6397 0.6397 1.1837 1.1837 1.1871 1.1871 1.4258 1.4258 1.4357 1.4357 2.5025 2.5025 2.5154 2.5154 3.4969 3.4969 3.5050 3.5050 3.7206 3.7206 3.7214 3.7214 3.9144 3.9144 3.9168 3.9168 4.3819 4.3819 4.3880 4.3880 4.4217 4.4217 4.4292 4.4292 4.9123 4.9123 4.9140 4.9140 15.7018 15.7018 15.7022 15.7022 15.8791 15.8791 15.8819 15.8819 k = 0.3571 0.3227-0.0000 ( 4316 PWs) bands (ev): -12.2942 -12.2942 -12.2935 -12.2935 -11.9820 -11.9820 -11.9817 -11.9817 -11.4759 -11.4759 -11.4755 -11.4755 -11.1732 -11.1732 -11.1732 -11.1732 -0.5072 -0.5072 -0.5065 -0.5065 -0.0156 -0.0156 -0.0151 -0.0151 0.6597 0.6597 0.6624 0.6624 1.1909 1.1909 1.1958 1.1958 1.4424 1.4424 1.4509 1.4509 2.5352 2.5352 2.5479 2.5479 3.4845 3.4845 3.4931 3.4931 3.7082 3.7082 3.7090 3.7090 3.9232 3.9232 3.9255 3.9255 4.3915 4.3915 4.3977 4.3977 4.4191 4.4191 4.4269 4.4269 4.9199 4.9199 4.9216 4.9216 15.7041 15.7041 15.7048 15.7048 15.8965 15.8965 15.8994 15.8994 k = 0.3482 0.3227-0.0000 ( 4304 PWs) bands (ev): -12.3255 -12.3255 -12.3249 -12.3249 -11.9956 -11.9956 -11.9953 -11.9953 -11.4878 -11.4878 -11.4874 -11.4874 -11.1658 -11.1658 -11.1657 -11.1657 -0.4721 -0.4721 -0.4714 -0.4714 0.0139 0.0139 0.0146 0.0146 0.6801 0.6801 0.6829 0.6829 1.2001 1.2001 1.2063 1.2063 1.4659 1.4659 1.4732 1.4732 2.5670 2.5670 2.5795 2.5795 3.4729 3.4729 3.4821 3.4821 3.6958 3.6958 3.6966 3.6966 3.9318 3.9318 3.9340 3.9340 4.4012 4.4012 4.4073 4.4073 4.4169 4.4169 4.4251 4.4251 4.9274 4.9274 4.9291 4.9291 15.7022 15.7022 15.7030 15.7030 15.9137 15.9137 15.9167 15.9167 k = 0.3393 0.3227-0.0000 ( 4294 PWs) bands (ev): -12.3570 -12.3570 -12.3564 -12.3564 -12.0098 -12.0098 -12.0095 -12.0095 -11.5000 -11.5000 -11.4996 -11.4996 -11.1588 -11.1588 -11.1587 -11.1587 -0.4369 -0.4369 -0.4362 -0.4362 0.0433 0.0433 0.0439 0.0439 0.6984 0.6984 0.7012 0.7012 1.2135 1.2135 1.2207 1.2207 1.4947 1.4947 1.5008 1.5008 2.5980 2.5980 2.6103 2.6103 3.4625 3.4625 3.4722 3.4722 3.6834 3.6834 3.6842 3.6842 3.9401 3.9401 3.9422 3.9422 4.4084 4.4084 4.4146 4.4146 4.4176 4.4176 4.4259 4.4259 4.9347 4.9347 4.9364 4.9364 15.6953 15.6953 15.6963 15.6963 15.9304 15.9304 15.9333 15.9333 k = 0.3304 0.3227-0.0000 ( 4294 PWs) bands (ev): -12.3888 -12.3888 -12.3882 -12.3882 -12.0245 -12.0245 -12.0243 -12.0243 -11.5126 -11.5126 -11.5122 -11.5122 -11.1525 -11.1525 -11.1524 -11.1524 -0.4021 -0.4021 -0.4013 -0.4013 0.0720 0.0720 0.0727 0.0727 0.7147 0.7147 0.7174 0.7174 1.2326 1.2326 1.2403 1.2403 1.5274 1.5274 1.5327 1.5327 2.6281 2.6281 2.6402 2.6402 3.4535 3.4535 3.4637 3.4637 3.6712 3.6712 3.6720 3.6720 3.9480 3.9480 3.9499 3.9499 4.4083 4.4083 4.4155 4.4155 4.4261 4.4261 4.4336 4.4336 4.9417 4.9417 4.9434 4.9434 15.6829 15.6829 15.6841 15.6841 15.9462 15.9462 15.9491 15.9491 k = 0.3214 0.3227-0.0000 ( 4310 PWs) bands (ev): -12.4206 -12.4206 -12.4201 -12.4201 -12.0398 -12.0398 -12.0396 -12.0396 -11.5255 -11.5255 -11.5251 -11.5251 -11.1467 -11.1467 -11.1466 -11.1466 -0.3683 -0.3683 -0.3673 -0.3673 0.0998 0.0998 0.1005 0.1005 0.7295 0.7295 0.7320 0.7320 1.2578 1.2578 1.2659 1.2659 1.5631 1.5631 1.5677 1.5677 2.6574 2.6574 2.6692 2.6692 3.4461 3.4461 3.4570 3.4570 3.6593 3.6593 3.6602 3.6602 3.9552 3.9552 3.9570 3.9570 4.4059 4.4059 4.4135 4.4135 4.4374 4.4374 4.4446 4.4446 4.9484 4.9484 4.9500 4.9500 15.6648 15.6648 15.6661 15.6661 15.9606 15.9606 15.9635 15.9635 k = 0.3125 0.3227-0.0000 ( 4310 PWs) bands (ev): -12.4524 -12.4524 -12.4519 -12.4519 -12.0554 -12.0554 -12.0553 -12.0553 -11.5386 -11.5386 -11.5382 -11.5382 -11.1415 -11.1415 -11.1414 -11.1414 -0.3360 -0.3360 -0.3350 -0.3350 0.1265 0.1265 0.1272 0.1272 0.7439 0.7439 0.7462 0.7462 1.2893 1.2893 1.2975 1.2975 1.6012 1.6012 1.6053 1.6053 2.6858 2.6858 2.6972 2.6972 3.4406 3.4406 3.4521 3.4521 3.6479 3.6479 3.6490 3.6490 3.9617 3.9617 3.9634 3.9634 4.4030 4.4030 4.4110 4.4110 4.4496 4.4496 4.4567 4.4567 4.9547 4.9547 4.9562 4.9562 15.6410 15.6410 15.6424 15.6424 15.9735 15.9735 15.9764 15.9764 k = 0.3036 0.3227-0.0000 ( 4310 PWs) bands (ev): -12.4842 -12.4842 -12.4837 -12.4837 -12.0714 -12.0714 -12.0713 -12.0713 -11.5519 -11.5519 -11.5516 -11.5516 -11.1369 -11.1369 -11.1368 -11.1368 -0.3060 -0.3060 -0.3050 -0.3050 0.1522 0.1522 0.1528 0.1528 0.7589 0.7589 0.7609 0.7609 1.3264 1.3264 1.3346 1.3346 1.6413 1.6413 1.6449 1.6449 2.7131 2.7131 2.7241 2.7241 3.4371 3.4371 3.4493 3.4493 3.6373 3.6373 3.6386 3.6386 3.9674 3.9674 3.9690 3.9690 4.4000 4.4000 4.4081 4.4081 4.4624 4.4624 4.4695 4.4695 4.9605 4.9605 4.9621 4.9621 15.6114 15.6114 15.6129 15.6129 15.9844 15.9844 15.9872 15.9872 k = 0.2946 0.3227-0.0000 ( 4316 PWs) bands (ev): -12.5157 -12.5157 -12.5153 -12.5153 -12.0877 -12.0877 -12.0876 -12.0876 -11.5655 -11.5655 -11.5651 -11.5651 -11.1329 -11.1329 -11.1327 -11.1327 -0.2791 -0.2791 -0.2780 -0.2780 0.1769 0.1769 0.1774 0.1774 0.7754 0.7754 0.7772 0.7772 1.3685 1.3685 1.3766 1.3766 1.6831 1.6831 1.6864 1.6864 2.7393 2.7393 2.7499 2.7499 3.4357 3.4357 3.4486 3.4486 3.6279 3.6279 3.6293 3.6293 3.9722 3.9722 3.9738 3.9738 4.3968 4.3968 4.4051 4.4051 4.4759 4.4759 4.4829 4.4829 4.9659 4.9659 4.9674 4.9674 15.5764 15.5764 15.5778 15.5778 15.9929 15.9929 15.9957 15.9957 k = 0.2857 0.3227-0.0000 ( 4324 PWs) bands (ev): -12.5471 -12.5471 -12.5466 -12.5466 -12.1042 -12.1042 -12.1042 -12.1042 -11.5791 -11.5791 -11.5787 -11.5787 -11.1294 -11.1294 -11.1293 -11.1293 -0.2561 -0.2561 -0.2550 -0.2550 0.2011 0.2011 0.2015 0.2015 0.7943 0.7943 0.7958 0.7958 1.4149 1.4149 1.4228 1.4228 1.7264 1.7264 1.7294 1.7294 2.7642 2.7642 2.7744 2.7744 3.4364 3.4364 3.4499 3.4499 3.6202 3.6202 3.6217 3.6217 3.9761 3.9761 3.9776 3.9776 4.3935 4.3935 4.4019 4.4019 4.4899 4.4899 4.4969 4.4969 4.9707 4.9707 4.9722 4.9722 15.5363 15.5363 15.5378 15.5378 15.9987 15.9987 16.0015 16.0015 k = 0.2768 0.3227-0.0000 ( 4324 PWs) bands (ev): -12.5781 -12.5781 -12.5777 -12.5777 -12.1209 -12.1209 -12.1209 -12.1209 -11.5928 -11.5928 -11.5924 -11.5924 -11.1265 -11.1265 -11.1263 -11.1263 -0.2377 -0.2377 -0.2366 -0.2366 0.2252 0.2252 0.2255 0.2255 0.8157 0.8157 0.8171 0.8171 1.4648 1.4648 1.4726 1.4726 1.7712 1.7712 1.7738 1.7738 2.7878 2.7878 2.7975 2.7975 3.4389 3.4389 3.4529 3.4529 3.6149 3.6149 3.6164 3.6164 3.9791 3.9791 3.9805 3.9805 4.3901 4.3901 4.3986 4.3986 4.5043 4.5043 4.5113 4.5113 4.9750 4.9750 4.9765 4.9765 15.4917 15.4917 15.4930 15.4930 16.0016 16.0016 16.0044 16.0044 k = 0.2679 0.3227-0.0000 ( 4324 PWs) bands (ev): -12.6087 -12.6087 -12.6083 -12.6083 -12.1377 -12.1377 -12.1377 -12.1377 -11.6066 -11.6066 -11.6062 -11.6062 -11.1241 -11.1241 -11.1240 -11.1240 -0.2243 -0.2243 -0.2232 -0.2232 0.2498 0.2498 0.2499 0.2499 0.8400 0.8400 0.8412 0.8412 1.5176 1.5176 1.5253 1.5253 1.8172 1.8172 1.8196 1.8196 2.8099 2.8099 2.8191 2.8191 3.4425 3.4425 3.4569 3.4569 3.6128 3.6128 3.6141 3.6141 3.9812 3.9812 3.9825 3.9825 4.3866 4.3866 4.3952 4.3952 4.5192 4.5192 4.5261 4.5261 4.9787 4.9787 4.9802 4.9802 15.4428 15.4428 15.4441 15.4441 16.0012 16.0012 16.0039 16.0039 k = 0.2589 0.3227-0.0000 ( 4328 PWs) bands (ev): -12.6389 -12.6389 -12.6386 -12.6386 -12.1545 -12.1545 -12.1545 -12.1545 -11.6204 -11.6204 -11.6200 -11.6200 -11.1223 -11.1223 -11.1221 -11.1221 -0.2162 -0.2162 -0.2151 -0.2151 0.2752 0.2752 0.2753 0.2753 0.8668 0.8668 0.8680 0.8680 1.5729 1.5729 1.5804 1.5804 1.8644 1.8644 1.8666 1.8666 2.8307 2.8307 2.8394 2.8394 3.4466 3.4466 3.4609 3.4609 3.6151 3.6151 3.6159 3.6159 3.9824 3.9824 3.9837 3.9837 4.3830 4.3830 4.3917 4.3917 4.5343 4.5343 4.5412 4.5412 4.9818 4.9818 4.9832 4.9832 15.3902 15.3902 15.3914 15.3914 15.9973 15.9973 16.0000 16.0000 k = 0.2500 0.3227-0.0000 ( 4320 PWs) bands (ev): -12.6686 -12.6686 -12.6683 -12.6683 -12.1713 -12.1713 -12.1713 -12.1713 -11.6341 -11.6341 -11.6337 -11.6337 -11.1209 -11.1209 -11.1207 -11.1207 -0.2133 -0.2133 -0.2122 -0.2122 0.3016 0.3016 0.3018 0.3018 0.8959 0.8959 0.8970 0.8970 1.6301 1.6301 1.6374 1.6374 1.9127 1.9127 1.9148 1.9148 2.8500 2.8500 2.8583 2.8583 3.4501 3.4501 3.4640 3.4640 3.6226 3.6226 3.6228 3.6228 3.9828 3.9828 3.9840 3.9840 4.3792 4.3792 4.3881 4.3881 4.5496 4.5496 4.5565 4.5565 4.9843 4.9843 4.9857 4.9857 15.3343 15.3343 15.3355 15.3355 15.9898 15.9898 15.9924 15.9924 k = 0.2411 0.3227-0.0000 ( 4320 PWs) bands (ev): -12.6978 -12.6978 -12.6974 -12.6974 -12.1881 -12.1881 -12.1881 -12.1881 -11.6478 -11.6478 -11.6474 -11.6474 -11.1199 -11.1199 -11.1197 -11.1197 -0.2152 -0.2152 -0.2141 -0.2141 0.3290 0.3290 0.3294 0.3294 0.9267 0.9267 0.9278 0.9278 1.6888 1.6888 1.6960 1.6960 1.9622 1.9622 1.9641 1.9641 2.8682 2.8682 2.8761 2.8761 3.4524 3.4524 3.4654 3.4654 3.6350 3.6350 3.6364 3.6364 3.9825 3.9825 3.9837 3.9837 4.3755 4.3755 4.3845 4.3845 4.5651 4.5651 4.5719 4.5719 4.9861 4.9861 4.9875 4.9875 15.2757 15.2757 15.2767 15.2767 15.9785 15.9785 15.9810 15.9810 k = 0.2321 0.3227-0.0000 ( 4324 PWs) bands (ev): -12.7263 -12.7263 -12.7260 -12.7260 -12.2047 -12.2047 -12.2047 -12.2047 -11.6613 -11.6613 -11.6610 -11.6610 -11.1194 -11.1194 -11.1192 -11.1192 -0.2213 -0.2213 -0.2202 -0.2202 0.3571 0.3571 0.3576 0.3576 0.9588 0.9588 0.9599 0.9599 1.7488 1.7488 1.7558 1.7558 2.0126 2.0126 2.0143 2.0143 2.8854 2.8854 2.8929 2.8929 3.4532 3.4532 3.4651 3.4651 3.6530 3.6530 3.6558 3.6558 3.9816 3.9816 3.9829 3.9829 4.3717 4.3717 4.3808 4.3808 4.5805 4.5805 4.5873 4.5873 4.9872 4.9872 4.9886 4.9886 15.2147 15.2147 15.2157 15.2157 15.9633 15.9633 15.9657 15.9657 k = 0.2232 0.3227-0.0000 ( 4326 PWs) bands (ev): -12.7541 -12.7541 -12.7538 -12.7538 -12.2211 -12.2211 -12.2211 -12.2211 -11.6747 -11.6747 -11.6744 -11.6744 -11.1193 -11.1193 -11.1191 -11.1191 -0.2310 -0.2310 -0.2299 -0.2299 0.3855 0.3855 0.3862 0.3862 0.9917 0.9917 0.9928 0.9928 1.8096 1.8096 1.8165 1.8165 2.0638 2.0638 2.0655 2.0655 2.9019 2.9019 2.9091 2.9091 3.4526 3.4526 3.4636 3.4636 3.6761 3.6761 3.6801 3.6801 3.9802 3.9802 3.9816 3.9816 4.3680 4.3680 4.3772 4.3772 4.5958 4.5958 4.6026 4.6026 4.9876 4.9876 4.9890 4.9890 15.1517 15.1517 15.1526 15.1526 15.9442 15.9442 15.9465 15.9465 k = 0.2143 0.3227-0.0000 ( 4322 PWs) bands (ev): -12.7812 -12.7812 -12.7810 -12.7810 -12.2374 -12.2374 -12.2373 -12.2373 -11.6879 -11.6879 -11.6875 -11.6875 -11.1195 -11.1195 -11.1193 -11.1193 -0.2436 -0.2436 -0.2425 -0.2425 0.4139 0.4139 0.4147 0.4147 1.0249 1.0249 1.0261 1.0261 1.8710 1.8710 1.8778 1.8778 2.1158 2.1158 2.1174 2.1174 2.9180 2.9180 2.9249 2.9249 3.4513 3.4513 3.4613 3.4613 3.7032 3.7032 3.7083 3.7083 3.9788 3.9788 3.9803 3.9803 4.3644 4.3644 4.3738 4.3738 4.6109 4.6109 4.6177 4.6177 4.9873 4.9873 4.9888 4.9888 15.0872 15.0872 15.0880 15.0880 15.9213 15.9213 15.9235 15.9235 k = 0.2054 0.3227-0.0000 ( 4322 PWs) bands (ev): -12.8076 -12.8076 -12.8073 -12.8073 -12.2533 -12.2533 -12.2532 -12.2532 -11.7008 -11.7008 -11.7005 -11.7005 -11.1200 -11.1200 -11.1198 -11.1198 -0.2584 -0.2584 -0.2573 -0.2573 0.4418 0.4418 0.4427 0.4427 1.0582 1.0582 1.0593 1.0593 1.9327 1.9327 1.9394 1.9394 2.1683 2.1683 2.1699 2.1699 2.9340 2.9340 2.9407 2.9407 3.4496 3.4496 3.4588 3.4588 3.7331 3.7331 3.7388 3.7388 3.9775 3.9775 3.9793 3.9793 4.3611 4.3611 4.3706 4.3706 4.6256 4.6256 4.6325 4.6325 4.9863 4.9863 4.9878 4.9878 15.0215 15.0215 15.0223 15.0223 15.8947 15.8947 15.8968 15.8968 k = 0.1964 0.3227-0.0000 ( 4318 PWs) bands (ev): -12.8332 -12.8332 -12.8329 -12.8329 -12.2689 -12.2689 -12.2688 -12.2688 -11.7135 -11.7135 -11.7132 -11.7132 -11.1208 -11.1208 -11.1206 -11.1206 -0.2749 -0.2749 -0.2738 -0.2738 0.4689 0.4689 0.4698 0.4698 1.0910 1.0910 1.0921 1.0921 1.9945 1.9945 2.0009 2.0009 2.2212 2.2212 2.2227 2.2227 2.9504 2.9504 2.9568 2.9568 3.4481 3.4481 3.4567 3.4567 3.7641 3.7641 3.7703 3.7703 3.9770 3.9770 3.9793 3.9793 4.3582 4.3582 4.3678 4.3678 4.6400 4.6400 4.6470 4.6470 4.9846 4.9846 4.9862 4.9862 14.9550 14.9550 14.9557 14.9557 15.8646 15.8646 15.8665 15.8665 k = 0.1875 0.3227-0.0000 ( 4314 PWs) bands (ev): -12.8579 -12.8579 -12.8576 -12.8576 -12.2841 -12.2841 -12.2840 -12.2840 -11.7259 -11.7259 -11.7256 -11.7256 -11.1219 -11.1219 -11.1217 -11.1217 -0.2925 -0.2925 -0.2915 -0.2915 0.4949 0.4949 0.4958 0.4958 1.1232 1.1232 1.1243 1.1243 2.0559 2.0559 2.0622 2.0622 2.2742 2.2742 2.2757 2.2757 2.9672 2.9672 2.9734 2.9734 3.4472 3.4472 3.4554 3.4554 3.7945 3.7945 3.8006 3.8006 3.9783 3.9783 3.9813 3.9813 4.3561 4.3561 4.3656 4.3656 4.6538 4.6538 4.6609 4.6609 4.9822 4.9822 4.9838 4.9838 14.8881 14.8881 14.8888 14.8888 15.8312 15.8312 15.8330 15.8330 k = 0.1786 0.3227-0.0000 ( 4310 PWs) bands (ev): -12.8817 -12.8817 -12.8814 -12.8814 -12.2989 -12.2989 -12.2988 -12.2988 -11.7379 -11.7379 -11.7376 -11.7376 -11.1232 -11.1232 -11.1230 -11.1230 -0.3110 -0.3110 -0.3100 -0.3100 0.5196 0.5196 0.5205 0.5205 1.1544 1.1544 1.1555 1.1555 2.1167 2.1167 2.1228 2.1228 2.3271 2.3271 2.3287 2.3287 2.9848 2.9848 2.9908 2.9908 3.4473 3.4473 3.4552 3.4552 3.8220 3.8220 3.8274 3.8274 3.9827 3.9827 3.9867 3.9867 4.3549 4.3549 4.3644 4.3644 4.6671 4.6671 4.6743 4.6743 4.9791 4.9791 4.9808 4.9808 14.8211 14.8211 14.8217 14.8217 15.7948 15.7948 15.7965 15.7965 k = 0.1696 0.3227-0.0000 ( 4314 PWs) bands (ev): -12.9045 -12.9045 -12.9043 -12.9043 -12.3133 -12.3133 -12.3132 -12.3132 -11.7496 -11.7496 -11.7493 -11.7493 -11.1246 -11.1246 -11.1245 -11.1245 -0.3298 -0.3298 -0.3288 -0.3288 0.5427 0.5427 0.5436 0.5436 1.1845 1.1845 1.1854 1.1854 2.1765 2.1765 2.1823 2.1823 2.3797 2.3797 2.3814 2.3814 3.0033 3.0033 3.0091 3.0091 3.4487 3.4487 3.4563 3.4563 3.8437 3.8437 3.8481 3.8481 3.9918 3.9918 3.9972 3.9972 4.3552 4.3552 4.3646 4.3646 4.6797 4.6797 4.6871 4.6871 4.9753 4.9753 4.9771 4.9771 14.7544 14.7544 14.7550 14.7550 15.7559 15.7559 15.7574 15.7574 k = 0.1607 0.3227-0.0000 ( 4306 PWs) bands (ev): -12.9264 -12.9264 -12.9262 -12.9262 -12.3271 -12.3271 -12.3270 -12.3270 -11.7608 -11.7608 -11.7606 -11.7606 -11.1262 -11.1262 -11.1261 -11.1261 -0.3488 -0.3488 -0.3478 -0.3478 0.5642 0.5642 0.5651 0.5651 1.2131 1.2131 1.2141 1.2141 2.2347 2.2347 2.2402 2.2402 2.4319 2.4319 2.4337 2.4337 3.0229 3.0229 3.0285 3.0285 3.4517 3.4517 3.4591 3.4591 3.8580 3.8580 3.8611 3.8611 4.0066 4.0066 4.0132 4.0132 4.3577 4.3577 4.3666 4.3666 4.6917 4.6917 4.6992 4.6992 4.9709 4.9709 4.9727 4.9727 14.6884 14.6884 14.6889 14.6889 15.7148 15.7148 15.7162 15.7162 k = 0.1518 0.3227-0.0000 ( 4304 PWs) bands (ev): -12.9473 -12.9473 -12.9472 -12.9472 -12.3404 -12.3404 -12.3403 -12.3403 -11.7717 -11.7717 -11.7714 -11.7714 -11.1280 -11.1280 -11.1278 -11.1278 -0.3676 -0.3676 -0.3666 -0.3666 0.5840 0.5840 0.5849 0.5849 1.2403 1.2403 1.2412 1.2412 2.2910 2.2910 2.2962 2.2962 2.4836 2.4836 2.4855 2.4855 3.0436 3.0436 3.0490 3.0490 3.4565 3.4565 3.4637 3.4637 3.8649 3.8649 3.8670 3.8670 4.0257 4.0257 4.0330 4.0330 4.3630 4.3630 4.3713 4.3713 4.7028 4.7028 4.7105 4.7105 4.9658 4.9658 4.9676 4.9676 14.6233 14.6233 14.6238 14.6238 15.6720 15.6720 15.6732 15.6732 k = 0.1429 0.3227-0.0000 ( 4300 PWs) bands (ev): -12.9672 -12.9672 -12.9670 -12.9670 -12.3532 -12.3532 -12.3531 -12.3531 -11.7820 -11.7820 -11.7818 -11.7818 -11.1298 -11.1298 -11.1296 -11.1296 -0.3861 -0.3861 -0.3852 -0.3852 0.6021 0.6021 0.6030 0.6030 1.2659 1.2659 1.2666 1.2666 2.3447 2.3447 2.3495 2.3495 2.5347 2.5347 2.5368 2.5368 3.0653 3.0653 3.0706 3.0706 3.4634 3.4634 3.4703 3.4703 3.8661 3.8661 3.8676 3.8676 4.0463 4.0463 4.0534 4.0534 4.3719 4.3719 4.3793 4.3793 4.7132 4.7132 4.7211 4.7211 4.9600 4.9600 4.9620 4.9620 14.5596 14.5596 14.5600 14.5600 15.6280 15.6280 15.6291 15.6291 k = 0.1339 0.3227-0.0000 ( 4300 PWs) bands (ev): -12.9860 -12.9860 -12.9859 -12.9859 -12.3653 -12.3653 -12.3652 -12.3652 -11.7919 -11.7919 -11.7917 -11.7917 -11.1316 -11.1316 -11.1315 -11.1315 -0.4040 -0.4040 -0.4032 -0.4032 0.6186 0.6186 0.6194 0.6194 1.2897 1.2897 1.2904 1.2904 2.3953 2.3953 2.3996 2.3996 2.5852 2.5852 2.5876 2.5876 3.0880 3.0880 3.0930 3.0930 3.4723 3.4723 3.4791 3.4791 3.8636 3.8636 3.8648 3.8648 4.0652 4.0652 4.0715 4.0715 4.3854 4.3854 4.3913 4.3913 4.7227 4.7227 4.7309 4.7309 4.9537 4.9537 4.9558 4.9558 14.4975 14.4975 14.4979 14.4979 15.5832 15.5832 15.5842 15.5842 k = 0.1250 0.3227-0.0000 ( 4304 PWs) bands (ev): -13.0038 -13.0038 -13.0036 -13.0036 -12.3768 -12.3768 -12.3767 -12.3767 -11.8012 -11.8012 -11.8010 -11.8010 -11.1335 -11.1335 -11.1334 -11.1334 -0.4213 -0.4213 -0.4205 -0.4205 0.6335 0.6335 0.6342 0.6342 1.3117 1.3117 1.3123 1.3123 2.4422 2.4422 2.4460 2.4460 2.6351 2.6351 2.6378 2.6378 3.1113 3.1113 3.1162 3.1162 3.4834 3.4834 3.4900 3.4900 3.8586 3.8586 3.8598 3.8598 4.0805 4.0805 4.0855 4.0855 4.4036 4.4036 4.4079 4.4079 4.7313 4.7313 4.7398 4.7398 4.9468 4.9468 4.9490 4.9490 14.4374 14.4374 14.4378 14.4378 15.5383 15.5383 15.5391 15.5391 k = 0.1161 0.3227-0.0000 ( 4296 PWs) bands (ev): -13.0204 -13.0204 -13.0202 -13.0202 -12.3876 -12.3876 -12.3875 -12.3875 -11.8101 -11.8101 -11.8098 -11.8098 -11.1354 -11.1354 -11.1353 -11.1353 -0.4378 -0.4378 -0.4370 -0.4370 0.6468 0.6468 0.6475 0.6475 1.3320 1.3320 1.3325 1.3325 2.4849 2.4849 2.4882 2.4882 2.6845 2.6845 2.6874 2.6874 3.1352 3.1352 3.1400 3.1400 3.4968 3.4968 3.5031 3.5031 3.8522 3.8522 3.8535 3.8535 4.0909 4.0909 4.0944 4.0944 4.4265 4.4265 4.4288 4.4288 4.7391 4.7391 4.7478 4.7478 4.9394 4.9394 4.9416 4.9416 14.3798 14.3798 14.3801 14.3801 15.4937 15.4937 15.4944 15.4944 k = 0.1071 0.3227-0.0000 ( 4300 PWs) bands (ev): -13.0358 -13.0358 -13.0357 -13.0357 -12.3978 -12.3978 -12.3977 -12.3977 -11.8183 -11.8183 -11.8181 -11.8181 -11.1373 -11.1373 -11.1371 -11.1371 -0.4534 -0.4534 -0.4527 -0.4527 0.6586 0.6586 0.6593 0.6593 1.3505 1.3505 1.3509 1.3509 2.5233 2.5233 2.5261 2.5261 2.7330 2.7330 2.7363 2.7363 3.1592 3.1592 3.1639 3.1639 3.5122 3.5122 3.5182 3.5182 3.8449 3.8449 3.8464 3.8464 4.0964 4.0964 4.0982 4.0982 4.4531 4.4531 4.4536 4.4536 4.7459 4.7459 4.7550 4.7550 4.9315 4.9315 4.9338 4.9338 14.3248 14.3248 14.3251 14.3251 15.4499 15.4499 15.4506 15.4506 k = 0.0982 0.3227-0.0000 ( 4300 PWs) bands (ev): -13.0502 -13.0502 -13.0500 -13.0500 -12.4072 -12.4072 -12.4071 -12.4071 -11.8260 -11.8260 -11.8258 -11.8258 -11.1391 -11.1391 -11.1389 -11.1389 -0.4681 -0.4681 -0.4674 -0.4674 0.6691 0.6691 0.6697 0.6697 1.3672 1.3672 1.3676 1.3676 2.5572 2.5572 2.5596 2.5596 2.7806 2.7806 2.7840 2.7840 3.1830 3.1830 3.1877 3.1877 3.5294 3.5294 3.5349 3.5349 3.8374 3.8374 3.8392 3.8392 4.0971 4.0971 4.0974 4.0974 4.4812 4.4812 4.4825 4.4825 4.7518 4.7518 4.7613 4.7613 4.9231 4.9231 4.9256 4.9256 14.2728 14.2728 14.2731 14.2731 15.4076 15.4076 15.4081 15.4081 k = 0.0893 0.3227-0.0000 ( 4300 PWs) bands (ev): -13.0633 -13.0633 -13.0632 -13.0632 -12.4159 -12.4159 -12.4158 -12.4158 -11.8330 -11.8330 -11.8329 -11.8329 -11.1408 -11.1408 -11.1407 -11.1407 -0.4816 -0.4816 -0.4810 -0.4810 0.6783 0.6783 0.6788 0.6788 1.3821 1.3821 1.3824 1.3824 2.5868 2.5868 2.5888 2.5888 2.8267 2.8267 2.8303 2.8303 3.2065 3.2065 3.2111 3.2111 3.5480 3.5480 3.5529 3.5529 3.8300 3.8300 3.8323 3.8323 4.0927 4.0927 4.0938 4.0938 4.5105 4.5105 4.5134 4.5134 4.7568 4.7568 4.7668 4.7668 4.9143 4.9143 4.9169 4.9169 14.2241 14.2241 14.2244 14.2244 15.3670 15.3670 15.3675 15.3675 k = 0.0804 0.3227-0.0000 ( 4312 PWs) bands (ev): -13.0752 -13.0752 -13.0751 -13.0751 -12.4238 -12.4238 -12.4237 -12.4237 -11.8395 -11.8395 -11.8393 -11.8393 -11.1424 -11.1424 -11.1423 -11.1423 -0.4941 -0.4941 -0.4935 -0.4935 0.6863 0.6863 0.6868 0.6868 1.3953 1.3953 1.3956 1.3956 2.6123 2.6123 2.6139 2.6139 2.8709 2.8709 2.8746 2.8746 3.2291 3.2291 3.2337 3.2337 3.5671 3.5671 3.5712 3.5712 3.8236 3.8236 3.8264 3.8264 4.0848 4.0848 4.0869 4.0869 4.5406 4.5406 4.5449 4.5449 4.7610 4.7610 4.7714 4.7714 4.9051 4.9051 4.9078 4.9078 14.1791 14.1791 14.1793 14.1793 15.3288 15.3288 15.3292 15.3292 k = 0.0714 0.3227-0.0000 ( 4304 PWs) bands (ev): -13.0859 -13.0859 -13.0859 -13.0859 -12.4309 -12.4309 -12.4309 -12.4309 -11.8453 -11.8453 -11.8451 -11.8451 -11.1439 -11.1439 -11.1438 -11.1438 -0.5053 -0.5053 -0.5048 -0.5048 0.6932 0.6932 0.6936 0.6936 1.4070 1.4070 1.4072 1.4072 2.6339 2.6339 2.6352 2.6352 2.9126 2.9126 2.9163 2.9163 3.2508 3.2508 3.2553 3.2553 3.5858 3.5858 3.5891 3.5891 3.8188 3.8188 3.8224 3.8224 4.0740 4.0740 4.0772 4.0772 4.5706 4.5706 4.5761 4.5761 4.7643 4.7643 4.7753 4.7753 4.8955 4.8955 4.8983 4.8983 14.1380 14.1380 14.1382 14.1382 15.2934 15.2934 15.2937 15.2937 k = 0.0625 0.3227-0.0000 ( 4304 PWs) bands (ev): -13.0954 -13.0954 -13.0954 -13.0954 -12.4373 -12.4373 -12.4372 -12.4372 -11.8504 -11.8504 -11.8503 -11.8503 -11.1453 -11.1453 -11.1452 -11.1452 -0.5154 -0.5154 -0.5149 -0.5149 0.6991 0.6991 0.6995 0.6995 1.4170 1.4170 1.4172 1.4172 2.6521 2.6521 2.6531 2.6531 2.9513 2.9513 2.9549 2.9549 3.2713 3.2713 3.2757 3.2757 3.6028 3.6028 3.6051 3.6051 3.8169 3.8169 3.8213 3.8213 4.0609 4.0609 4.0649 4.0649 4.5998 4.5998 4.6064 4.6064 4.7669 4.7669 4.7786 4.7786 4.8854 4.8854 4.8885 4.8885 14.1010 14.1010 14.1012 14.1012 15.2612 15.2612 15.2614 15.2614 k = 0.0536 0.3227-0.0000 ( 4296 PWs) bands (ev): -13.1037 -13.1037 -13.1036 -13.1036 -12.4428 -12.4428 -12.4428 -12.4428 -11.8549 -11.8549 -11.8548 -11.8548 -11.1465 -11.1465 -11.1464 -11.1464 -0.5241 -0.5241 -0.5238 -0.5238 0.7041 0.7041 0.7044 0.7044 1.4256 1.4256 1.4257 1.4257 2.6671 2.6671 2.6679 2.6679 2.9863 2.9863 2.9897 2.9897 3.2902 3.2902 3.2944 3.2944 3.6169 3.6169 3.6181 3.6181 3.8189 3.8189 3.8243 3.8243 4.0458 4.0458 4.0504 4.0504 4.6276 4.6276 4.6353 4.6353 4.7688 4.7688 4.7814 4.7814 4.8749 4.8749 4.8783 4.8783 14.0685 14.0685 14.0686 14.0686 15.2324 15.2324 15.2327 15.2327 k = 0.0446 0.3227-0.0000 ( 4306 PWs) bands (ev): -13.1107 -13.1107 -13.1106 -13.1106 -12.4475 -12.4475 -12.4475 -12.4475 -11.8587 -11.8587 -11.8587 -11.8587 -11.1475 -11.1475 -11.1475 -11.1475 -0.5316 -0.5316 -0.5313 -0.5313 0.7081 0.7081 0.7084 0.7084 1.4327 1.4327 1.4328 1.4328 2.6792 2.6792 2.6799 2.6799 3.0172 3.0172 3.0203 3.0203 3.3075 3.3075 3.3114 3.3114 3.6269 3.6269 3.6272 3.6272 3.8257 3.8257 3.8319 3.8319 4.0289 4.0289 4.0340 4.0340 4.6536 4.6536 4.6623 4.6623 4.7701 4.7701 4.7837 4.7837 4.8640 4.8640 4.8678 4.8678 14.0405 14.0405 14.0406 14.0406 15.2076 15.2076 15.2077 15.2077 k = 0.0357 0.3227-0.0000 ( 4306 PWs) bands (ev): -13.1164 -13.1164 -13.1164 -13.1164 -12.4514 -12.4514 -12.4513 -12.4513 -11.8619 -11.8619 -11.8618 -11.8618 -11.1484 -11.1484 -11.1484 -11.1484 -0.5377 -0.5377 -0.5375 -0.5375 0.7114 0.7114 0.7116 0.7116 1.4384 1.4384 1.4385 1.4385 2.6888 2.6888 2.6893 2.6893 3.0434 3.0434 3.0460 3.0460 3.3227 3.3227 3.3261 3.3261 3.6323 3.6323 3.6327 3.6327 3.8374 3.8374 3.8442 3.8442 4.0104 4.0104 4.0160 4.0160 4.6773 4.6773 4.6870 4.6870 4.7710 4.7710 4.7859 4.7859 4.8526 4.8526 4.8570 4.8570 14.0174 14.0174 14.0175 14.0175 15.1868 15.1868 15.1870 15.1870 k = 0.0268 0.3227-0.0000 ( 4310 PWs) bands (ev): -13.1209 -13.1209 -13.1209 -13.1209 -12.4544 -12.4544 -12.4543 -12.4543 -11.8643 -11.8643 -11.8643 -11.8643 -11.1491 -11.1491 -11.1491 -11.1491 -0.5425 -0.5425 -0.5423 -0.5423 0.7139 0.7139 0.7140 0.7140 1.4428 1.4428 1.4429 1.4429 2.6960 2.6960 2.6964 2.6964 3.0644 3.0644 3.0665 3.0665 3.3355 3.3355 3.3382 3.3382 3.6343 3.6343 3.6350 3.6350 3.8534 3.8534 3.8604 3.8604 3.9909 3.9909 3.9968 3.9968 4.6982 4.6982 4.7086 4.7086 4.7719 4.7719 4.7880 4.7880 4.8411 4.8411 4.8462 4.8462 13.9992 13.9992 13.9993 13.9993 15.1705 15.1705 15.1706 15.1706 k = 0.0179 0.3227-0.0000 ( 4310 PWs) bands (ev): -13.1241 -13.1241 -13.1241 -13.1241 -12.4565 -12.4565 -12.4565 -12.4565 -11.8661 -11.8661 -11.8660 -11.8660 -11.1496 -11.1496 -11.1496 -11.1496 -0.5460 -0.5460 -0.5458 -0.5458 0.7156 0.7156 0.7157 0.7157 1.4459 1.4459 1.4460 1.4460 2.7011 2.7011 2.7013 2.7013 3.0798 3.0798 3.0812 3.0812 3.3453 3.3453 3.3473 3.3473 3.6345 3.6345 3.6351 3.6351 3.8719 3.8719 3.8787 3.8787 3.9710 3.9710 3.9769 3.9769 4.7156 4.7156 4.7256 4.7256 4.7738 4.7738 4.7897 4.7897 4.8301 4.8301 4.8358 4.8358 13.9862 13.9862 13.9862 13.9862 15.1587 15.1587 15.1587 15.1587 k = 0.0089 0.3227-0.0000 ( 4306 PWs) bands (ev): -13.1260 -13.1260 -13.1260 -13.1260 -12.4578 -12.4578 -12.4578 -12.4578 -11.8671 -11.8671 -11.8671 -11.8671 -11.1499 -11.1499 -11.1499 -11.1499 -0.5480 -0.5480 -0.5479 -0.5479 0.7167 0.7167 0.7167 0.7167 1.4478 1.4478 1.4478 1.4478 2.7041 2.7041 2.7042 2.7042 3.0893 3.0893 3.0901 3.0901 3.3517 3.3517 3.3527 3.3527 3.6341 3.6341 3.6344 3.6344 3.8907 3.8907 3.8961 3.8961 3.9529 3.9529 3.9579 3.9579 4.7286 4.7286 4.7353 4.7353 4.7783 4.7783 4.7897 4.7897 4.8221 4.8221 4.8267 4.8267 13.9783 13.9783 13.9784 13.9784 15.1515 15.1515 15.1516 15.1516 k = 0.0000 0.3227-0.0000 ( 4318 PWs) bands (ev): -13.1267 -13.1267 -13.1267 -13.1267 -12.4582 -12.4582 -12.4582 -12.4582 -11.8675 -11.8675 -11.8675 -11.8675 -11.1500 -11.1500 -11.1500 -11.1500 -0.5487 -0.5487 -0.5487 -0.5487 0.7171 0.7171 0.7171 0.7171 1.4484 1.4484 1.4484 1.4484 2.7051 2.7051 2.7051 2.7051 3.0928 3.0928 3.0928 3.0928 3.3542 3.3542 3.3542 3.3542 3.6340 3.6340 3.6340 3.6340 3.9030 3.9030 3.9030 3.9030 3.9457 3.9457 3.9457 3.9457 4.7358 4.7358 4.7358 4.7358 4.7852 4.7852 4.7852 4.7852 4.8210 4.8210 4.8210 4.8210 13.9757 13.9757 13.9757 13.9757 15.1491 15.1491 15.1491 15.1491 k = 0.0000 0.3227-0.0000 ( 4318 PWs) bands (ev): -13.1267 -13.1267 -13.1267 -13.1267 -12.4582 -12.4582 -12.4582 -12.4582 -11.8675 -11.8675 -11.8675 -11.8675 -11.1500 -11.1500 -11.1500 -11.1500 -0.5487 -0.5487 -0.5487 -0.5487 0.7171 0.7171 0.7171 0.7171 1.4484 1.4484 1.4484 1.4484 2.7051 2.7051 2.7051 2.7051 3.0928 3.0928 3.0928 3.0928 3.3542 3.3542 3.3542 3.3542 3.6340 3.6340 3.6340 3.6340 3.9030 3.9030 3.9030 3.9030 3.9457 3.9457 3.9457 3.9457 4.7358 4.7358 4.7358 4.7358 4.7852 4.7852 4.7852 4.7852 4.8210 4.8210 4.8210 4.8210 13.9757 13.9757 13.9757 13.9757 15.1491 15.1491 15.1491 15.1491 k = 0.0000 0.3138-0.0000 ( 4310 PWs) bands (ev): -13.1538 -13.1538 -13.1001 -13.1001 -12.4892 -12.4892 -12.4273 -12.4273 -11.8749 -11.8749 -11.8591 -11.8591 -11.1527 -11.1527 -11.1469 -11.1469 -0.5739 -0.5739 -0.5223 -0.5223 0.6812 0.6812 0.7518 0.7518 1.4390 1.4390 1.4564 1.4564 2.6443 2.6443 2.7718 2.7718 3.0699 3.0699 3.1156 3.1156 3.3342 3.3342 3.3742 3.3742 3.6132 3.6132 3.6433 3.6433 3.9037 3.9037 3.9056 3.9056 3.9379 3.9379 3.9534 3.9534 4.7358 4.7358 4.7374 4.7374 4.7842 4.7842 4.7858 4.7858 4.8092 4.8092 4.8344 4.8344 13.9145 13.9145 14.0344 14.0344 15.1124 15.1124 15.1818 15.1818 k = 0.0000 0.3048-0.0000 ( 4312 PWs) bands (ev): -13.1814 -13.1814 -13.0744 -13.0744 -12.5201 -12.5201 -12.3964 -12.3964 -11.8812 -11.8812 -11.8501 -11.8501 -11.1551 -11.1551 -11.1434 -11.1434 -0.5981 -0.5981 -0.4947 -0.4947 0.6446 0.6446 0.7851 0.7851 1.4273 1.4273 1.4638 1.4638 2.5901 2.5901 2.8434 2.8434 3.0471 3.0471 3.1385 3.1385 3.3143 3.3143 3.3941 3.3941 3.5829 3.5829 3.6404 3.6404 3.9083 3.9083 3.9100 3.9100 3.9304 3.9304 3.9609 3.9609 4.7372 4.7372 4.7407 4.7407 4.7824 4.7824 4.7853 4.7853 4.8007 4.8007 4.8489 4.8489 13.8510 13.8510 14.0903 14.0903 15.0720 15.0720 15.2098 15.2098 k = 0.0000 0.2958-0.0000 ( 4320 PWs) bands (ev): -13.2094 -13.2094 -13.0496 -13.0496 -12.5508 -12.5508 -12.3656 -12.3656 -11.8863 -11.8863 -11.8404 -11.8404 -11.1571 -11.1571 -11.1395 -11.1395 -0.6212 -0.6212 -0.4659 -0.4659 0.6073 0.6073 0.8166 0.8166 1.4126 1.4126 1.4716 1.4716 2.5433 2.5433 2.9192 2.9192 3.0245 3.0245 3.1612 3.1612 3.2944 3.2944 3.4138 3.4138 3.5450 3.5450 3.6262 3.6262 3.9133 3.9133 3.9161 3.9161 3.9240 3.9240 3.9683 3.9683 4.7396 4.7396 4.7447 4.7447 4.7783 4.7783 4.7845 4.7845 4.7978 4.7978 4.8643 4.8643 13.7853 13.7853 14.1435 14.1435 15.0287 15.0287 15.2327 15.2327 k = 0.0000 0.2869-0.0000 ( 4316 PWs) bands (ev): -13.2377 -13.2377 -13.0258 -13.0258 -12.5812 -12.5812 -12.3352 -12.3352 -11.8900 -11.8900 -11.8303 -11.8303 -11.1588 -11.1588 -11.1351 -11.1351 -0.6434 -0.6434 -0.4358 -0.4358 0.5696 0.5696 0.8458 0.8458 1.3944 1.3944 1.4807 1.4807 2.5043 2.5043 2.9983 2.9983 3.0020 3.0020 3.1838 3.1838 3.2746 3.2746 3.4332 3.4332 3.5014 3.5014 3.6024 3.6024 3.9115 3.9115 3.9205 3.9205 3.9263 3.9263 3.9755 3.9755 4.7411 4.7411 4.7471 4.7471 4.7763 4.7763 4.7844 4.7844 4.7986 4.7986 4.8807 4.8807 13.7176 13.7176 14.1936 14.1936 14.9829 14.9829 15.2497 15.2497 k = 0.0000 0.2779-0.0000 ( 4312 PWs) bands (ev): -13.2660 -13.2660 -13.0033 -13.0033 -12.6113 -12.6113 -12.3051 -12.3051 -11.8921 -11.8921 -11.8200 -11.8200 -11.1602 -11.1602 -11.1303 -11.1303 -0.6647 -0.6647 -0.4045 -0.4045 0.5316 0.5316 0.8724 0.8724 1.3725 1.3725 1.4919 1.4919 2.4735 2.4735 2.9797 2.9797 3.0801 3.0801 3.2061 3.2061 3.2550 3.2550 3.4475 3.4475 3.4582 3.4582 3.5711 3.5711 3.9050 3.9050 3.9211 3.9211 3.9346 3.9346 3.9825 3.9825 4.7361 4.7361 4.7498 4.7498 4.7812 4.7812 4.7859 4.7859 4.8011 4.8011 4.8979 4.8979 13.6481 13.6481 14.2408 14.2408 14.9355 14.9355 15.2599 15.2599 k = 0.0000 0.2689-0.0000 ( 4312 PWs) bands (ev): -13.2943 -13.2943 -12.9822 -12.9822 -12.6411 -12.6411 -12.2754 -12.2754 -11.8925 -11.8925 -11.8094 -11.8094 -11.1612 -11.1612 -11.1251 -11.1251 -0.6851 -0.6851 -0.3719 -0.3719 0.4932 0.4932 0.8960 0.8960 1.3472 1.3472 1.5059 1.5059 2.4509 2.4509 2.9577 2.9577 3.1636 3.1636 3.2282 3.2282 3.2356 3.2356 3.4004 3.4004 3.4724 3.4724 3.5341 3.5341 3.8980 3.8980 3.9197 3.9197 3.9416 3.9416 3.9891 3.9891 4.7255 4.7255 4.7541 4.7541 4.7842 4.7842 4.7950 4.7950 4.8056 4.8056 4.9158 4.9158 13.5770 13.5770 14.2847 14.2847 14.8870 14.8870 15.2624 15.2624 k = 0.0000 0.2600-0.0000 ( 4320 PWs) bands (ev): -13.3225 -13.3225 -12.9625 -12.9625 -12.6704 -12.6704 -12.2463 -12.2463 -11.8910 -11.8910 -11.7988 -11.7988 -11.1620 -11.1620 -11.1194 -11.1194 -0.7048 -0.7048 -0.3380 -0.3380 0.4545 0.4545 0.9163 0.9163 1.3187 1.3187 1.5233 1.5233 2.4362 2.4362 2.9360 2.9360 3.2162 3.2162 3.2466 3.2466 3.2514 3.2514 3.3458 3.3458 3.4872 3.4872 3.4962 3.4962 3.8911 3.8911 3.9157 3.9157 3.9463 3.9463 3.9955 3.9955 4.7126 4.7126 4.7590 4.7590 4.7855 4.7855 4.8033 4.8033 4.8171 4.8171 4.9343 4.9343 13.5045 13.5045 14.3254 14.3254 14.8378 14.8378 15.2565 15.2565 k = 0.0000 0.2510-0.0000 ( 4320 PWs) bands (ev): -13.3505 -13.3505 -12.9444 -12.9444 -12.6992 -12.6992 -12.2179 -12.2179 -11.8875 -11.8875 -11.7883 -11.7883 -11.1625 -11.1625 -11.1133 -11.1133 -0.7237 -0.7237 -0.3029 -0.3029 0.4155 0.4155 0.9333 0.9333 1.2879 1.2879 1.5445 1.5445 2.4288 2.4288 2.9147 2.9147 3.1974 3.1974 3.2708 3.2708 3.2883 3.2883 3.3325 3.3325 3.4474 3.4474 3.5099 3.5099 3.8844 3.8844 3.9090 3.9090 3.9484 3.9484 4.0015 4.0015 4.6987 4.6987 4.7639 4.7639 4.7871 4.7871 4.8078 4.8078 4.8358 4.8358 4.9532 4.9532 13.4309 13.4309 14.3629 14.3629 14.7885 14.7885 15.2429 15.2429 k = 0.0000 0.2420-0.0000 ( 4316 PWs) bands (ev): -13.3781 -13.3781 -12.9280 -12.9280 -12.7274 -12.7274 -12.1902 -12.1902 -11.8820 -11.8820 -11.7780 -11.7780 -11.1628 -11.1628 -11.1067 -11.1067 -0.7420 -0.7420 -0.2666 -0.2666 0.3761 0.3761 0.9470 0.9470 1.2557 1.2557 1.5694 1.5694 2.4282 2.4282 2.8937 2.8937 3.1785 3.1785 3.2296 3.2296 3.2916 3.2916 3.3851 3.3851 3.4305 3.4305 3.5277 3.5277 3.8782 3.8782 3.8997 3.8997 3.9481 3.9481 4.0072 4.0072 4.6841 4.6841 4.7688 4.7688 4.7890 4.7890 4.8117 4.8117 4.8576 4.8576 4.9724 4.9724 13.3562 13.3562 14.3971 14.3971 14.7395 14.7395 15.2227 15.2227 k = 0.0000 0.2331-0.0000 ( 4308 PWs) bands (ev): -13.4054 -13.4054 -12.9133 -12.9133 -12.7550 -12.7550 -12.1632 -12.1632 -11.8745 -11.8745 -11.7678 -11.7678 -11.1627 -11.1627 -11.0997 -11.0997 -0.7598 -0.7598 -0.2290 -0.2290 0.3361 0.3361 0.9577 0.9577 1.2231 1.2231 1.5981 1.5981 2.4333 2.4333 2.8732 2.8732 3.1570 3.1570 3.1722 3.1722 3.3108 3.3108 3.3419 3.3419 3.5056 3.5056 3.5455 3.5455 3.8724 3.8724 3.8879 3.8879 3.9460 3.9460 4.0125 4.0125 4.6692 4.6692 4.7735 4.7735 4.7912 4.7912 4.8155 4.8155 4.8812 4.8812 4.9917 4.9917 13.2808 13.2808 14.4281 14.4281 14.6910 14.6910 15.1979 15.1979 k = 0.0000 0.2241-0.0000 ( 4312 PWs) bands (ev): -13.4322 -13.4322 -12.9003 -12.9003 -12.7819 -12.7819 -12.1371 -12.1371 -11.8650 -11.8650 -11.7580 -11.7580 -11.1625 -11.1625 -11.0923 -11.0923 -0.7770 -0.7770 -0.1903 -0.1903 0.2956 0.2956 0.9658 0.9658 1.1910 1.1910 1.6302 1.6302 2.4436 2.4436 2.8532 2.8532 3.1047 3.1047 3.1447 3.1447 3.2862 3.2862 3.3325 3.3325 3.5596 3.5596 3.5878 3.5878 3.8664 3.8664 3.8747 3.8747 3.9432 3.9432 4.0175 4.0175 4.6544 4.6544 4.7779 4.7779 4.7938 4.7938 4.8193 4.8193 4.9062 4.9062 5.0109 5.0109 13.2049 13.2049 14.4558 14.4558 14.6435 14.6435 15.1701 15.1701 k = 0.0000 0.2152-0.0000 ( 4312 PWs) bands (ev): -13.4584 -13.4584 -12.8891 -12.8891 -12.8082 -12.8082 -12.1118 -12.1118 -11.8537 -11.8537 -11.7486 -11.7486 -11.1620 -11.1620 -11.0845 -11.0845 -0.7937 -0.7937 -0.1505 -0.1505 0.2544 0.2544 0.9717 0.9717 1.1605 1.1605 1.6654 1.6654 2.4580 2.4580 2.8337 2.8337 3.0424 3.0424 3.1267 3.1267 3.2308 3.2308 3.3507 3.3507 3.5766 3.5766 3.6615 3.6615 3.8549 3.8549 3.8657 3.8657 3.9417 3.9417 4.0221 4.0221 4.6401 4.6401 4.7820 4.7820 4.7968 4.7968 4.8232 4.8232 4.9320 4.9320 5.0298 5.0298 13.1287 13.1287 14.4805 14.4805 14.5970 14.5970 15.1406 15.1406 k = 0.0000 0.2062-0.0000 ( 4312 PWs) bands (ev): -13.4840 -13.4840 -12.8797 -12.8797 -12.8336 -12.8336 -12.0873 -12.0873 -11.8406 -11.8406 -11.7396 -11.7396 -11.1613 -11.1613 -11.0764 -11.0764 -0.8100 -0.8100 -0.1098 -0.1098 0.2126 0.2126 0.9759 0.9759 1.1324 1.1324 1.7032 1.7032 2.4758 2.4758 2.8147 2.8147 2.9789 2.9789 3.1096 3.1096 3.1732 3.1732 3.3684 3.3684 3.5920 3.5920 3.7256 3.7256 3.8374 3.8374 3.8617 3.8617 3.9460 3.9460 4.0263 4.0263 4.6269 4.6269 4.7857 4.7857 4.7999 4.7999 4.8272 4.8272 4.9582 4.9582 5.0483 5.0483 13.0524 13.0524 14.5021 14.5021 14.5519 14.5519 15.1103 15.1103 k = 0.0000 0.1972-0.0000 ( 4316 PWs) bands (ev): -13.5090 -13.5090 -12.8719 -12.8719 -12.8583 -12.8583 -12.0636 -12.0636 -11.8260 -11.8260 -11.7311 -11.7311 -11.1603 -11.1603 -11.0680 -11.0680 -0.8258 -0.8258 -0.0681 -0.0681 0.1700 0.1700 0.9789 0.9789 1.1073 1.1073 1.7431 1.7431 2.4963 2.4963 2.7962 2.7962 2.9151 2.9151 3.0926 3.0926 3.1146 3.1146 3.3852 3.3852 3.6064 3.6064 3.7710 3.7710 3.8178 3.8178 3.8593 3.8593 3.9634 3.9634 4.0301 4.0301 4.6157 4.6157 4.7890 4.7890 4.8032 4.8032 4.8311 4.8311 4.9844 4.9844 5.0663 5.0663 12.9763 12.9763 14.5078 14.5078 14.5213 14.5213 15.0800 15.0800 k = 0.0000 0.1883-0.0000 ( 4316 PWs) bands (ev): -13.5331 -13.5331 -12.8821 -12.8821 -12.8656 -12.8656 -12.0407 -12.0407 -11.8101 -11.8101 -11.7230 -11.7230 -11.1591 -11.1591 -11.0593 -11.0593 -0.8412 -0.8412 -0.0257 -0.0257 0.1269 0.1269 0.9812 0.9812 1.0858 1.0858 1.7847 1.7847 2.5186 2.5186 2.7784 2.7784 2.8513 2.8513 3.0525 3.0525 3.0784 3.0784 3.4010 3.4010 3.6201 3.6201 3.7915 3.7915 3.7970 3.7970 3.8580 3.8580 3.9985 3.9985 4.0337 4.0337 4.6078 4.6078 4.7919 4.7919 4.8066 4.8066 4.8351 4.8351 5.0105 5.0105 5.0837 5.0837 12.9007 12.9007 14.4659 14.4659 14.5372 14.5372 15.0500 15.0500 k = 0.0000 0.1793-0.0000 ( 4316 PWs) bands (ev): -13.5565 -13.5565 -12.9051 -12.9051 -12.8608 -12.8608 -12.0184 -12.0184 -11.7933 -11.7933 -11.7155 -11.7155 -11.1578 -11.1578 -11.0503 -11.0503 -0.8563 -0.8563 0.0174 0.0174 0.0832 0.0832 0.9832 0.9832 1.0683 1.0683 1.8276 1.8276 2.5414 2.5414 2.7612 2.7612 2.7886 2.7886 2.9917 2.9917 3.0626 3.0626 3.4157 3.4157 3.6328 3.6328 3.7745 3.7745 3.7933 3.7933 3.8578 3.8578 4.0362 4.0362 4.0450 4.0450 4.6050 4.6050 4.7943 4.7943 4.8101 4.8101 4.8390 4.8390 5.0360 5.0360 5.1004 5.1004 12.8257 12.8257 14.4254 14.4254 14.5509 14.5509 15.0207 15.0207 k = 0.0000 0.1703-0.0000 ( 4314 PWs) bands (ev): -13.5791 -13.5791 -12.9271 -12.9271 -12.8573 -12.8573 -11.9969 -11.9969 -11.7757 -11.7757 -11.7085 -11.7085 -11.1562 -11.1562 -11.0413 -11.0413 -0.8709 -0.8709 0.0393 0.0393 0.0609 0.0609 0.9854 0.9854 1.0550 1.0550 1.8713 1.8713 2.5620 2.5620 2.7291 2.7291 2.7449 2.7449 2.9299 2.9299 3.0478 3.0478 3.4292 3.4292 3.6448 3.6448 3.7517 3.7517 3.7837 3.7837 3.8588 3.8588 4.0394 4.0394 4.0905 4.0905 4.6094 4.6094 4.7963 4.7963 4.8135 4.8135 4.8429 4.8429 5.0609 5.0609 5.1163 5.1163 12.7517 12.7517 14.3867 14.3867 14.5623 14.5623 14.9922 14.9922 k = 0.0000 0.1614-0.0000 ( 4312 PWs) bands (ev): -13.6007 -13.6007 -12.9482 -12.9482 -12.8550 -12.8550 -11.9761 -11.9761 -11.7577 -11.7577 -11.7020 -11.7020 -11.1545 -11.1545 -11.0321 -11.0321 -0.8851 -0.8851 -0.0048 -0.0048 0.1046 0.1046 0.9881 0.9881 1.0462 1.0462 1.9154 1.9154 2.5713 2.5713 2.6821 2.6821 2.7289 2.7289 2.8677 2.8677 3.0337 3.0337 3.4414 3.4414 3.6560 3.6560 3.7283 3.7283 3.7683 3.7683 3.8609 3.8609 4.0420 4.0420 4.1294 4.1294 4.6232 4.6232 4.7977 4.7977 4.8170 4.8170 4.8467 4.8467 5.0849 5.0849 5.1314 5.1314 12.6789 12.6789 14.3499 14.3499 14.5715 14.5715 14.9648 14.9648 k = 0.0000 0.1524-0.0000 ( 4308 PWs) bands (ev): -13.6214 -13.6214 -12.9684 -12.9684 -12.8537 -12.8537 -11.9559 -11.9559 -11.7396 -11.7396 -11.6960 -11.6960 -11.1525 -11.1525 -11.0229 -11.0229 -0.8989 -0.8989 -0.0486 -0.0486 0.1484 0.1484 0.9915 0.9915 1.0418 1.0418 1.9594 1.9594 2.5478 2.5478 2.6686 2.6686 2.7137 2.7137 2.8055 2.8055 3.0202 3.0202 3.4523 3.4523 3.6664 3.6664 3.7047 3.7047 3.7495 3.7495 3.8639 3.8639 4.0442 4.0442 4.1575 4.1575 4.6477 4.6477 4.7986 4.7986 4.8206 4.8206 4.8505 4.8505 5.1079 5.1079 5.1457 5.1457 12.6077 12.6077 14.3149 14.3149 14.5789 14.5789 14.9386 14.9386 k = 0.0000 0.1434-0.0000 ( 4304 PWs) bands (ev): -13.6411 -13.6411 -12.9875 -12.9875 -12.8534 -12.8534 -11.9364 -11.9364 -11.7215 -11.7215 -11.6905 -11.6905 -11.1505 -11.1505 -11.0138 -11.0138 -0.9121 -0.9121 -0.0920 -0.0920 0.1918 0.1918 0.9962 0.9962 1.0418 1.0418 2.0030 2.0030 2.4962 2.4962 2.6834 2.6834 2.6992 2.6992 2.7437 2.7437 3.0074 3.0074 3.4619 3.4619 3.6760 3.6760 3.6812 3.6812 3.7287 3.7287 3.8678 3.8678 4.0461 4.0461 4.1738 4.1738 4.6825 4.6825 4.7989 4.7989 4.8242 4.8242 4.8542 4.8542 5.1298 5.1298 5.1591 5.1591 12.5382 12.5382 14.2819 14.2819 14.5845 14.5845 14.9138 14.9138 k = 0.0000 0.1345-0.0000 ( 4302 PWs) bands (ev): -13.6597 -13.6597 -13.0056 -13.0056 -12.8537 -12.8537 -11.9177 -11.9177 -11.7038 -11.7038 -11.6855 -11.6855 -11.1483 -11.1483 -11.0048 -11.0048 -0.9249 -0.9249 -0.1346 -0.1346 0.2346 0.2346 1.0023 1.0023 1.0461 1.0461 2.0454 2.0454 2.4360 2.4360 2.6786 2.6786 2.6890 2.6890 2.7079 2.7079 2.9953 2.9953 3.4702 3.4702 3.6577 3.6577 3.6849 3.6849 3.7069 3.7069 3.8725 3.8725 4.0478 4.0478 4.1797 4.1797 4.7255 4.7255 4.7989 4.7989 4.8278 4.8278 4.8579 4.8579 5.1505 5.1505 5.1717 5.1717 12.4708 12.4708 14.2509 14.2509 14.5886 14.5886 14.8903 14.8903 k = 0.0000 0.1255-0.0000 ( 4302 PWs) bands (ev): -13.6774 -13.6774 -13.0226 -13.0226 -12.8547 -12.8547 -11.8998 -11.8998 -11.6865 -11.6865 -11.6809 -11.6809 -11.1459 -11.1459 -10.9960 -10.9960 -0.9371 -0.9371 -0.1761 -0.1761 0.2765 0.2765 1.0103 1.0103 1.0545 1.0545 2.0860 2.0860 2.3734 2.3734 2.6217 2.6217 2.6735 2.6735 2.7342 2.7342 2.9838 2.9838 3.4772 3.4772 3.6348 3.6348 3.6812 3.6812 3.6962 3.6962 3.8776 3.8776 4.0492 4.0492 4.1775 4.1775 4.7717 4.7717 4.8005 4.8005 4.8314 4.8314 4.8617 4.8617 5.1698 5.1698 5.1835 5.1835 12.4059 12.4059 14.2218 14.2218 14.5913 14.5913 14.8684 14.8684 k = 0.0000 0.1165-0.0000 ( 4302 PWs) bands (ev): -13.6939 -13.6939 -13.0386 -13.0386 -12.8561 -12.8561 -11.8827 -11.8827 -11.6769 -11.6769 -11.6697 -11.6697 -11.1435 -11.1435 -10.9874 -10.9874 -0.9486 -0.9486 -0.2161 -0.2161 0.3169 0.3169 1.0204 1.0204 1.0669 1.0669 2.1235 2.1235 2.3102 2.3102 2.5648 2.5648 2.6613 2.6613 2.7612 2.7612 2.9731 2.9731 3.4830 3.4830 3.6126 3.6126 3.6583 3.6583 3.7035 3.7035 3.8832 3.8832 4.0505 4.0505 4.1695 4.1695 4.7914 4.7914 4.8300 4.8300 4.8349 4.8349 4.8667 4.8667 5.1874 5.1874 5.1948 5.1948 12.3435 12.3435 14.1948 14.1948 14.5928 14.5928 14.8481 14.8481 k = 0.0000 0.1076-0.0000 ( 4290 PWs) bands (ev): -13.7093 -13.7093 -13.0535 -13.0535 -12.8579 -12.8579 -11.8666 -11.8666 -11.6732 -11.6732 -11.6539 -11.6539 -11.1410 -11.1410 -10.9792 -10.9792 -0.9595 -0.9595 -0.2545 -0.2545 0.3556 0.3556 1.0329 1.0329 1.0831 1.0831 2.1558 2.1558 2.2470 2.2470 2.5123 2.5123 2.6500 2.6500 2.7880 2.7880 2.9631 2.9631 3.4878 3.4878 3.5912 3.5912 3.6342 3.6342 3.7113 3.7113 3.8889 3.8889 4.0515 4.0515 4.1578 4.1578 4.7909 4.7909 4.8384 4.8384 4.8621 4.8621 4.8898 4.8898 5.2017 5.2017 5.2073 5.2073 12.2843 12.2843 14.1698 14.1698 14.5932 14.5932 14.8295 14.8295 k = 0.0000 0.0986-0.0000 ( 4290 PWs) bands (ev): -13.7236 -13.7236 -13.0672 -13.0672 -12.8599 -12.8599 -11.8515 -11.8515 -11.6700 -11.6700 -11.6389 -11.6389 -11.1386 -11.1386 -10.9713 -10.9713 -0.9697 -0.9697 -0.2909 -0.2909 0.3920 0.3920 1.0480 1.0480 1.1029 1.1029 2.1780 2.1780 2.1855 2.1855 2.4680 2.4680 2.6396 2.6396 2.8140 2.8140 2.9539 2.9539 3.4915 3.4915 3.5709 3.5709 3.6101 3.6101 3.7188 3.7188 3.8947 3.8947 4.0524 4.0524 4.1438 4.1438 4.7886 4.7886 4.8417 4.8417 4.8680 4.8680 4.9394 4.9394 5.2118 5.2118 5.2217 5.2217 12.2282 12.2282 14.1468 14.1468 14.5926 14.5926 14.8127 14.8127 k = 0.0000 0.0896-0.0000 ( 4286 PWs) bands (ev): -13.7367 -13.7367 -13.0798 -13.0798 -12.8621 -12.8621 -11.8375 -11.8375 -11.6671 -11.6671 -11.6250 -11.6250 -11.1361 -11.1361 -10.9640 -10.9640 -0.9792 -0.9792 -0.3250 -0.3250 0.4257 0.4257 1.0660 1.0660 1.1259 1.1259 2.1219 2.1219 2.1882 2.1882 2.4378 2.4378 2.6301 2.6301 2.8388 2.8388 2.9454 2.9454 3.4943 3.4943 3.5519 3.5519 3.5863 3.5863 3.7259 3.7259 3.9005 3.9005 4.0531 4.0531 4.1286 4.1286 4.7858 4.7858 4.8449 4.8449 4.8713 4.8713 4.9899 4.9899 5.2202 5.2202 5.2357 5.2357 12.1758 12.1758 14.1258 14.1258 14.5913 14.5913 14.7976 14.7976 k = 0.0000 0.0807-0.0000 ( 4274 PWs) bands (ev): -13.7486 -13.7486 -13.0913 -13.0913 -12.8643 -12.8643 -11.8246 -11.8246 -11.6645 -11.6645 -11.6121 -11.6121 -11.1337 -11.1337 -10.9571 -10.9571 -0.9878 -0.9878 -0.3566 -0.3566 0.4564 0.4564 1.0868 1.0868 1.1521 1.1521 2.0607 2.0607 2.1769 2.1769 2.4269 2.4269 2.6214 2.6214 2.8622 2.8622 2.9377 2.9377 3.4963 3.4963 3.5344 3.5344 3.5631 3.5631 3.7325 3.7325 3.9060 3.9060 4.0537 4.0537 4.1131 4.1131 4.7826 4.7826 4.8478 4.8478 4.8741 4.8741 5.0379 5.0379 5.2276 5.2276 5.2486 5.2486 12.1273 12.1273 14.1069 14.1069 14.5892 14.5892 14.7844 14.7844 k = 0.0000 0.0717-0.0000 ( 4286 PWs) bands (ev): -13.7594 -13.7594 -13.1016 -13.1016 -12.8665 -12.8665 -11.8129 -11.8129 -11.6623 -11.6623 -11.6004 -11.6004 -11.1313 -11.1313 -10.9508 -10.9508 -0.9956 -0.9956 -0.3856 -0.3856 0.4838 0.4838 1.1104 1.1104 1.1811 1.1811 2.0006 2.0006 2.1476 2.1476 2.4333 2.4333 2.6136 2.6136 2.8838 2.8838 2.9307 2.9307 3.4971 3.4971 3.5186 3.5186 3.5410 3.5410 3.7386 3.7386 3.9112 3.9112 4.0542 4.0542 4.0978 4.0978 4.7793 4.7793 4.8506 4.8506 4.8764 4.8764 5.0825 5.0825 5.2342 5.2342 5.2602 5.2602 12.0830 12.0830 14.0899 14.0899 14.5867 14.5867 14.7729 14.7729 k = 0.0000 0.0628-0.0000 ( 4292 PWs) bands (ev): -13.7689 -13.7689 -13.1107 -13.1107 -12.8686 -12.8686 -11.8025 -11.8025 -11.6604 -11.6604 -11.5900 -11.5900 -11.1292 -11.1292 -10.9451 -10.9451 -1.0026 -1.0026 -0.4116 -0.4116 0.5077 0.5077 1.1362 1.1362 1.2127 1.2127 1.9417 1.9417 2.1079 2.1079 2.4498 2.4498 2.6067 2.6067 2.9035 2.9035 2.9246 2.9246 3.4953 3.4953 3.5061 3.5061 3.5208 3.5208 3.7441 3.7441 3.9159 3.9159 4.0546 4.0546 4.0833 4.0833 4.7761 4.7761 4.8530 4.8530 4.8785 4.8785 5.1229 5.1229 5.2399 5.2399 5.2707 5.2707 12.0432 12.0432 14.0750 14.0750 14.5838 14.5838 14.7631 14.7631 k = 0.0000 0.0538-0.0000 ( 4292 PWs) bands (ev): -13.7771 -13.7771 -13.1186 -13.1186 -12.8705 -12.8705 -11.7934 -11.7934 -11.6588 -11.6588 -11.5809 -11.5809 -11.1272 -11.1272 -10.9401 -10.9401 -1.0086 -1.0086 -0.4345 -0.4345 0.5280 0.5280 1.1636 1.1636 1.2464 1.2464 1.8845 1.8845 2.0642 2.0642 2.4701 2.4701 2.6007 2.6007 2.9189 2.9189 2.9214 2.9214 3.4869 3.4869 3.4967 3.4967 3.5069 3.5069 3.7490 3.7490 3.9202 3.9202 4.0549 4.0549 4.0700 4.0700 4.7729 4.7729 4.8552 4.8552 4.8803 4.8803 5.1585 5.1585 5.2449 5.2449 5.2800 5.2800 12.0081 12.0081 14.0621 14.0621 14.5808 14.5808 14.7550 14.7550 k = 0.0000 0.0448-0.0000 ( 4293 PWs) bands (ev): -13.7841 -13.7841 -13.1253 -13.1253 -12.8722 -12.8722 -11.7856 -11.7856 -11.6575 -11.6575 -11.5731 -11.5731 -11.1254 -11.1254 -10.9358 -10.9358 -1.0138 -1.0138 -0.4542 -0.4542 0.5449 0.5449 1.1917 1.1917 1.2818 1.2818 1.8293 1.8293 2.0205 2.0205 2.4907 2.4907 2.5956 2.5956 2.9146 2.9146 2.9363 2.9363 3.4759 3.4759 3.4824 3.4824 3.5043 3.5043 3.7532 3.7532 3.9240 3.9240 4.0551 4.0551 4.0583 4.0583 4.7700 4.7700 4.8571 4.8571 4.8819 4.8819 5.1890 5.1890 5.2490 5.2490 5.2882 5.2882 11.9779 11.9779 14.0512 14.0512 14.5779 14.5779 14.7483 14.7483 k = 0.0000 0.0359-0.0000 ( 4301 PWs) bands (ev): -13.7899 -13.7899 -13.1309 -13.1309 -12.8737 -12.8737 -11.7792 -11.7792 -11.6564 -11.6564 -11.5666 -11.5666 -11.1239 -11.1239 -10.9322 -10.9322 -1.0180 -1.0180 -0.4705 -0.4705 0.5583 0.5583 1.2190 1.2190 1.3182 1.3182 1.7768 1.7768 1.9796 1.9796 2.5096 2.5096 2.5914 2.5914 2.9109 2.9109 2.9490 2.9490 3.4640 3.4640 3.4707 3.4707 3.5039 3.5039 3.7568 3.7568 3.9271 3.9271 4.0481 4.0481 4.0554 4.0554 4.7675 4.7675 4.8587 4.8587 4.8832 4.8832 5.2138 5.2138 5.2524 5.2524 5.2955 5.2955 11.9529 11.9529 14.0423 14.0423 14.5752 14.5752 14.7431 14.7431 k = 0.0000 0.0269-0.0000 ( 4301 PWs) bands (ev): -13.7944 -13.7944 -13.1351 -13.1351 -12.8748 -12.8748 -11.7742 -11.7742 -11.6556 -11.6556 -11.5616 -11.5616 -11.1227 -11.1227 -10.9294 -10.9294 -1.0213 -1.0213 -0.4833 -0.4833 0.5686 0.5686 1.2438 1.2438 1.3543 1.3543 1.7282 1.7282 1.9441 1.9441 2.5253 2.5253 2.5882 2.5882 2.9080 2.9080 2.9590 2.9590 3.4527 3.4527 3.4629 3.4629 3.5038 3.5038 3.7595 3.7595 3.9296 3.9296 4.0401 4.0401 4.0555 4.0555 4.7654 4.7654 4.8599 4.8599 4.8842 4.8842 5.2329 5.2329 5.2550 5.2550 5.3016 5.3016 11.9333 11.9333 14.0354 14.0354 14.5729 14.5729 14.7392 14.7392 k = 0.0000 0.0179-0.0000 ( 4297 PWs) bands (ev): -13.7976 -13.7976 -13.1382 -13.1382 -12.8757 -12.8757 -11.7706 -11.7706 -11.6551 -11.6551 -11.5580 -11.5580 -11.1218 -11.1218 -10.9273 -10.9273 -1.0236 -1.0236 -0.4925 -0.4925 0.5758 0.5758 1.2639 1.2639 1.3877 1.3877 1.6860 1.6860 1.9162 1.9162 2.5372 2.5372 2.5859 2.5859 2.9060 2.9060 2.9662 2.9662 3.4439 3.4439 3.4575 3.4575 3.5038 3.5038 3.7615 3.7615 3.9314 3.9314 4.0343 4.0343 4.0556 4.0556 4.7638 4.7638 4.8608 4.8608 4.8849 4.8849 5.2461 5.2461 5.2568 5.2568 5.3066 5.3066 11.9192 11.9192 14.0304 14.0304 14.5712 14.5712 14.7364 14.7364 k = 0.0000 0.0090-0.0000 ( 4299 PWs) bands (ev): -13.7995 -13.7995 -13.1401 -13.1401 -12.8762 -12.8762 -11.7684 -11.7684 -11.6547 -11.6547 -11.5558 -11.5558 -11.1213 -11.1213 -10.9261 -10.9261 -1.0250 -1.0250 -0.4980 -0.4980 0.5800 0.5800 1.2771 1.2771 1.4135 1.4135 1.6549 1.6549 1.8983 1.8983 2.5445 2.5445 2.5845 2.5845 2.9047 2.9047 2.9705 2.9705 3.4384 3.4384 3.4543 3.4543 3.5038 3.5038 3.7627 3.7627 3.9324 3.9324 4.0307 4.0307 4.0556 4.0556 4.7629 4.7629 4.8614 4.8614 4.8853 4.8853 5.2540 5.2540 5.2577 5.2577 5.3099 5.3099 11.9107 11.9107 14.0275 14.0275 14.5701 14.5701 14.7348 14.7348 k = 0.0000 0.0000 0.0000 ( 4295 PWs) bands (ev): -13.8001 -13.8001 -13.1407 -13.1407 -12.8764 -12.8764 -11.7677 -11.7677 -11.6546 -11.6546 -11.5551 -11.5551 -11.1211 -11.1211 -10.9257 -10.9257 -1.0255 -1.0255 -0.4999 -0.4999 0.5814 0.5814 1.2817 1.2817 1.4237 1.4237 1.6428 1.6428 1.8920 1.8920 2.5470 2.5470 2.5840 2.5840 2.9043 2.9043 2.9720 2.9720 3.4366 3.4366 3.4533 3.4533 3.5038 3.5038 3.7631 3.7631 3.9328 3.9328 4.0295 4.0295 4.0556 4.0556 4.7626 4.7626 4.8616 4.8616 4.8854 4.8854 5.2572 5.2572 5.2574 5.2574 5.3110 5.3110 11.9078 11.9078 14.0265 14.0265 14.5698 14.5698 14.7343 14.7343 k = 0.0000 0.0000 0.0000 ( 4295 PWs) bands (ev): -13.8001 -13.8001 -13.1407 -13.1407 -12.8764 -12.8764 -11.7677 -11.7677 -11.6546 -11.6546 -11.5551 -11.5551 -11.1211 -11.1211 -10.9257 -10.9257 -1.0255 -1.0255 -0.4999 -0.4999 0.5814 0.5814 1.2817 1.2817 1.4237 1.4237 1.6428 1.6428 1.8920 1.8920 2.5470 2.5470 2.5840 2.5840 2.9043 2.9043 2.9720 2.9720 3.4366 3.4366 3.4533 3.4533 3.5038 3.5038 3.7631 3.7631 3.9328 3.9328 4.0295 4.0295 4.0556 4.0556 4.7626 4.7626 4.8616 4.8616 4.8854 4.8854 5.2572 5.2572 5.2574 5.2574 5.3110 5.3110 11.9078 11.9078 14.0265 14.0265 14.5698 14.5698 14.7343 14.7343 k = 0.0000 0.0000 0.0089 ( 4303 PWs) bands (ev): -13.7994 -13.7994 -13.1467 -13.1467 -12.8696 -12.8696 -11.7700 -11.7700 -11.6545 -11.6545 -11.5554 -11.5554 -11.1200 -11.1200 -10.9258 -10.9258 -1.0242 -1.0242 -0.5005 -0.5005 0.5815 0.5815 1.2681 1.2681 1.4229 1.4229 1.6582 1.6582 1.8959 1.8959 2.5324 2.5324 2.5845 2.5845 2.9031 2.9031 2.9878 2.9878 3.4338 3.4338 3.4458 3.4458 3.5050 3.5050 3.7632 3.7632 3.9327 3.9327 4.0368 4.0368 4.0549 4.0549 4.7616 4.7616 4.8616 4.8616 4.8855 4.8855 5.2509 5.2509 5.2607 5.2607 5.3107 5.3107 11.9112 11.9112 14.0148 14.0148 14.5720 14.5720 14.7435 14.7435 k = 0.0000 0.0000 0.0178 ( 4307 PWs) bands (ev): -13.7972 -13.7972 -13.1634 -13.1634 -12.8510 -12.8510 -11.7768 -11.7768 -11.6541 -11.6541 -11.5561 -11.5561 -11.1167 -11.1167 -10.9262 -10.9262 -1.0204 -1.0204 -0.5026 -0.5026 0.5819 0.5819 1.2328 1.2328 1.4208 1.4208 1.6989 1.6989 1.9074 1.9074 2.4938 2.4938 2.5859 2.5859 2.8997 2.8997 3.0299 3.0299 3.4221 3.4221 3.4278 3.4278 3.5089 3.5089 3.7633 3.7633 3.9323 3.9323 4.0528 4.0528 4.0576 4.0576 4.7585 4.7585 4.8619 4.8619 4.8855 4.8855 5.2414 5.2414 5.2614 5.2614 5.3096 5.3096 11.9214 11.9214 13.9816 13.9816 14.5788 14.5788 14.7693 14.7693 k = 0.0000 0.0000 0.0267 ( 4291 PWs) bands (ev): -13.7936 -13.7936 -13.1872 -13.1872 -12.8237 -12.8237 -11.7880 -11.7880 -11.6534 -11.6534 -11.5573 -11.5573 -11.1114 -11.1114 -10.9268 -10.9268 -1.0140 -1.0140 -0.5061 -0.5061 0.5825 0.5825 1.1853 1.1853 1.4179 1.4179 1.7551 1.7551 1.9260 1.9260 2.4407 2.4407 2.5882 2.5882 2.8941 2.8941 3.0888 3.0888 3.3899 3.3899 3.4136 3.4136 3.5152 3.5152 3.7634 3.7634 3.9317 3.9317 4.0494 4.0494 4.0892 4.0892 4.7531 4.7531 4.8624 4.8624 4.8855 4.8855 5.2287 5.2287 5.2597 5.2597 5.3079 5.3079 11.9382 11.9382 13.9310 13.9310 14.5901 14.5901 14.8073 14.8073 k = 0.0000 0.0000 0.0356 ( 4293 PWs) bands (ev): -13.7885 -13.7885 -13.2154 -13.2154 -12.7908 -12.7908 -11.8035 -11.8035 -11.6524 -11.6524 -11.5590 -11.5590 -11.1044 -11.1044 -10.9276 -10.9276 -1.0051 -1.0051 -0.5110 -0.5110 0.5833 0.5833 1.1326 1.1326 1.4150 1.4150 1.8201 1.8201 1.9509 1.9509 2.3802 2.3802 2.5915 2.5915 2.8866 2.8866 3.1572 3.1572 3.3482 3.3482 3.3951 3.3951 3.5240 3.5240 3.7635 3.7635 3.9309 3.9309 4.0447 4.0447 4.1287 4.1287 4.7448 4.7448 4.8630 4.8630 4.8856 4.8856 5.2128 5.2128 5.2560 5.2560 5.3056 5.3056 11.9616 11.9616 13.8677 13.8677 14.6058 14.6058 14.8529 14.8529 k = 0.0000 0.0000 0.0445 ( 4285 PWs) bands (ev): -13.7820 -13.7820 -13.2458 -13.2458 -12.7542 -12.7542 -11.8228 -11.8228 -11.6509 -11.6509 -11.5611 -11.5611 -11.0960 -11.0960 -10.9287 -10.9287 -0.9938 -0.9938 -0.5174 -0.5174 0.5843 0.5843 1.0784 1.0784 1.4131 1.4131 1.8900 1.8900 1.9813 1.9813 2.3162 2.3162 2.5958 2.5958 2.8773 2.8773 3.2296 3.2296 3.3019 3.3019 3.3719 3.3719 3.5349 3.5349 3.7636 3.7636 3.9300 3.9300 4.0387 4.0387 4.1737 4.1737 4.7333 4.7333 4.8638 4.8638 4.8856 4.8856 5.1939 5.1939 5.2510 5.2510 5.3028 5.3028 11.9913 11.9913 13.7953 13.7953 14.6257 14.6257 14.9021 14.9021 k = 0.0000 0.0000 0.0534 ( 4287 PWs) bands (ev): -13.7741 -13.7741 -13.2775 -13.2775 -12.7152 -12.7152 -11.8456 -11.8456 -11.6491 -11.6491 -11.5636 -11.5636 -11.0864 -11.0864 -10.9302 -10.9302 -0.9801 -0.9801 -0.5255 -0.5255 0.5854 0.5854 1.0247 1.0247 1.4127 1.4127 1.9627 1.9627 2.0166 2.0166 2.2511 2.2511 2.6009 2.6009 2.8665 2.8665 3.2419 3.2419 3.3140 3.3140 3.3446 3.3446 3.5476 3.5476 3.7635 3.7635 3.9289 3.9289 4.0316 4.0316 4.2223 4.2223 4.7177 4.7177 4.8648 4.8648 4.8856 4.8856 5.1722 5.1722 5.2450 5.2450 5.2993 5.2993 12.0273 12.0273 13.7165 13.7165 14.6496 14.6496 14.9518 14.9518 k = 0.0000 0.0000 0.0623 ( 4289 PWs) bands (ev): -13.7647 -13.7647 -13.3095 -13.3095 -12.6745 -12.6745 -11.8716 -11.8716 -11.6469 -11.6469 -11.5666 -11.5666 -11.0761 -11.0761 -10.9319 -10.9319 -0.9643 -0.9643 -0.5353 -0.5353 0.5868 0.5868 0.9729 0.9729 1.4148 1.4148 2.0364 2.0364 2.0562 2.0562 2.1866 2.1866 2.6069 2.6069 2.8545 2.8545 3.1882 3.1882 3.3101 3.3101 3.3939 3.3939 3.5619 3.5619 3.7632 3.7632 3.9278 3.9278 4.0236 4.0236 4.2731 4.2731 4.6975 4.6975 4.8659 4.8659 4.8856 4.8856 5.1478 5.1478 5.2388 5.2388 5.2954 5.2954 12.0692 12.0692 13.6332 13.6332 14.6773 14.6773 14.9997 14.9997 k = 0.0000 0.0000 0.0712 ( 4293 PWs) bands (ev): -13.7539 -13.7539 -13.3414 -13.3414 -12.6326 -12.6326 -11.9004 -11.9004 -11.6444 -11.6444 -11.5699 -11.5699 -11.0652 -11.0652 -10.9341 -10.9341 -0.9465 -0.9465 -0.5468 -0.5468 0.5883 0.5883 0.9236 0.9236 1.4197 1.4197 2.0973 2.0973 2.1012 2.1012 2.1350 2.1350 2.6138 2.6138 2.8415 2.8415 3.1305 3.1305 3.2731 3.2731 3.4748 3.4748 3.5774 3.5774 3.7626 3.7626 3.9267 3.9267 4.0147 4.0147 4.3253 4.3253 4.6719 4.6719 4.8671 4.8671 4.8855 4.8855 5.1210 5.1210 5.2330 5.2330 5.2910 5.2910 12.1167 12.1167 13.5467 13.5467 14.7086 14.7086 15.0438 15.0438 k = 0.0000 0.0000 0.0801 ( 4299 PWs) bands (ev): -13.7416 -13.7416 -13.3730 -13.3730 -12.5898 -12.5898 -11.9317 -11.9317 -11.6414 -11.6414 -11.5735 -11.5735 -11.0541 -11.0541 -10.9366 -10.9366 -0.9267 -0.9267 -0.5602 -0.5602 0.5902 0.5902 0.8775 0.8775 1.4280 1.4280 2.0546 2.0546 2.1440 2.1440 2.1939 2.1939 2.6216 2.6216 2.8277 2.8277 3.0710 3.0710 3.2318 3.2318 3.5561 3.5561 3.5948 3.5948 3.7616 3.7616 3.9257 3.9257 4.0052 4.0052 4.3782 4.3782 4.6407 4.6407 4.8685 4.8685 4.8853 4.8853 5.0919 5.0919 5.2281 5.2281 5.2861 5.2861 12.1696 12.1696 13.4582 13.4582 14.7431 14.7431 15.0823 15.0823 k = 0.0000 0.0000 0.0890 ( 4285 PWs) bands (ev): -13.7280 -13.7280 -13.4040 -13.4040 -12.5464 -12.5464 -11.9651 -11.9651 -11.6382 -11.6382 -11.5774 -11.5774 -11.0431 -11.0431 -10.9396 -10.9396 -0.9052 -0.9052 -0.5754 -0.5754 0.5925 0.5925 0.8349 0.8349 1.4400 1.4400 1.9940 1.9940 2.1926 2.1926 2.2692 2.2692 2.6302 2.6302 2.8134 2.8134 3.0105 3.0105 3.1866 3.1866 3.6077 3.6077 3.6428 3.6428 3.7601 3.7601 3.9248 3.9248 3.9952 3.9952 4.4313 4.4313 4.6035 4.6035 4.8699 4.8699 4.8851 4.8851 5.0605 5.0605 5.2245 5.2245 5.2808 5.2808 12.2275 12.2275 13.3683 13.3683 14.7803 14.7803 15.1138 15.1138 k = 0.0000 0.0000 0.0979 ( 4279 PWs) bands (ev): -13.7131 -13.7131 -13.4343 -13.4343 -12.5027 -12.5027 -12.0005 -12.0005 -11.6346 -11.6346 -11.5815 -11.5815 -11.0321 -11.0321 -10.9431 -10.9431 -0.8823 -0.8823 -0.5925 -0.5925 0.5955 0.5955 0.7961 0.7961 1.4558 1.4558 1.9348 1.9348 2.2433 2.2433 2.3450 2.3450 2.6396 2.6396 2.7987 2.7987 2.9493 2.9493 3.1376 3.1376 3.6261 3.6261 3.7241 3.7241 3.7578 3.7578 3.9243 3.9243 3.9851 3.9851 4.4841 4.4841 4.5604 4.5604 4.8714 4.8714 4.8847 4.8847 5.0271 5.0271 5.2225 5.2225 5.2752 5.2752 12.2901 12.2901 13.2776 13.2776 14.8199 14.8199 15.1366 15.1366 k = 0.0000 0.0000 0.1067 ( 4275 PWs) bands (ev): -13.6967 -13.6967 -13.4637 -13.4637 -12.4587 -12.4587 -12.0375 -12.0375 -11.6308 -11.6308 -11.5858 -11.5858 -11.0215 -11.0215 -10.9472 -10.9472 -0.8581 -0.8581 -0.6114 -0.6114 0.5994 0.5994 0.7613 0.7613 1.4756 1.4756 1.8777 1.8777 2.2961 2.2961 2.4203 2.4203 2.6498 2.6498 2.7837 2.7837 2.8877 2.8877 3.0851 3.0851 3.6433 3.6433 3.7544 3.7544 3.8061 3.8061 3.9242 3.9242 3.9751 3.9751 4.5115 4.5115 4.5365 4.5365 4.8729 4.8729 4.8841 4.8841 4.9915 4.9915 5.2220 5.2220 5.2693 5.2693 12.3570 12.3570 13.1868 13.1868 14.8613 14.8613 15.1496 15.1496 k = 0.0000 0.0000 0.1156 ( 4270 PWs) bands (ev): -13.6790 -13.6790 -13.4921 -13.4921 -12.4147 -12.4147 -12.0760 -12.0760 -11.6268 -11.6268 -11.5903 -11.5903 -11.0114 -11.0114 -10.9518 -10.9518 -0.8329 -0.8329 -0.6321 -0.6321 0.6045 0.6045 0.7303 0.7303 1.4995 1.4995 1.8231 1.8231 2.3505 2.3505 2.4948 2.4948 2.6607 2.6607 2.7687 2.7687 2.8262 2.8262 3.0294 3.0294 3.6600 3.6600 3.7500 3.7500 3.8873 3.8873 3.9248 3.9248 3.9654 3.9654 4.4572 4.4572 4.5881 4.5881 4.8743 4.8743 4.8834 4.8834 4.9540 4.9540 5.2231 5.2231 5.2632 5.2632 12.4280 12.4280 13.0962 13.0962 14.9039 14.9039 15.1520 15.1520 k = 0.0000 0.0000 0.1245 ( 4278 PWs) bands (ev): -13.6600 -13.6600 -13.5196 -13.5196 -12.3707 -12.3707 -12.1157 -12.1157 -11.6226 -11.6226 -11.5949 -11.5949 -11.0017 -11.0017 -10.9570 -10.9570 -0.8070 -0.8070 -0.6543 -0.6543 0.6112 0.6112 0.7033 0.7033 1.5273 1.5273 1.7712 1.7712 2.4065 2.4065 2.5681 2.5681 2.6721 2.6721 2.7530 2.7530 2.7658 2.7658 2.9708 2.9708 3.6760 3.6760 3.7442 3.7442 3.9259 3.9259 3.9564 3.9564 3.9674 3.9674 4.3980 4.3980 4.6388 4.6388 4.8755 4.8755 4.8824 4.8824 4.9148 4.9148 5.2256 5.2256 5.2570 5.2570 12.5026 12.5026 13.0063 13.0063 14.9468 14.9468 15.1438 15.1438 k = 0.0000 0.0000 0.1334 ( 4276 PWs) bands (ev): -13.6397 -13.6397 -13.5459 -13.5459 -12.3269 -12.3269 -12.1564 -12.1564 -11.6182 -11.6182 -11.5996 -11.5996 -10.9926 -10.9926 -10.9628 -10.9628 -0.7807 -0.7807 -0.6779 -0.6779 0.6197 0.6197 0.6801 0.6801 1.5590 1.5590 1.7222 1.7222 2.4637 2.4637 2.6400 2.6400 2.6827 2.6827 2.7047 2.7047 2.7399 2.7399 2.9093 2.9093 3.6910 3.6910 3.7368 3.7368 3.9281 3.9281 3.9484 3.9484 4.0457 4.0457 4.3344 4.3344 4.6883 4.6883 4.8686 4.8686 4.8789 4.8789 4.8843 4.8843 5.2292 5.2292 5.2508 5.2508 12.5804 12.5804 12.9175 12.9175 14.9891 14.9891 15.1260 15.1260 k = 0.0000 0.0000 0.1423 ( 4276 PWs) bands (ev): -13.6181 -13.6181 -13.5712 -13.5712 -12.2835 -12.2835 -12.1981 -12.1981 -11.6136 -11.6136 -11.6043 -11.6043 -10.9842 -10.9842 -10.9693 -10.9693 -0.7543 -0.7543 -0.7026 -0.7026 0.6305 0.6305 0.6604 0.6604 1.5945 1.5945 1.6762 1.6762 2.5221 2.5221 2.6410 2.6410 2.6981 2.6981 2.7109 2.7109 2.7256 2.7256 2.8453 2.8453 3.7048 3.7048 3.7278 3.7278 3.9314 3.9314 3.9415 3.9415 4.1220 4.1220 4.2668 4.2668 4.7364 4.7364 4.8279 4.8279 4.8791 4.8791 4.8816 4.8816 5.2337 5.2337 5.2447 5.2447 12.6612 12.6612 12.8301 12.8301 15.0297 15.0297 15.0998 15.0998 k = 0.0000 0.0000 0.1512 ( 4274 PWs) bands (ev): -13.5952 -13.5952 -13.5952 -13.5952 -12.2405 -12.2405 -12.2405 -12.2405 -11.6090 -11.6090 -11.6090 -11.6090 -10.9764 -10.9764 -10.9764 -10.9764 -0.7282 -0.7282 -0.7282 -0.7282 0.6440 0.6440 0.6440 0.6440 1.6336 1.6336 1.6336 1.6336 2.5813 2.5813 2.5813 2.5813 2.7115 2.7115 2.7115 2.7115 2.7791 2.7791 2.7791 2.7791 3.7171 3.7171 3.7171 3.7171 3.9358 3.9358 3.9358 3.9358 4.1959 4.1959 4.1959 4.1959 4.7831 4.7831 4.7831 4.7831 4.8803 4.8803 4.8803 4.8803 5.2390 5.2390 5.2390 5.2390 12.7446 12.7446 12.7446 12.7446 15.0671 15.0671 15.0671 15.0671 k = 0.0000 0.0000 0.1512 ( 4274 PWs) bands (ev): -13.5952 -13.5952 -13.5952 -13.5952 -12.2405 -12.2405 -12.2405 -12.2405 -11.6090 -11.6090 -11.6090 -11.6090 -10.9764 -10.9764 -10.9764 -10.9764 -0.7282 -0.7282 -0.7282 -0.7282 0.6440 0.6440 0.6440 0.6440 1.6336 1.6336 1.6336 1.6336 2.5813 2.5813 2.5813 2.5813 2.7115 2.7115 2.7115 2.7115 2.7791 2.7791 2.7791 2.7791 3.7171 3.7171 3.7171 3.7171 3.9358 3.9358 3.9358 3.9358 4.1959 4.1959 4.1959 4.1959 4.7831 4.7831 4.7831 4.7831 4.8803 4.8803 4.8803 4.8803 5.2390 5.2390 5.2390 5.2390 12.7446 12.7446 12.7446 12.7446 15.0671 15.0671 15.0671 15.0671 k = 0.0089-0.0000 0.1512 ( 4282 PWs) bands (ev): -13.5945 -13.5945 -13.5945 -13.5945 -12.2401 -12.2401 -12.2401 -12.2401 -11.6088 -11.6088 -11.6087 -11.6087 -10.9763 -10.9763 -10.9763 -10.9763 -0.7276 -0.7276 -0.7275 -0.7275 0.6446 0.6446 0.6446 0.6446 1.6328 1.6328 1.6328 1.6328 2.5809 2.5809 2.5820 2.5820 2.7086 2.7086 2.7103 2.7103 2.7785 2.7785 2.7798 2.7798 3.7120 3.7120 3.7127 3.7127 3.9335 3.9335 3.9336 3.9336 4.1969 4.1969 4.1972 4.1972 4.7818 4.7818 4.7830 4.7830 4.8797 4.8797 4.8800 4.8800 5.2392 5.2392 5.2396 5.2396 12.7473 12.7473 12.7473 12.7473 15.0707 15.0707 15.0707 15.0707 k = 0.0179-0.0000 0.1512 ( 4282 PWs) bands (ev): -13.5924 -13.5924 -13.5924 -13.5924 -12.2389 -12.2389 -12.2388 -12.2388 -11.6080 -11.6080 -11.6079 -11.6079 -10.9761 -10.9761 -10.9761 -10.9761 -0.7256 -0.7256 -0.7255 -0.7255 0.6464 0.6464 0.6465 0.6465 1.6303 1.6303 1.6304 1.6304 2.5806 2.5806 2.5828 2.5828 2.7018 2.7018 2.7051 2.7051 2.7779 2.7779 2.7804 2.7804 3.6978 3.6978 3.6992 3.6992 3.9269 3.9269 3.9271 3.9271 4.1999 4.1999 4.2006 4.2006 4.7793 4.7793 4.7816 4.7816 4.8782 4.8782 4.8788 4.8788 5.2401 5.2401 5.2409 5.2409 12.7556 12.7556 12.7556 12.7556 15.0815 15.0815 15.0815 15.0815 k = 0.0268-0.0000 0.1512 ( 4282 PWs) bands (ev): -13.5890 -13.5890 -13.5890 -13.5890 -12.2368 -12.2368 -12.2368 -12.2368 -11.6068 -11.6068 -11.6066 -11.6066 -10.9758 -10.9758 -10.9758 -10.9758 -0.7223 -0.7223 -0.7221 -0.7221 0.6495 0.6495 0.6497 0.6497 1.6261 1.6261 1.6262 1.6262 2.5803 2.5803 2.5838 2.5838 2.6918 2.6918 2.6966 2.6966 2.7770 2.7770 2.7803 2.7803 3.6752 3.6752 3.6774 3.6774 3.9160 3.9160 3.9163 3.9163 4.2040 4.2040 4.2051 4.2051 4.7755 4.7755 4.7788 4.7788 4.8759 4.8759 4.8768 4.8768 5.2417 5.2417 5.2430 5.2430 12.7694 12.7694 12.7694 12.7694 15.0993 15.0993 15.0995 15.0995 k = 0.0357-0.0000 0.1512 ( 4274 PWs) bands (ev): -13.5841 -13.5841 -13.5841 -13.5841 -12.2340 -12.2340 -12.2339 -12.2339 -11.6050 -11.6050 -11.6048 -11.6048 -10.9753 -10.9753 -10.9753 -10.9753 -0.7176 -0.7176 -0.7174 -0.7174 0.6538 0.6538 0.6541 0.6541 1.6201 1.6201 1.6202 1.6202 2.5793 2.5793 2.5845 2.5845 2.6793 2.6793 2.6857 2.6857 2.7754 2.7754 2.7794 2.7794 3.6453 3.6453 3.6482 3.6482 3.9012 3.9012 3.9017 3.9017 4.2082 4.2082 4.2096 4.2096 4.7706 4.7706 4.7749 4.7749 4.8731 4.8731 4.8741 4.8741 5.2440 5.2440 5.2457 5.2457 12.7885 12.7885 12.7885 12.7885 15.1242 15.1242 15.1244 15.1244 k = 0.0446-0.0000 0.1512 ( 4270 PWs) bands (ev): -13.5779 -13.5779 -13.5779 -13.5779 -12.2304 -12.2304 -12.2303 -12.2303 -11.6028 -11.6028 -11.6026 -11.6026 -10.9747 -10.9747 -10.9747 -10.9747 -0.7117 -0.7117 -0.7114 -0.7114 0.6593 0.6593 0.6597 0.6597 1.6122 1.6122 1.6124 1.6124 2.5769 2.5769 2.5841 2.5841 2.6655 2.6655 2.6736 2.6736 2.7728 2.7728 2.7772 2.7772 3.6094 3.6094 3.6130 3.6130 3.8827 3.8827 3.8834 3.8834 4.2112 4.2112 4.2130 4.2130 4.7646 4.7646 4.7698 4.7698 4.8697 4.8697 4.8708 4.8708 5.2469 5.2469 5.2490 5.2490 12.8129 12.8129 12.8129 12.8129 15.1559 15.1559 15.1561 15.1561 k = 0.0536-0.0000 0.1512 ( 4282 PWs) bands (ev): -13.5703 -13.5703 -13.5703 -13.5703 -12.2259 -12.2259 -12.2259 -12.2259 -11.6001 -11.6001 -11.5998 -11.5998 -10.9740 -10.9740 -10.9740 -10.9740 -0.7045 -0.7045 -0.7041 -0.7041 0.6661 0.6661 0.6665 0.6665 1.6024 1.6024 1.6026 1.6026 2.5714 2.5714 2.5809 2.5809 2.6521 2.6521 2.6621 2.6621 2.7689 2.7689 2.7736 2.7736 3.5685 3.5685 3.5728 3.5728 3.8607 3.8607 3.8616 3.8616 4.2120 4.2120 4.2140 4.2140 4.7578 4.7578 4.7637 4.7637 4.8661 4.8661 4.8670 4.8670 5.2502 5.2502 5.2528 5.2528 12.8424 12.8424 12.8425 12.8425 15.1942 15.1942 15.1944 15.1944 k = 0.0625-0.0000 0.1512 ( 4286 PWs) bands (ev): -13.5613 -13.5613 -13.5613 -13.5613 -12.2208 -12.2208 -12.2207 -12.2207 -11.5969 -11.5969 -11.5966 -11.5966 -10.9732 -10.9732 -10.9732 -10.9732 -0.6959 -0.6959 -0.6955 -0.6955 0.6739 0.6739 0.6745 0.6745 1.5905 1.5905 1.5907 1.5907 2.5610 2.5610 2.5720 2.5720 2.6422 2.6422 2.6533 2.6533 2.7636 2.7636 2.7685 2.7685 3.5238 3.5238 3.5288 3.5288 3.8355 3.8355 3.8366 3.8366 4.2096 4.2096 4.2120 4.2120 4.7503 4.7503 4.7568 4.7568 4.8623 4.8623 4.8628 4.8628 5.2538 5.2538 5.2568 5.2568 12.8769 12.8769 12.8769 12.8769 15.2388 15.2388 15.2391 15.2391 k = 0.0714-0.0000 0.1512 ( 4284 PWs) bands (ev): -13.5510 -13.5510 -13.5510 -13.5510 -12.2148 -12.2148 -12.2147 -12.2147 -11.5933 -11.5933 -11.5929 -11.5929 -10.9723 -10.9723 -10.9723 -10.9723 -0.6862 -0.6862 -0.6857 -0.6857 0.6829 0.6829 0.6835 0.6835 1.5763 1.5763 1.5767 1.5767 2.5443 2.5443 2.5555 2.5555 2.6379 2.6379 2.6485 2.6485 2.7568 2.7568 2.7619 2.7619 3.4762 3.4762 3.4820 3.4820 3.8074 3.8074 3.8086 3.8086 4.2036 4.2036 4.2063 4.2063 4.7425 4.7425 4.7495 4.7495 4.8582 4.8582 4.8583 4.8583 5.2577 5.2577 5.2611 5.2611 12.9161 12.9161 12.9162 12.9162 15.2896 15.2896 15.2899 15.2899 k = 0.0804-0.0000 0.1512 ( 4290 PWs) bands (ev): -13.5393 -13.5393 -13.5393 -13.5393 -12.2081 -12.2081 -12.2080 -12.2080 -11.5891 -11.5891 -11.5887 -11.5887 -10.9713 -10.9713 -10.9713 -10.9713 -0.6752 -0.6752 -0.6747 -0.6747 0.6930 0.6930 0.6936 0.6936 1.5599 1.5599 1.5603 1.5603 2.5215 2.5215 2.5319 2.5319 2.6385 2.6385 2.6477 2.6477 2.7485 2.7485 2.7536 2.7536 3.4268 3.4268 3.4332 3.4332 3.7766 3.7766 3.7780 3.7780 4.1934 4.1934 4.1964 4.1964 4.7346 4.7346 4.7419 4.7419 4.8536 4.8536 4.8539 4.8539 5.2616 5.2616 5.2655 5.2655 12.9599 12.9599 12.9600 12.9600 15.3460 15.3460 15.3463 15.3463 k = 0.0893-0.0000 0.1512 ( 4290 PWs) bands (ev): -13.5264 -13.5264 -13.5263 -13.5263 -12.2007 -12.2007 -12.2006 -12.2006 -11.5846 -11.5846 -11.5841 -11.5841 -10.9703 -10.9703 -10.9702 -10.9702 -0.6630 -0.6630 -0.6624 -0.6624 0.7040 0.7040 0.7048 0.7048 1.5410 1.5410 1.5415 1.5415 2.4933 2.4933 2.5029 2.5029 2.6422 2.6422 2.6498 2.6498 2.7387 2.7387 2.7437 2.7437 3.3763 3.3763 3.3834 3.3834 3.7434 3.7434 3.7450 3.7450 4.1789 4.1789 4.1821 4.1821 4.7268 4.7268 4.7342 4.7342 4.8486 4.8486 4.8495 4.8495 5.2656 5.2656 5.2698 5.2698 13.0080 13.0080 13.0080 13.0080 15.4077 15.4077 15.4081 15.4081 k = 0.0982-0.0000 0.1512 ( 4286 PWs) bands (ev): -13.5121 -13.5121 -13.5120 -13.5120 -12.1926 -12.1926 -12.1925 -12.1925 -11.5796 -11.5796 -11.5790 -11.5790 -10.9691 -10.9691 -10.9691 -10.9691 -0.6497 -0.6497 -0.6490 -0.6490 0.7160 0.7160 0.7168 0.7168 1.5197 1.5197 1.5202 1.5202 2.4606 2.4606 2.4697 2.4697 2.6477 2.6477 2.6539 2.6539 2.7275 2.7275 2.7322 2.7322 3.3256 3.3256 3.3333 3.3333 3.7083 3.7083 3.7101 3.7101 4.1601 4.1601 4.1635 4.1635 4.7191 4.7191 4.7266 4.7266 4.8433 4.8433 4.8448 4.8448 5.2693 5.2693 5.2739 5.2739 13.0602 13.0602 13.0602 13.0602 15.4743 15.4743 15.4747 15.4747 k = 0.1071-0.0000 0.1512 ( 4284 PWs) bands (ev): -13.4965 -13.4965 -13.4964 -13.4964 -12.1839 -12.1839 -12.1837 -12.1837 -11.5742 -11.5742 -11.5736 -11.5736 -10.9680 -10.9680 -10.9680 -10.9680 -0.6352 -0.6352 -0.6345 -0.6345 0.7287 0.7287 0.7297 0.7297 1.4958 1.4958 1.4964 1.4964 2.4237 2.4237 2.4325 2.4325 2.6545 2.6545 2.6590 2.6590 2.7151 2.7151 2.7192 2.7192 3.2753 3.2753 3.2835 3.2835 3.6716 3.6716 3.6735 3.6735 4.1372 4.1372 4.1407 4.1407 4.7117 4.7117 4.7191 4.7191 4.8377 4.8377 4.8399 4.8399 5.2727 5.2727 5.2776 5.2776 13.1161 13.1161 13.1161 13.1161 15.5454 15.5454 15.5458 15.5458 k = 0.1161-0.0000 0.1512 ( 4288 PWs) bands (ev): -13.4796 -13.4796 -13.4796 -13.4796 -12.1745 -12.1745 -12.1743 -12.1743 -11.5683 -11.5683 -11.5677 -11.5677 -10.9668 -10.9668 -10.9668 -10.9668 -0.6197 -0.6197 -0.6189 -0.6189 0.7422 0.7422 0.7432 0.7432 1.4695 1.4695 1.4702 1.4702 2.3829 2.3829 2.3914 2.3914 2.6619 2.6619 2.6640 2.6640 2.7023 2.7023 2.7047 2.7047 3.2261 3.2261 3.2348 3.2348 3.6338 3.6338 3.6357 3.6357 4.1105 4.1105 4.1140 4.1140 4.7045 4.7045 4.7117 4.7117 4.8318 4.8318 4.8346 4.8346 5.2757 5.2757 5.2809 5.2809 13.1756 13.1756 13.1756 13.1756 15.6203 15.6203 15.6207 15.6207 k = 0.1250-0.0000 0.1512 ( 4298 PWs) bands (ev): -13.4615 -13.4615 -13.4614 -13.4614 -12.1645 -12.1645 -12.1643 -12.1643 -11.5622 -11.5622 -11.5615 -11.5615 -10.9657 -10.9657 -10.9657 -10.9657 -0.6032 -0.6032 -0.6023 -0.6023 0.7562 0.7562 0.7573 0.7573 1.4409 1.4409 1.4417 1.4417 2.3380 2.3380 2.3463 2.3463 2.6656 2.6656 2.6694 2.6694 2.6893 2.6893 2.6922 2.6922 3.1786 3.1786 3.1876 3.1876 3.5952 3.5952 3.5972 3.5972 4.0804 4.0804 4.0839 4.0839 4.6973 4.6973 4.7043 4.7043 4.8256 4.8256 4.8290 4.8290 5.2782 5.2782 5.2837 5.2837 13.2383 13.2383 13.2384 13.2384 15.6985 15.6985 15.6989 15.6989 k = 0.1339-0.0000 0.1512 ( 4302 PWs) bands (ev): -13.4421 -13.4421 -13.4421 -13.4421 -12.1539 -12.1539 -12.1537 -12.1537 -11.5556 -11.5556 -11.5549 -11.5549 -10.9646 -10.9646 -10.9645 -10.9645 -0.5858 -0.5858 -0.5848 -0.5848 0.7705 0.7705 0.7717 0.7717 1.4102 1.4102 1.4111 1.4111 2.2890 2.2890 2.2972 2.2972 2.6574 2.6574 2.6686 2.6686 2.6813 2.6813 2.6911 2.6911 3.1332 3.1332 3.1424 3.1424 3.5563 3.5563 3.5584 3.5584 4.0475 4.0475 4.0509 4.0509 4.6900 4.6900 4.6967 4.6967 4.8190 4.8190 4.8231 4.8231 5.2801 5.2801 5.2857 5.2857 13.3041 13.3041 13.3042 13.3042 15.7793 15.7793 15.7797 15.7797 k = 0.1429-0.0000 0.1512 ( 4306 PWs) bands (ev): -13.4215 -13.4215 -13.4215 -13.4215 -12.1428 -12.1428 -12.1425 -12.1425 -11.5487 -11.5487 -11.5480 -11.5480 -10.9635 -10.9635 -10.9635 -10.9635 -0.5675 -0.5675 -0.5664 -0.5664 0.7848 0.7848 0.7861 0.7861 1.3778 1.3778 1.3788 1.3788 2.2357 2.2357 2.2439 2.2439 2.6418 2.6418 2.6515 2.6515 2.6882 2.6882 2.6962 2.6962 3.0903 3.0903 3.0995 3.0995 3.5177 3.5177 3.5196 3.5196 4.0123 4.0123 4.0156 4.0156 4.6825 4.6825 4.6888 4.6888 4.8121 4.8121 4.8168 4.8168 5.2812 5.2812 5.2870 5.2870 13.3726 13.3726 13.3727 13.3727 15.8619 15.8619 15.8624 15.8624 k = 0.1518-0.0000 0.1512 ( 4292 PWs) bands (ev): -13.3998 -13.3998 -13.3997 -13.3997 -12.1312 -12.1312 -12.1309 -12.1309 -11.5415 -11.5415 -11.5407 -11.5407 -10.9625 -10.9625 -10.9624 -10.9624 -0.5483 -0.5483 -0.5472 -0.5472 0.7988 0.7988 0.8002 0.8002 1.3442 1.3442 1.3453 1.3453 2.1784 2.1784 2.1864 2.1864 2.6235 2.6235 2.6321 2.6321 2.6959 2.6959 2.7026 2.7026 3.0503 3.0503 3.0592 3.0592 3.4796 3.4796 3.4815 3.4815 3.9755 3.9755 3.9787 3.9787 4.6745 4.6745 4.6804 4.6804 4.8049 4.8049 4.8101 4.8101 5.2815 5.2815 5.2875 5.2875 13.4435 13.4435 13.4437 13.4437 15.9455 15.9455 15.9461 15.9461 k = 0.1607-0.0000 0.1512 ( 4284 PWs) bands (ev): -13.3768 -13.3768 -13.3768 -13.3768 -12.1192 -12.1192 -12.1189 -12.1189 -11.5339 -11.5339 -11.5332 -11.5332 -10.9615 -10.9615 -10.9615 -10.9615 -0.5285 -0.5285 -0.5273 -0.5273 0.8120 0.8120 0.8134 0.8134 1.3102 1.3102 1.3113 1.3113 2.1170 2.1170 2.1248 2.1248 2.6033 2.6033 2.6112 2.6112 2.7029 2.7029 2.7086 2.7086 3.0137 3.0137 3.0221 3.0221 3.4426 3.4426 3.4443 3.4443 3.9378 3.9378 3.9408 3.9408 4.6660 4.6660 4.6715 4.6715 4.7973 4.7973 4.8030 4.8030 5.2809 5.2809 5.2871 5.2871 13.5166 13.5166 13.5168 13.5168 16.0290 16.0290 16.0296 16.0296 k = 0.1696-0.0000 0.1512 ( 4278 PWs) bands (ev): -13.3528 -13.3528 -13.3528 -13.3528 -12.1068 -12.1068 -12.1064 -12.1064 -11.5261 -11.5261 -11.5253 -11.5253 -10.9607 -10.9607 -10.9607 -10.9607 -0.5082 -0.5082 -0.5068 -0.5068 0.8235 0.8235 0.8250 0.8250 1.2766 1.2766 1.2779 1.2779 2.0518 2.0518 2.0594 2.0594 2.5816 2.5816 2.5888 2.5888 2.7080 2.7080 2.7131 2.7131 2.9811 2.9811 2.9889 2.9889 3.4070 3.4070 3.4083 3.4083 3.8997 3.8997 3.9025 3.9025 4.6569 4.6569 4.6619 4.6619 4.7893 4.7893 4.7955 4.7955 5.2794 5.2794 5.2856 5.2856 13.5917 13.5917 13.5920 13.5920 16.1111 16.1111 16.1116 16.1116 k = 0.1786-0.0000 0.1512 ( 4282 PWs) bands (ev): -13.3276 -13.3276 -13.3276 -13.3276 -12.0940 -12.0940 -12.0937 -12.0937 -11.5180 -11.5180 -11.5172 -11.5172 -10.9600 -10.9600 -10.9600 -10.9600 -0.4873 -0.4873 -0.4859 -0.4859 0.8325 0.8325 0.8341 0.8341 1.2448 1.2448 1.2461 1.2461 1.9831 1.9831 1.9904 1.9904 2.5581 2.5581 2.5646 2.5646 2.7103 2.7103 2.7145 2.7145 2.9536 2.9536 2.9606 2.9606 3.3729 3.3729 3.3738 3.3738 3.8620 3.8620 3.8646 3.8646 4.6469 4.6469 4.6514 4.6514 4.7810 4.7810 4.7876 4.7876 5.2769 5.2769 5.2832 5.2832 13.6684 13.6684 13.6687 13.6687 16.1898 16.1898 16.1904 16.1904 k = 0.1875-0.0000 0.1512 ( 4286 PWs) bands (ev): -13.3014 -13.3014 -13.3014 -13.3014 -12.0810 -12.0810 -12.0806 -12.0806 -11.5097 -11.5097 -11.5089 -11.5089 -10.9595 -10.9595 -10.9595 -10.9595 -0.4662 -0.4662 -0.4646 -0.4646 0.8376 0.8376 0.8392 0.8392 1.2164 1.2164 1.2177 1.2177 1.9114 1.9114 1.9184 1.9184 2.5325 2.5325 2.5382 2.5382 2.7083 2.7083 2.7117 2.7117 2.9325 2.9325 2.9386 2.9386 3.3406 3.3406 3.3409 3.3409 3.8252 3.8252 3.8276 3.8276 4.6360 4.6360 4.6401 4.6401 4.7724 4.7724 4.7793 4.7793 5.2734 5.2734 5.2797 5.2797 13.7466 13.7466 13.7470 13.7470 16.2632 16.2632 16.2638 16.2638 k = 0.1964-0.0000 0.1512 ( 4284 PWs) bands (ev): -13.2742 -13.2742 -13.2741 -13.2741 -12.0677 -12.0677 -12.0673 -12.0673 -11.5012 -11.5012 -11.5003 -11.5003 -10.9592 -10.9592 -10.9591 -10.9591 -0.4448 -0.4448 -0.4432 -0.4432 0.8375 0.8375 0.8390 0.8390 1.1931 1.1931 1.1944 1.1944 1.8371 1.8371 1.8437 1.8437 2.5043 2.5043 2.5092 2.5092 2.7010 2.7010 2.7032 2.7032 2.9188 2.9188 2.9241 2.9241 3.3098 3.3098 3.3101 3.3101 3.7901 3.7901 3.7923 3.7923 4.6241 4.6241 4.6279 4.6279 4.7633 4.7633 4.7706 4.7706 5.2688 5.2688 5.2752 5.2752 13.8260 13.8260 13.8264 13.8264 16.3285 16.3285 16.3292 16.3292 k = 0.2054-0.0000 0.1512 ( 4278 PWs) bands (ev): -13.2459 -13.2459 -13.2459 -13.2459 -12.0543 -12.0543 -12.0539 -12.0539 -11.4924 -11.4924 -11.4916 -11.4916 -10.9590 -10.9590 -10.9590 -10.9590 -0.4236 -0.4236 -0.4218 -0.4218 0.8308 0.8308 0.8322 0.8322 1.1766 1.1766 1.1778 1.1778 1.7605 1.7605 1.7668 1.7668 2.4731 2.4731 2.4772 2.4772 2.6879 2.6879 2.6889 2.6889 2.9129 2.9129 2.9175 2.9175 3.2805 3.2805 3.2815 3.2815 3.7572 3.7572 3.7591 3.7591 4.6113 4.6113 4.6146 4.6146 4.7540 4.7540 4.7615 4.7615 5.2632 5.2632 5.2695 5.2695 13.9063 13.9063 13.9069 13.9069 16.3836 16.3836 16.3844 16.3844 k = 0.2143-0.0000 0.1512 ( 4278 PWs) bands (ev): -13.2167 -13.2167 -13.2167 -13.2167 -12.0408 -12.0408 -12.0403 -12.0403 -11.4835 -11.4835 -11.4826 -11.4826 -10.9591 -10.9591 -10.9590 -10.9590 -0.4025 -0.4025 -0.4006 -0.4006 0.8170 0.8170 0.8182 0.8182 1.1678 1.1678 1.1689 1.1689 1.6823 1.6823 1.6882 1.6882 2.4387 2.4387 2.4420 2.4420 2.6696 2.6696 2.6701 2.6701 2.9136 2.9136 2.9176 2.9176 3.2530 3.2530 3.2547 3.2547 3.7270 3.7270 3.7287 3.7287 4.5974 4.5974 4.6004 4.6004 4.7442 4.7442 4.7520 4.7520 5.2564 5.2564 5.2627 5.2627 13.9875 13.9875 13.9881 13.9881 16.4276 16.4276 16.4285 16.4285 k = 0.2232-0.0000 0.1512 ( 4278 PWs) bands (ev): -13.1866 -13.1866 -13.1865 -13.1865 -12.0273 -12.0273 -12.0268 -12.0268 -11.4743 -11.4743 -11.4735 -11.4735 -10.9594 -10.9594 -10.9593 -10.9593 -0.3819 -0.3819 -0.3799 -0.3799 0.7967 0.7967 0.7975 0.7975 1.1665 1.1665 1.1673 1.1673 1.6028 1.6028 1.6083 1.6083 2.4012 2.4012 2.4038 2.4038 2.6466 2.6466 2.6485 2.6485 2.9195 2.9195 2.9228 2.9228 3.2273 3.2273 3.2300 3.2300 3.6999 3.6999 3.7014 3.7014 4.5825 4.5825 4.5852 4.5852 4.7341 4.7341 4.7420 4.7420 5.2485 5.2485 5.2549 5.2549 14.0692 14.0692 14.0699 14.0699 16.4611 16.4611 16.4621 16.4621 k = 0.2321-0.0000 0.1512 ( 4286 PWs) bands (ev): -13.1556 -13.1556 -13.1555 -13.1555 -12.0139 -12.0139 -12.0134 -12.0134 -11.4651 -11.4651 -11.4642 -11.4642 -10.9600 -10.9600 -10.9599 -10.9599 -0.3621 -0.3621 -0.3599 -0.3599 0.7713 0.7713 0.7718 0.7718 1.1714 1.1714 1.1720 1.1720 1.5224 1.5224 1.5275 1.5275 2.3606 2.3606 2.3627 2.3627 2.6212 2.6212 2.6245 2.6245 2.9289 2.9289 2.9314 2.9314 3.2038 3.2038 3.2075 3.2075 3.6763 3.6763 3.6776 3.6776 4.5666 4.5666 4.5690 4.5690 4.7236 4.7236 4.7316 4.7316 5.2396 5.2396 5.2459 5.2459 14.1513 14.1513 14.1520 14.1520 16.4855 16.4855 16.4866 16.4866 k = 0.2411-0.0000 0.1512 ( 4284 PWs) bands (ev): -13.1237 -13.1237 -13.1237 -13.1237 -12.0007 -12.0007 -12.0001 -12.0001 -11.4557 -11.4557 -11.4548 -11.4548 -10.9609 -10.9609 -10.9608 -10.9608 -0.3434 -0.3434 -0.3410 -0.3410 0.7427 0.7427 0.7429 0.7429 1.1810 1.1810 1.1813 1.1813 1.4416 1.4416 1.4463 1.4463 2.3175 2.3175 2.3191 2.3191 2.5940 2.5940 2.5986 2.5986 2.9402 2.9402 2.9420 2.9420 3.1827 3.1827 3.1875 3.1875 3.6563 3.6563 3.6574 3.6574 4.5497 4.5497 4.5519 4.5519 4.7126 4.7126 4.7208 4.7208 5.2295 5.2295 5.2358 5.2358 14.2335 14.2335 14.2343 14.2343 16.5021 16.5021 16.5033 16.5033 k = 0.2500-0.0000 0.1512 ( 4280 PWs) bands (ev): -13.0911 -13.0911 -13.0911 -13.0911 -11.9877 -11.9877 -11.9871 -11.9871 -11.4461 -11.4461 -11.4453 -11.4453 -10.9620 -10.9620 -10.9620 -10.9620 -0.3261 -0.3261 -0.3235 -0.3235 0.7127 0.7127 0.7127 0.7127 1.1935 1.1935 1.1935 1.1935 1.3611 1.3611 1.3653 1.3653 2.2724 2.2724 2.2738 2.2738 2.5654 2.5654 2.5711 2.5711 2.9520 2.9520 2.9530 2.9530 3.1648 3.1648 3.1708 3.1708 3.6400 3.6400 3.6409 3.6409 4.5318 4.5318 4.5338 4.5338 4.7013 4.7013 4.7095 4.7095 5.2184 5.2184 5.2246 5.2246 14.3157 14.3157 14.3166 14.3166 16.5122 16.5122 16.5135 16.5135 k = 0.2589-0.0000 0.1512 ( 4284 PWs) bands (ev): -13.0577 -13.0577 -13.0577 -13.0577 -11.9751 -11.9751 -11.9744 -11.9744 -11.4364 -11.4364 -11.4356 -11.4356 -10.9635 -10.9635 -10.9634 -10.9634 -0.3105 -0.3105 -0.3078 -0.3078 0.6827 0.6827 0.6829 0.6829 1.2055 1.2055 1.2062 1.2062 1.2831 1.2831 1.2863 1.2863 2.2259 2.2259 2.2272 2.2272 2.5356 2.5356 2.5422 2.5422 2.9630 2.9630 2.9632 2.9632 3.1510 3.1510 3.1583 3.1583 3.6272 3.6272 3.6280 3.6280 4.5131 4.5131 4.5149 4.5149 4.6896 4.6896 4.6978 4.6978 5.2061 5.2061 5.2123 5.2123 14.3978 14.3978 14.3987 14.3987 16.5166 16.5166 16.5180 16.5180 k = 0.2679-0.0000 0.1512 ( 4274 PWs) bands (ev): -13.0237 -13.0237 -13.0236 -13.0236 -11.9630 -11.9630 -11.9622 -11.9622 -11.4266 -11.4266 -11.4258 -11.4258 -10.9653 -10.9653 -10.9652 -10.9652 -0.2972 -0.2972 -0.2943 -0.2943 0.6541 0.6541 0.6545 0.6545 1.1864 1.1864 1.1907 1.1907 1.2370 1.2370 1.2378 1.2378 2.1785 2.1785 2.1799 2.1799 2.5047 2.5047 2.5121 2.5121 2.9710 2.9710 2.9716 2.9716 3.1428 3.1428 3.1512 3.1512 3.6178 3.6178 3.6185 3.6185 4.4935 4.4935 4.4951 4.4951 4.6775 4.6775 4.6856 4.6856 5.1929 5.1929 5.1989 5.1989 14.4795 14.4795 14.4805 14.4805 16.5162 16.5162 16.5176 16.5176 k = 0.2768-0.0000 0.1512 ( 4280 PWs) bands (ev): -12.9890 -12.9890 -12.9889 -12.9889 -11.9514 -11.9514 -11.9506 -11.9506 -11.4167 -11.4167 -11.4159 -11.4159 -10.9675 -10.9675 -10.9674 -10.9674 -0.2864 -0.2864 -0.2833 -0.2833 0.6279 0.6279 0.6284 0.6284 1.1132 1.1132 1.1171 1.1171 1.2468 1.2468 1.2477 1.2477 2.1311 2.1311 2.1327 2.1327 2.4728 2.4728 2.4808 2.4808 2.9753 2.9753 2.9764 2.9764 3.1414 3.1414 3.1505 3.1505 3.6115 3.6115 3.6120 3.6120 4.4731 4.4731 4.4747 4.4747 4.6651 4.6651 4.6731 4.6731 5.1786 5.1786 5.1846 5.1846 14.5607 14.5607 14.5618 14.5618 16.5116 16.5116 16.5131 16.5131 k = 0.2857-0.0000 0.1512 ( 4292 PWs) bands (ev): -12.9538 -12.9538 -12.9537 -12.9537 -11.9405 -11.9405 -11.9396 -11.9396 -11.4066 -11.4066 -11.4059 -11.4059 -10.9700 -10.9700 -10.9699 -10.9699 -0.2784 -0.2784 -0.2752 -0.2752 0.6049 0.6049 0.6055 0.6055 1.0357 1.0357 1.0390 1.0390 1.2619 1.2619 1.2628 1.2628 2.0840 2.0840 2.0859 2.0859 2.4401 2.4401 2.4486 2.4486 2.9757 2.9757 2.9767 2.9767 3.1473 3.1473 3.1566 3.1566 3.6079 3.6079 3.6082 3.6082 4.4522 4.4522 4.4536 4.4536 4.6523 4.6523 4.6602 4.6602 5.1632 5.1632 5.1692 5.1692 14.6413 14.6413 14.6424 14.6424 16.5036 16.5036 16.5052 16.5052 k = 0.2946-0.0000 0.1512 ( 4298 PWs) bands (ev): -12.9180 -12.9180 -12.9179 -12.9179 -11.9304 -11.9304 -11.9295 -11.9295 -11.3964 -11.3964 -11.3957 -11.3957 -10.9728 -10.9728 -10.9727 -10.9727 -0.2736 -0.2736 -0.2702 -0.2702 0.5855 0.5855 0.5860 0.5860 0.9590 0.9590 0.9618 0.9618 1.2767 1.2767 1.2777 1.2777 2.0379 2.0379 2.0403 2.0403 2.4067 2.4067 2.4156 2.4156 2.9728 2.9728 2.9734 2.9734 3.1596 3.1596 3.1687 3.1687 3.6066 3.6066 3.6067 3.6067 4.4306 4.4306 4.4319 4.4319 4.6392 4.6392 4.6470 4.6470 5.1470 5.1470 5.1528 5.1528 14.7210 14.7210 14.7222 14.7222 16.4929 16.4929 16.4945 16.4945 k = 0.3036-0.0000 0.1512 ( 4302 PWs) bands (ev): -12.8818 -12.8818 -12.8816 -12.8816 -11.9212 -11.9212 -11.9202 -11.9202 -11.3861 -11.3861 -11.3855 -11.3855 -10.9760 -10.9760 -10.9759 -10.9759 -0.2720 -0.2720 -0.2685 -0.2685 0.5697 0.5697 0.5700 0.5700 0.8843 0.8843 0.8865 0.8865 1.2901 1.2901 1.2913 1.2913 1.9935 1.9935 1.9963 1.9963 2.3730 2.3730 2.3822 2.3822 2.9678 2.9678 2.9679 2.9679 3.1770 3.1770 3.1857 3.1857 3.6070 3.6070 3.6071 3.6071 4.4086 4.4086 4.4099 4.4099 4.6259 4.6259 4.6334 4.6334 5.1298 5.1298 5.1355 5.1355 14.7999 14.7999 14.8011 14.8011 16.4800 16.4800 16.4817 16.4817 k = 0.3125-0.0000 0.1512 ( 4312 PWs) bands (ev): -12.8451 -12.8451 -12.8450 -12.8450 -11.9130 -11.9130 -11.9120 -11.9120 -11.3756 -11.3756 -11.3750 -11.3750 -10.9796 -10.9796 -10.9795 -10.9795 -0.2735 -0.2735 -0.2700 -0.2700 0.5567 0.5567 0.5568 0.5568 0.8130 0.8130 0.8144 0.8144 1.3013 1.3013 1.3028 1.3028 1.9511 1.9511 1.9546 1.9546 2.3392 2.3392 2.3487 2.3487 2.9614 2.9614 2.9620 2.9620 3.1979 3.1979 3.2062 3.2062 3.6089 3.6089 3.6092 3.6092 4.3864 4.3864 4.3875 4.3875 4.6124 4.6124 4.6198 4.6198 5.1116 5.1116 5.1173 5.1173 14.8776 14.8776 14.8789 14.8789 16.4655 16.4655 16.4673 16.4673 k = 0.3214-0.0000 0.1512 ( 4320 PWs) bands (ev): -12.8081 -12.8081 -12.8080 -12.8080 -11.9060 -11.9060 -11.9050 -11.9050 -11.3650 -11.3650 -11.3645 -11.3645 -10.9835 -10.9835 -10.9834 -10.9834 -0.2781 -0.2781 -0.2746 -0.2746 0.5439 0.5439 0.5449 0.5449 0.7473 0.7473 0.7476 0.7476 1.3096 1.3096 1.3115 1.3115 1.9115 1.9115 1.9156 1.9156 2.3056 2.3056 2.3153 2.3153 2.9551 2.9551 2.9563 2.9563 3.2214 3.2214 3.2291 3.2291 3.6117 3.6117 3.6123 3.6123 4.3639 4.3639 4.3651 4.3651 4.5988 4.5988 4.6060 4.6060 5.0926 5.0926 5.0982 5.0982 14.9542 14.9542 14.9555 14.9555 16.4500 16.4500 16.4518 16.4518 k = 0.3304-0.0000 0.1512 ( 4308 PWs) bands (ev): -12.7709 -12.7709 -12.7707 -12.7707 -11.9002 -11.9002 -11.8992 -11.8992 -11.3543 -11.3543 -11.3537 -11.3537 -10.9878 -10.9878 -10.9877 -10.9877 -0.2853 -0.2853 -0.2818 -0.2818 0.5267 0.5267 0.5292 0.5292 0.6908 0.6908 0.6922 0.6922 1.3146 1.3146 1.3169 1.3169 1.8751 1.8751 1.8800 1.8800 2.2726 2.2726 2.2825 2.2825 2.9497 2.9497 2.9515 2.9515 3.2466 3.2466 3.2539 3.2539 3.6152 3.6152 3.6160 3.6160 4.3415 4.3415 4.3426 4.3426 4.5853 4.5853 4.5922 4.5922 5.0728 5.0728 5.0782 5.0782 15.0294 15.0294 15.0307 15.0307 16.4339 16.4340 16.4358 16.4358 k = 0.3393-0.0000 0.1512 ( 4308 PWs) bands (ev): -12.7334 -12.7334 -12.7332 -12.7332 -11.8958 -11.8958 -11.8947 -11.8947 -11.3433 -11.3433 -11.3428 -11.3428 -10.9924 -10.9924 -10.9923 -10.9923 -0.2947 -0.2947 -0.2911 -0.2911 0.4973 0.4973 0.5014 0.5014 0.6521 0.6521 0.6553 0.6553 1.3157 1.3157 1.3185 1.3185 1.8425 1.8425 1.8482 1.8482 2.2404 2.2404 2.2503 2.2503 2.9457 2.9457 2.9479 2.9479 3.2728 3.2728 3.2797 3.2797 3.6189 3.6189 3.6200 3.6200 4.3192 4.3192 4.3203 4.3203 4.5720 4.5720 4.5786 4.5786 5.0522 5.0522 5.0575 5.0575 15.1032 15.1032 15.1045 15.1045 16.4177 16.4177 16.4196 16.4196 k = 0.3482-0.0000 0.1512 ( 4320 PWs) bands (ev): -12.6958 -12.6958 -12.6956 -12.6956 -11.8929 -11.8929 -11.8918 -11.8918 -11.3322 -11.3322 -11.3318 -11.3318 -10.9974 -10.9974 -10.9973 -10.9973 -0.3056 -0.3056 -0.3021 -0.3021 0.4523 0.4523 0.4569 0.4569 0.6357 0.6357 0.6398 0.6398 1.3125 1.3125 1.3158 1.3158 1.8141 1.8141 1.8205 1.8205 2.2091 2.2091 2.2192 2.2192 2.9434 2.9434 2.9460 2.9460 3.2997 3.2997 3.3062 3.3062 3.6225 3.6225 3.6239 3.6239 4.2971 4.2971 4.2982 4.2982 4.5591 4.5591 4.5654 4.5654 5.0309 5.0309 5.0361 5.0361 15.1753 15.1753 15.1766 15.1766 16.4015 16.4015 16.4036 16.4036 k = 0.3571-0.0000 0.1512 ( 4328 PWs) bands (ev): -12.6581 -12.6581 -12.6579 -12.6579 -11.8916 -11.8916 -11.8904 -11.8904 -11.3209 -11.3209 -11.3206 -11.3206 -11.0028 -11.0028 -11.0027 -11.0027 -0.3175 -0.3175 -0.3141 -0.3141 0.3973 0.3973 0.4019 0.4019 0.6353 0.6353 0.6393 0.6393 1.3051 1.3051 1.3088 1.3088 1.7900 1.7900 1.7971 1.7971 2.1790 2.1790 2.1891 2.1891 2.9432 2.9432 2.9462 2.9462 3.3267 3.3267 3.3328 3.3328 3.6257 3.6257 3.6275 3.6275 4.2754 4.2754 4.2766 4.2766 4.5469 4.5469 4.5527 4.5527 5.0088 5.0088 5.0139 5.0139 15.2457 15.2457 15.2470 15.2470 16.3858 16.3858 16.3879 16.3879 k = 0.3661-0.0000 0.1512 ( 4316 PWs) bands (ev): -12.6205 -12.6205 -12.6202 -12.6202 -11.8919 -11.8919 -11.8907 -11.8907 -11.3095 -11.3095 -11.3092 -11.3092 -11.0085 -11.0085 -11.0084 -11.0084 -0.3299 -0.3299 -0.3265 -0.3265 0.3386 0.3386 0.3428 0.3428 0.6436 0.6436 0.6475 0.6475 1.2934 1.2934 1.2975 1.2975 1.7702 1.7702 1.7781 1.7781 2.1501 2.1501 2.1602 2.1602 2.9453 2.9453 2.9485 2.9485 3.3533 3.3533 3.3590 3.3590 3.6285 3.6285 3.6307 3.6307 4.2542 4.2542 4.2555 4.2555 4.5355 4.5355 4.5409 4.5409 4.9861 4.9861 4.9911 4.9911 15.3143 15.3143 15.3155 15.3155 16.3705 16.3705 16.3727 16.3727 k = 0.3750-0.0000 0.1512 ( 4304 PWs) bands (ev): -12.5829 -12.5829 -12.5826 -12.5826 -11.8939 -11.8939 -11.8927 -11.8927 -11.2979 -11.2979 -11.2976 -11.2976 -11.0145 -11.0145 -11.0144 -11.0144 -0.3421 -0.3421 -0.3388 -0.3388 0.2793 0.2793 0.2832 0.2832 0.6570 0.6570 0.6607 0.6607 1.2779 1.2779 1.2822 1.2822 1.7547 1.7547 1.7630 1.7630 2.1224 2.1224 2.1325 2.1325 2.9498 2.9498 2.9532 2.9532 3.3787 3.3787 3.3840 3.3840 3.6311 3.6311 3.6337 3.6337 4.2335 4.2335 4.2349 4.2349 4.5253 4.5253 4.5302 4.5302 4.9629 4.9629 4.9677 4.9677 15.3809 15.3809 15.3820 15.3820 16.3558 16.3558 16.3580 16.3580 k = 0.3839-0.0000 0.1512 ( 4300 PWs) bands (ev): -12.5455 -12.5455 -12.5451 -12.5451 -11.8977 -11.8977 -11.8965 -11.8965 -11.2862 -11.2862 -11.2859 -11.2859 -11.0209 -11.0209 -11.0208 -11.0208 -0.3536 -0.3536 -0.3505 -0.3505 0.2208 0.2208 0.2245 0.2245 0.6735 0.6735 0.6770 0.6770 1.2591 1.2591 1.2637 1.2637 1.7430 1.7430 1.7517 1.7517 2.0958 2.0958 2.1060 2.1060 2.9568 2.9568 2.9605 2.9605 3.4020 3.4020 3.4068 3.4068 3.6338 3.6338 3.6369 3.6369 4.2132 4.2132 4.2148 4.2148 4.5167 4.5167 4.5210 4.5210 4.9391 4.9391 4.9438 4.9438 15.4454 15.4454 15.4465 15.4465 16.3416 16.3416 16.3438 16.3438 k = 0.3929-0.0000 0.1512 ( 4302 PWs) bands (ev): -12.5083 -12.5083 -12.5079 -12.5079 -11.9034 -11.9034 -11.9022 -11.9022 -11.2743 -11.2743 -11.2741 -11.2741 -11.0276 -11.0276 -11.0275 -11.0275 -0.3641 -0.3641 -0.3611 -0.3611 0.1640 0.1640 0.1675 0.1675 0.6921 0.6921 0.6955 0.6955 1.2378 1.2378 1.2424 1.2424 1.7346 1.7346 1.7436 1.7436 2.0703 2.0703 2.0805 2.0805 2.9665 2.9665 2.9703 2.9703 3.4219 3.4219 3.4262 3.4262 3.6376 3.6376 3.6413 3.6413 4.1931 4.1931 4.1950 4.1950 4.5099 4.5099 4.5136 4.5136 4.9149 4.9149 4.9195 4.9195 15.5077 15.5077 15.5087 15.5087 16.3278 16.3278 16.3300 16.3300 k = 0.4018-0.0000 0.1512 ( 4300 PWs) bands (ev): -12.4715 -12.4715 -12.4710 -12.4710 -11.9109 -11.9109 -11.9097 -11.9097 -11.2624 -11.2624 -11.2622 -11.2622 -11.0347 -11.0347 -11.0346 -11.0346 -0.3732 -0.3732 -0.3702 -0.3702 0.1093 0.1093 0.1126 0.1126 0.7120 0.7120 0.7153 0.7153 1.2147 1.2147 1.2193 1.2193 1.7292 1.7292 1.7385 1.7385 2.0458 2.0458 2.0560 2.0560 2.9789 2.9789 2.9827 2.9827 3.4368 3.4368 3.4405 3.4405 3.6438 3.6438 3.6482 3.6482 4.1732 4.1732 4.1754 4.1754 4.5053 4.5053 4.5084 4.5084 4.8903 4.8903 4.8947 4.8947 15.5677 15.5677 15.5685 15.5685 16.3141 16.3141 16.3162 16.3162 k = 0.4107-0.0000 0.1512 ( 4304 PWs) bands (ev): -12.4350 -12.4350 -12.4345 -12.4345 -11.9203 -11.9203 -11.9190 -11.9190 -11.2503 -11.2503 -11.2502 -11.2502 -11.0420 -11.0420 -11.0420 -11.0420 -0.3805 -0.3805 -0.3775 -0.3775 0.0568 0.0568 0.0600 0.0600 0.7329 0.7329 0.7361 0.7361 1.1903 1.1903 1.1948 1.1948 1.7265 1.7265 1.7359 1.7359 2.0220 2.0220 2.0322 2.0322 2.9938 2.9938 2.9978 2.9978 3.4451 3.4451 3.4484 3.4484 3.6539 3.6539 3.6589 3.6589 4.1532 4.1532 4.1557 4.1557 4.5032 4.5032 4.5057 4.5057 4.8654 4.8654 4.8696 4.8696 15.6253 15.6253 15.6260 15.6260 16.3001 16.3001 16.3021 16.3021 k = 0.4196-0.0000 0.1512 ( 4312 PWs) bands (ev): -12.3991 -12.3991 -12.3985 -12.3985 -11.9315 -11.9315 -11.9303 -11.9303 -11.2383 -11.2383 -11.2381 -11.2381 -11.0498 -11.0498 -11.0497 -11.0497 -0.3857 -0.3857 -0.3828 -0.3828 0.0069 0.0069 0.0099 0.0099 0.7542 0.7542 0.7574 0.7574 1.1652 1.1652 1.1695 1.1695 1.7262 1.7262 1.7356 1.7356 1.9990 1.9990 2.0091 2.0091 3.0113 3.0113 3.0153 3.0153 3.4459 3.4459 3.4488 3.4488 3.6687 3.6687 3.6741 3.6741 4.1327 4.1327 4.1356 4.1356 4.5038 4.5038 4.5057 4.5057 4.8402 4.8402 4.8443 4.8443 15.6804 15.6804 15.6810 15.6810 16.2854 16.2854 16.2872 16.2872 k = 0.4286-0.0000 0.1512 ( 4312 PWs) bands (ev): -12.3637 -12.3637 -12.3631 -12.3631 -11.9446 -11.9446 -11.9434 -11.9434 -11.2262 -11.2262 -11.2261 -11.2261 -11.0578 -11.0578 -11.0578 -11.0578 -0.3886 -0.3886 -0.3858 -0.3858 -0.0403 -0.0403 -0.0374 -0.0374 0.7758 0.7759 0.7790 0.7790 1.1398 1.1398 1.1440 1.1440 1.7281 1.7281 1.7376 1.7376 1.9764 1.9764 1.9865 1.9865 3.0312 3.0312 3.0352 3.0352 3.4394 3.4394 3.4422 3.4422 3.6881 3.6881 3.6938 3.6938 4.1116 4.1116 4.1149 4.1149 4.5073 4.5073 4.5085 4.5085 4.8149 4.8149 4.8189 4.8189 15.7331 15.7331 15.7336 15.7336 16.2695 16.2695 16.2712 16.2712 k = 0.4375-0.0000 0.1512 ( 4308 PWs) bands (ev): -12.3289 -12.3289 -12.3283 -12.3283 -11.9595 -11.9595 -11.9584 -11.9584 -11.2142 -11.2142 -11.2141 -11.2141 -11.0662 -11.0662 -11.0662 -11.0662 -0.3890 -0.3890 -0.3863 -0.3863 -0.0848 -0.0848 -0.0819 -0.0819 0.7976 0.7976 0.8007 0.8007 1.1144 1.1144 1.1185 1.1185 1.7322 1.7322 1.7418 1.7418 1.9543 1.9543 1.9643 1.9643 3.0533 3.0533 3.0573 3.0573 3.4268 3.4268 3.4295 3.4295 3.7112 3.7112 3.7170 3.7170 4.0897 4.0897 4.0933 4.0933 4.5136 4.5136 4.5142 4.5142 4.7895 4.7895 4.7934 4.7934 15.7833 15.7833 15.7836 15.7836 16.2521 16.2521 16.2534 16.2534 k = 0.4464-0.0000 0.1512 ( 4312 PWs) bands (ev): -12.2949 -12.2949 -12.2943 -12.2943 -11.9763 -11.9763 -11.9751 -11.9751 -11.2022 -11.2022 -11.2022 -11.2022 -11.0749 -11.0749 -11.0749 -11.0749 -0.3868 -0.3868 -0.3841 -0.3841 -0.1263 -0.1263 -0.1236 -0.1236 0.8192 0.8192 0.8223 0.8223 1.0893 1.0893 1.0932 1.0932 1.7384 1.7384 1.7480 1.7480 1.9326 1.9326 1.9425 1.9425 3.0774 3.0774 3.0813 3.0813 3.4091 3.4091 3.4118 3.4118 3.7369 3.7369 3.7427 3.7427 4.0668 4.0668 4.0708 4.0708 4.5226 4.5226 4.5226 4.5226 4.7642 4.7642 4.7679 4.7679 15.8310 15.8310 15.8312 15.8312 16.2326 16.2326 16.2338 16.2338 k = 0.4554-0.0000 0.1512 ( 4316 PWs) bands (ev): -12.2618 -12.2618 -12.2611 -12.2611 -11.9948 -11.9948 -11.9937 -11.9937 -11.1904 -11.1904 -11.1903 -11.1903 -11.0840 -11.0840 -11.0839 -11.0839 -0.3818 -0.3818 -0.3792 -0.3792 -0.1650 -0.1650 -0.1623 -0.1623 0.8408 0.8408 0.8439 0.8439 1.0646 1.0646 1.0684 1.0684 1.7467 1.7467 1.7562 1.7562 1.9113 1.9113 1.9212 1.9212 3.1033 3.1033 3.1071 3.1071 3.3875 3.3875 3.3903 3.3903 3.7643 3.7643 3.7701 3.7701 4.0429 4.0429 4.0472 4.0472 4.5338 4.5338 4.5343 4.5343 4.7391 4.7391 4.7426 4.7426 15.8763 15.8763 15.8764 15.8764 16.2110 16.2110 16.2119 16.2119 k = 0.4643-0.0000 0.1512 ( 4312 PWs) bands (ev): -12.2295 -12.2295 -12.2288 -12.2288 -12.0150 -12.0150 -12.0139 -12.0139 -11.1787 -11.1787 -11.1786 -11.1786 -11.0933 -11.0933 -11.0933 -11.0933 -0.3739 -0.3739 -0.3713 -0.3713 -0.2006 -0.2006 -0.1979 -0.1979 0.8624 0.8624 0.8655 0.8655 1.0404 1.0404 1.0441 1.0441 1.7568 1.7568 1.7663 1.7663 1.8905 1.8905 1.9003 1.9003 3.1307 3.1307 3.1344 3.1344 3.3630 3.3630 3.3659 3.3659 3.7928 3.7928 3.7986 3.7986 4.0179 4.0179 4.0225 4.0225 4.5474 4.5474 4.5484 4.5484 4.7143 4.7143 4.7176 4.7176 15.9193 15.9193 15.9193 15.9193 16.1871 16.1871 16.1877 16.1877 k = 0.4732-0.0000 0.1512 ( 4310 PWs) bands (ev): -12.1983 -12.1983 -12.1975 -12.1975 -12.0368 -12.0368 -12.0358 -12.0358 -11.1672 -11.1672 -11.1671 -11.1671 -11.1030 -11.1030 -11.1030 -11.1030 -0.3631 -0.3631 -0.3605 -0.3605 -0.2331 -0.2331 -0.2305 -0.2305 0.8838 0.8838 0.8870 0.8870 1.0168 1.0168 1.0203 1.0203 1.7688 1.7688 1.7783 1.7783 1.8702 1.8702 1.8800 1.8800 3.1592 3.1592 3.1628 3.1628 3.3363 3.3363 3.3393 3.3393 3.8219 3.8219 3.8276 3.8276 3.9920 3.9920 3.9968 3.9968 4.5632 4.5632 4.5646 4.5646 4.6899 4.6899 4.6930 4.6930 15.9599 15.9599 15.9600 15.9600 16.1609 16.1609 16.1613 16.1613 k = 0.4821-0.0000 0.1512 ( 4306 PWs) bands (ev): -12.1682 -12.1682 -12.1674 -12.1674 -12.0602 -12.0602 -12.0592 -12.0592 -11.1558 -11.1558 -11.1558 -11.1558 -11.1130 -11.1130 -11.1130 -11.1130 -0.3492 -0.3492 -0.3466 -0.3466 -0.2626 -0.2626 -0.2600 -0.2600 0.9054 0.9054 0.9085 0.9085 0.9937 0.9937 0.9971 0.9971 1.7824 1.7824 1.7920 1.7920 1.8507 1.8507 1.8603 1.8603 3.1886 3.1886 3.1921 3.1921 3.3080 3.3080 3.3111 3.3111 3.8512 3.8512 3.8567 3.8567 3.9651 3.9651 3.9701 3.9701 4.5809 4.5809 4.5827 4.5827 4.6662 4.6662 4.6690 4.6690 15.9985 15.9985 15.9986 15.9986 16.1326 16.1326 16.1328 16.1328 k = 0.4911-0.0000 0.1512 ( 4310 PWs) bands (ev): -12.1392 -12.1392 -12.1383 -12.1383 -12.0852 -12.0852 -12.0842 -12.0842 -11.1447 -11.1447 -11.1447 -11.1447 -11.1233 -11.1233 -11.1233 -11.1233 -0.3322 -0.3322 -0.3297 -0.3297 -0.2889 -0.2889 -0.2864 -0.2864 0.9270 0.9270 0.9302 0.9302 0.9711 0.9711 0.9744 0.9744 1.7976 1.7976 1.8072 1.8072 1.8319 1.8319 1.8416 1.8416 3.2186 3.2186 3.2220 3.2220 3.2787 3.2787 3.2819 3.2819 3.8803 3.8803 3.8858 3.8858 3.9375 3.9375 3.9427 3.9427 4.6003 4.6003 4.6024 4.6024 4.6432 4.6432 4.6458 4.6458 16.0350 16.0350 16.0351 16.0351 16.1021 16.1021 16.1022 16.1022 k = 0.5000-0.0000 0.1512 ( 4316 PWs) bands (ev): -12.1115 -12.1115 -12.1115 -12.1115 -12.1106 -12.1106 -12.1106 -12.1106 -11.1339 -11.1339 -11.1339 -11.1339 -11.1338 -11.1338 -11.1338 -11.1338 -0.3121 -0.3121 -0.3121 -0.3121 -0.3096 -0.3096 -0.3096 -0.3096 0.9489 0.9489 0.9489 0.9489 0.9522 0.9522 0.9522 0.9522 1.8142 1.8142 1.8142 1.8142 1.8238 1.8238 1.8238 1.8238 3.2487 3.2487 3.2487 3.2487 3.2520 3.2520 3.2520 3.2520 3.9092 3.9092 3.9092 3.9092 3.9145 3.9145 3.9145 3.9145 4.6212 4.6212 4.6212 4.6212 4.6235 4.6235 4.6235 4.6235 16.0695 16.0695 16.0695 16.0695 16.0696 16.0696 16.0696 16.0696 k = 0.5000-0.0000 0.1512 ( 4316 PWs) bands (ev): -12.1115 -12.1115 -12.1115 -12.1115 -12.1106 -12.1106 -12.1106 -12.1106 -11.1339 -11.1339 -11.1339 -11.1339 -11.1338 -11.1338 -11.1338 -11.1338 -0.3121 -0.3121 -0.3121 -0.3121 -0.3096 -0.3096 -0.3096 -0.3096 0.9489 0.9489 0.9489 0.9489 0.9522 0.9522 0.9522 0.9522 1.8142 1.8142 1.8142 1.8142 1.8238 1.8238 1.8238 1.8238 3.2487 3.2487 3.2487 3.2487 3.2520 3.2520 3.2520 3.2520 3.9092 3.9092 3.9092 3.9092 3.9145 3.9145 3.9145 3.9145 4.6212 4.6212 4.6212 4.6212 4.6235 4.6235 4.6235 4.6235 16.0695 16.0695 16.0695 16.0695 16.0696 16.0696 16.0696 16.0696 k = 0.5000 0.0090 0.1512 ( 4312 PWs) bands (ev): -12.1112 -12.1112 -12.1112 -12.1112 -12.1103 -12.1103 -12.1103 -12.1103 -11.1342 -11.1342 -11.1342 -11.1342 -11.1341 -11.1341 -11.1341 -11.1341 -0.3130 -0.3130 -0.3129 -0.3129 -0.3105 -0.3105 -0.3103 -0.3103 0.9488 0.9488 0.9488 0.9488 0.9521 0.9521 0.9522 0.9522 1.8141 1.8141 1.8144 1.8144 1.8234 1.8234 1.8243 1.8243 3.2496 3.2496 3.2501 3.2501 3.2531 3.2531 3.2533 3.2533 3.9085 3.9085 3.9085 3.9085 3.9137 3.9137 3.9140 3.9140 4.6219 4.6219 4.6219 4.6219 4.6243 4.6243 4.6243 4.6243 16.0677 16.0677 16.0677 16.0677 16.0680 16.0680 16.0680 16.0680 k = 0.5000 0.0179 0.1512 ( 4312 PWs) bands (ev): -12.1104 -12.1104 -12.1103 -12.1103 -12.1095 -12.1095 -12.1094 -12.1094 -11.1351 -11.1351 -11.1350 -11.1350 -11.1350 -11.1350 -11.1350 -11.1350 -0.3154 -0.3154 -0.3154 -0.3154 -0.3131 -0.3131 -0.3127 -0.3127 0.9487 0.9487 0.9487 0.9487 0.9518 0.9518 0.9520 0.9520 1.8143 1.8143 1.8148 1.8148 1.8232 1.8232 1.8249 1.8249 3.2529 3.2529 3.2538 3.2538 3.2565 3.2565 3.2568 3.2568 3.9066 3.9066 3.9067 3.9067 3.9117 3.9117 3.9122 3.9122 4.6241 4.6241 4.6241 4.6241 4.6264 4.6264 4.6264 4.6264 16.0624 16.0624 16.0624 16.0624 16.0630 16.0630 16.0630 16.0630 k = 0.5000 0.0269 0.1512 ( 4308 PWs) bands (ev): -12.1090 -12.1090 -12.1089 -12.1089 -12.1081 -12.1081 -12.1080 -12.1080 -11.1365 -11.1365 -11.1365 -11.1365 -11.1365 -11.1365 -11.1365 -11.1365 -0.3195 -0.3195 -0.3194 -0.3194 -0.3172 -0.3172 -0.3167 -0.3167 0.9483 0.9483 0.9483 0.9483 0.9513 0.9513 0.9516 0.9516 1.8147 1.8147 1.8154 1.8154 1.8233 1.8233 1.8258 1.8258 3.2584 3.2584 3.2599 3.2599 3.2622 3.2622 3.2626 3.2626 3.9035 3.9035 3.9035 3.9035 3.9083 3.9083 3.9092 3.9092 4.6277 4.6277 4.6277 4.6277 4.6300 4.6300 4.6300 4.6300 16.0540 16.0540 16.0540 16.0540 16.0548 16.0548 16.0549 16.0549 k = 0.5000 0.0359 0.1512 ( 4308 PWs) bands (ev): -12.1071 -12.1071 -12.1069 -12.1069 -12.1062 -12.1062 -12.1060 -12.1060 -11.1386 -11.1386 -11.1386 -11.1386 -11.1385 -11.1385 -11.1385 -11.1385 -0.3250 -0.3250 -0.3249 -0.3249 -0.3228 -0.3228 -0.3222 -0.3222 0.9475 0.9475 0.9476 0.9476 0.9505 0.9505 0.9509 0.9509 1.8155 1.8155 1.8165 1.8165 1.8238 1.8238 1.8270 1.8270 3.2663 3.2663 3.2682 3.2682 3.2702 3.2702 3.2708 3.2708 3.8991 3.8991 3.8992 3.8992 3.9038 3.9038 3.9049 3.9049 4.6327 4.6327 4.6327 4.6327 4.6349 4.6349 4.6350 4.6350 16.0427 16.0427 16.0428 16.0428 16.0437 16.0437 16.0439 16.0439 k = 0.5000 0.0448 0.1512 ( 4312 PWs) bands (ev): -12.1046 -12.1046 -12.1044 -12.1044 -12.1037 -12.1037 -12.1035 -12.1035 -11.1412 -11.1412 -11.1412 -11.1412 -11.1412 -11.1412 -11.1411 -11.1411 -0.3319 -0.3319 -0.3318 -0.3318 -0.3299 -0.3299 -0.3290 -0.3290 0.9463 0.9463 0.9463 0.9463 0.9491 0.9491 0.9495 0.9495 1.8168 1.8168 1.8181 1.8181 1.8247 1.8247 1.8288 1.8288 3.2764 3.2764 3.2787 3.2787 3.2805 3.2805 3.2812 3.2812 3.8935 3.8935 3.8935 3.8935 3.8979 3.8979 3.8993 3.8993 4.6389 4.6389 4.6389 4.6389 4.6411 4.6411 4.6411 4.6411 16.0289 16.0289 16.0291 16.0291 16.0301 16.0301 16.0305 16.0305 k = 0.5000 0.0538 0.1512 ( 4312 PWs) bands (ev): -12.1015 -12.1015 -12.1013 -12.1013 -12.1006 -12.1006 -12.1004 -12.1004 -11.1444 -11.1444 -11.1444 -11.1444 -11.1443 -11.1443 -11.1443 -11.1443 -0.3401 -0.3401 -0.3399 -0.3399 -0.3381 -0.3381 -0.3372 -0.3372 0.9442 0.9442 0.9442 0.9442 0.9469 0.9469 0.9474 0.9474 1.8189 1.8189 1.8205 1.8205 1.8265 1.8265 1.8313 1.8313 3.2888 3.2888 3.2916 3.2916 3.2930 3.2930 3.2938 3.2938 3.8866 3.8866 3.8867 3.8867 3.8909 3.8909 3.8925 3.8925 4.6462 4.6462 4.6462 4.6462 4.6484 4.6484 4.6484 4.6484 16.0132 16.0132 16.0135 16.0135 16.0145 16.0145 16.0151 16.0151 k = 0.5000 0.0628 0.1512 ( 4308 PWs) bands (ev): -12.0979 -12.0979 -12.0977 -12.0977 -12.0971 -12.0971 -12.0968 -12.0968 -11.1481 -11.1481 -11.1481 -11.1481 -11.1481 -11.1481 -11.1481 -11.1481 -0.3493 -0.3493 -0.3492 -0.3492 -0.3475 -0.3475 -0.3464 -0.3464 0.9411 0.9411 0.9412 0.9412 0.9436 0.9436 0.9442 0.9442 1.8220 1.8220 1.8239 1.8239 1.8291 1.8291 1.8347 1.8347 3.3034 3.3034 3.3065 3.3065 3.3077 3.3077 3.3086 3.3086 3.8785 3.8785 3.8786 3.8786 3.8826 3.8826 3.8845 3.8845 4.6545 4.6545 4.6546 4.6546 4.6566 4.6566 4.6567 4.6567 15.9961 15.9961 15.9963 15.9963 15.9973 15.9973 15.9982 15.9982 k = 0.5000 0.0717 0.1512 ( 4308 PWs) bands (ev): -12.0939 -12.0939 -12.0936 -12.0936 -12.0930 -12.0930 -12.0927 -12.0927 -11.1524 -11.1524 -11.1524 -11.1524 -11.1523 -11.1523 -11.1523 -11.1523 -0.3595 -0.3595 -0.3594 -0.3594 -0.3578 -0.3578 -0.3566 -0.3566 0.9368 0.9368 0.9369 0.9369 0.9392 0.9392 0.9398 0.9398 1.8262 1.8262 1.8284 1.8284 1.8330 1.8330 1.8392 1.8392 3.3202 3.3202 3.3237 3.3237 3.3245 3.3245 3.3255 3.3255 3.8692 3.8692 3.8694 3.8694 3.8731 3.8731 3.8753 3.8753 4.6637 4.6637 4.6638 4.6638 4.6658 4.6658 4.6659 4.6659 15.9779 15.9779 15.9782 15.9782 15.9792 15.9792 15.9803 15.9803 k = 0.5000 0.0807 0.1512 ( 4312 PWs) bands (ev): -12.0893 -12.0893 -12.0889 -12.0889 -12.0884 -12.0884 -12.0881 -12.0881 -11.1572 -11.1572 -11.1572 -11.1572 -11.1571 -11.1571 -11.1571 -11.1571 -0.3704 -0.3704 -0.3703 -0.3703 -0.3689 -0.3689 -0.3676 -0.3676 0.9310 0.9310 0.9311 0.9311 0.9332 0.9332 0.9339 0.9339 1.8317 1.8317 1.8343 1.8343 1.8381 1.8381 1.8450 1.8450 3.3390 3.3390 3.3428 3.3428 3.3434 3.3434 3.3445 3.3445 3.8587 3.8587 3.8590 3.8590 3.8625 3.8625 3.8649 3.8649 4.6735 4.6735 4.6737 4.6737 4.6755 4.6755 4.6757 4.6757 15.9592 15.9592 15.9595 15.9595 15.9604 15.9604 15.9618 15.9618 k = 0.5000 0.0896 0.1512 ( 4312 PWs) bands (ev): -12.0842 -12.0842 -12.0838 -12.0838 -12.0834 -12.0834 -12.0830 -12.0830 -11.1625 -11.1625 -11.1625 -11.1625 -11.1624 -11.1624 -11.1624 -11.1624 -0.3820 -0.3820 -0.3818 -0.3818 -0.3806 -0.3806 -0.3792 -0.3792 0.9236 0.9236 0.9238 0.9238 0.9257 0.9257 0.9264 0.9264 1.8387 1.8387 1.8416 1.8416 1.8448 1.8448 1.8523 1.8523 3.3598 3.3598 3.3640 3.3640 3.3642 3.3642 3.3655 3.3655 3.8472 3.8472 3.8475 3.8475 3.8508 3.8508 3.8534 3.8534 4.6838 4.6838 4.6840 4.6840 4.6858 4.6858 4.6859 4.6859 15.9404 15.9404 15.9407 15.9407 15.9415 15.9415 15.9431 15.9431 k = 0.5000 0.0986 0.1512 ( 4312 PWs) bands (ev): -12.0787 -12.0787 -12.0783 -12.0783 -12.0779 -12.0779 -12.0774 -12.0774 -11.1682 -11.1682 -11.1682 -11.1682 -11.1681 -11.1681 -11.1681 -11.1681 -0.3940 -0.3940 -0.3938 -0.3938 -0.3926 -0.3926 -0.3912 -0.3912 0.9145 0.9145 0.9147 0.9147 0.9164 0.9164 0.9171 0.9171 1.8474 1.8474 1.8506 1.8506 1.8530 1.8530 1.8611 1.8611 3.3825 3.3825 3.3869 3.3869 3.3871 3.3871 3.3884 3.3884 3.8346 3.8346 3.8350 3.8350 3.8380 3.8380 3.8408 3.8408 4.6943 4.6943 4.6947 4.6947 4.6963 4.6963 4.6965 4.6965 15.9219 15.9219 15.9221 15.9221 15.9229 15.9229 15.9247 15.9247 k = 0.5000 0.1076 0.1512 ( 4308 PWs) bands (ev): -12.0728 -12.0728 -12.0723 -12.0723 -12.0720 -12.0720 -12.0715 -12.0715 -11.1744 -11.1744 -11.1744 -11.1744 -11.1743 -11.1743 -11.1743 -11.1743 -0.4062 -0.4062 -0.4060 -0.4060 -0.4050 -0.4050 -0.4035 -0.4035 0.9036 0.9036 0.9038 0.9038 0.9053 0.9053 0.9060 0.9060 1.8577 1.8577 1.8613 1.8613 1.8630 1.8630 1.8715 1.8715 3.4069 3.4069 3.4114 3.4114 3.4119 3.4119 3.4130 3.4130 3.8210 3.8210 3.8216 3.8216 3.8243 3.8243 3.8274 3.8274 4.7050 4.7050 4.7054 4.7054 4.7069 4.7069 4.7072 4.7072 15.9040 15.9040 15.9041 15.9041 15.9049 15.9049 15.9070 15.9070 k = 0.5000 0.1165 0.1512 ( 4296 PWs) bands (ev): -12.0664 -12.0664 -12.0659 -12.0659 -12.0656 -12.0656 -12.0651 -12.0651 -11.1810 -11.1810 -11.1810 -11.1810 -11.1809 -11.1809 -11.1809 -11.1809 -0.4186 -0.4186 -0.4184 -0.4184 -0.4175 -0.4175 -0.4159 -0.4159 0.8909 0.8909 0.8911 0.8911 0.8924 0.8924 0.8931 0.8931 1.8697 1.8697 1.8736 1.8736 1.8746 1.8746 1.8836 1.8836 3.4330 3.4330 3.4375 3.4375 3.4384 3.4384 3.4392 3.4392 3.8065 3.8065 3.8073 3.8073 3.8098 3.8098 3.8131 3.8131 4.7155 4.7155 4.7161 4.7161 4.7174 4.7174 4.7177 4.7177 15.8870 15.8870 15.8871 15.8871 15.8878 15.8878 15.8901 15.8901 k = 0.5000 0.1255 0.1512 ( 4300 PWs) bands (ev): -12.0597 -12.0597 -12.0592 -12.0592 -12.0589 -12.0589 -12.0584 -12.0584 -11.1880 -11.1880 -11.1880 -11.1880 -11.1879 -11.1879 -11.1879 -11.1879 -0.4309 -0.4309 -0.4307 -0.4307 -0.4299 -0.4299 -0.4284 -0.4284 0.8766 0.8766 0.8767 0.8767 0.8779 0.8779 0.8785 0.8785 1.8833 1.8833 1.8875 1.8875 1.8879 1.8879 1.8973 1.8973 3.4605 3.4605 3.4649 3.4649 3.4663 3.4663 3.4669 3.4669 3.7914 3.7914 3.7924 3.7924 3.7946 3.7946 3.7981 3.7981 4.7257 4.7257 4.7264 4.7264 4.7276 4.7276 4.7280 4.7280 15.8712 15.8712 15.8712 15.8712 15.8719 15.8719 15.8743 15.8743 k = 0.5000 0.1345 0.1512 ( 4304 PWs) bands (ev): -12.0527 -12.0527 -12.0521 -12.0521 -12.0519 -12.0519 -12.0513 -12.0513 -11.1953 -11.1953 -11.1953 -11.1953 -11.1952 -11.1952 -11.1952 -11.1952 -0.4431 -0.4431 -0.4429 -0.4429 -0.4422 -0.4422 -0.4406 -0.4406 0.8606 0.8606 0.8607 0.8607 0.8617 0.8617 0.8624 0.8624 1.8984 1.8984 1.9027 1.9027 1.9029 1.9029 1.9124 1.9124 3.4891 3.4891 3.4935 3.4935 3.4954 3.4954 3.4957 3.4957 3.7757 3.7757 3.7771 3.7771 3.7789 3.7789 3.7828 3.7828 4.7354 4.7354 4.7362 4.7362 4.7372 4.7372 4.7377 4.7377 15.8567 15.8567 15.8568 15.8568 15.8573 15.8573 15.8599 15.8599 k = 0.5000 0.1434 0.1512 ( 4312 PWs) bands (ev): -12.0453 -12.0453 -12.0447 -12.0447 -12.0446 -12.0446 -12.0439 -12.0439 -11.2030 -11.2030 -11.2029 -11.2029 -11.2029 -11.2029 -11.2028 -11.2028 -0.4551 -0.4551 -0.4549 -0.4549 -0.4543 -0.4543 -0.4526 -0.4526 0.8432 0.8432 0.8433 0.8433 0.8441 0.8441 0.8448 0.8448 1.9149 1.9149 1.9189 1.9189 1.9198 1.9198 1.9289 1.9289 3.5184 3.5184 3.5227 3.5227 3.5253 3.5253 3.5253 3.5253 3.7598 3.7598 3.7618 3.7618 3.7631 3.7631 3.7674 3.7674 4.7444 4.7444 4.7453 4.7453 4.7462 4.7462 4.7468 4.7468 15.8438 15.8438 15.8440 15.8440 15.8444 15.8444 15.8471 15.8471 k = 0.5000 0.1524 0.1512 ( 4304 PWs) bands (ev): -12.0377 -12.0377 -12.0371 -12.0371 -12.0370 -12.0370 -12.0363 -12.0363 -11.2108 -11.2108 -11.2108 -11.2108 -11.2108 -11.2108 -11.2107 -11.2107 -0.4666 -0.4666 -0.4664 -0.4664 -0.4659 -0.4659 -0.4643 -0.4643 0.8246 0.8246 0.8246 0.8246 0.8253 0.8253 0.8260 0.8260 1.9326 1.9326 1.9363 1.9363 1.9378 1.9378 1.9466 1.9466 3.5476 3.5476 3.5519 3.5519 3.5550 3.5550 3.5556 3.5556 3.7442 3.7442 3.7471 3.7471 3.7478 3.7478 3.7526 3.7526 4.7526 4.7526 4.7536 4.7536 4.7544 4.7544 4.7550 4.7550 15.8326 15.8326 15.8329 15.8329 15.8331 15.8331 15.8360 15.8360 k = 0.5000 0.1614 0.1512 ( 4304 PWs) bands (ev): -12.0299 -12.0299 -12.0292 -12.0292 -12.0292 -12.0292 -12.0285 -12.0285 -11.2190 -11.2190 -11.2189 -11.2189 -11.2189 -11.2189 -11.2188 -11.2188 -0.4778 -0.4778 -0.4775 -0.4775 -0.4771 -0.4771 -0.4755 -0.4755 0.8050 0.8050 0.8050 0.8050 0.8055 0.8055 0.8062 0.8062 1.9513 1.9513 1.9548 1.9548 1.9569 1.9569 1.9653 1.9653 3.5756 3.5756 3.5799 3.5799 3.5835 3.5835 3.5849 3.5849 3.7301 3.7301 3.7342 3.7342 3.7343 3.7343 3.7396 3.7396 4.7597 4.7597 4.7609 4.7609 4.7615 4.7615 4.7622 4.7622 15.8232 15.8232 15.8237 15.8237 15.8237 15.8237 15.8267 15.8267 k = 0.5000 0.1703 0.1512 ( 4312 PWs) bands (ev): -12.0219 -12.0219 -12.0213 -12.0213 -12.0212 -12.0212 -12.0205 -12.0205 -11.2272 -11.2272 -11.2272 -11.2272 -11.2272 -11.2272 -11.2271 -11.2271 -0.4884 -0.4884 -0.4881 -0.4881 -0.4878 -0.4878 -0.4862 -0.4862 0.7845 0.7845 0.7846 0.7846 0.7850 0.7850 0.7857 0.7857 1.9709 1.9709 1.9741 1.9741 1.9768 1.9768 1.9849 1.9849 3.5994 3.5994 3.6038 3.6038 3.6080 3.6080 3.6105 3.6105 3.7201 3.7201 3.7251 3.7251 3.7261 3.7261 3.7311 3.7311 4.7658 4.7658 4.7671 4.7671 4.7675 4.7675 4.7684 4.7684 15.8157 15.8157 15.8161 15.8161 15.8163 15.8163 15.8193 15.8193 k = 0.5000 0.1793 0.1512 ( 4312 PWs) bands (ev): -12.0138 -12.0138 -12.0132 -12.0132 -12.0131 -12.0131 -12.0124 -12.0124 -11.2356 -11.2356 -11.2355 -11.2355 -11.2355 -11.2355 -11.2355 -11.2355 -0.4984 -0.4984 -0.4981 -0.4981 -0.4979 -0.4979 -0.4963 -0.4963 0.7636 0.7636 0.7638 0.7638 0.7639 0.7639 0.7646 0.7646 1.9911 1.9911 1.9941 1.9941 1.9973 1.9973 2.0050 2.0050 3.6142 3.6142 3.6190 3.6190 3.6230 3.6230 3.6264 3.6264 3.7202 3.7202 3.7259 3.7259 3.7273 3.7273 3.7318 3.7318 4.7706 4.7706 4.7720 4.7720 4.7723 4.7723 4.7732 4.7732 15.8101 15.8101 15.8104 15.8104 15.8108 15.8108 15.8137 15.8137 k = 0.5000 0.1883 0.1512 ( 4312 PWs) bands (ev): -12.0057 -12.0057 -12.0051 -12.0051 -12.0049 -12.0049 -12.0042 -12.0042 -11.2441 -11.2441 -11.2440 -11.2440 -11.2440 -11.2440 -11.2439 -11.2439 -0.5078 -0.5078 -0.5075 -0.5075 -0.5074 -0.5074 -0.5058 -0.5058 0.7424 0.7424 0.7427 0.7427 0.7427 0.7427 0.7434 0.7434 2.0117 2.0117 2.0145 2.0145 2.0182 2.0182 2.0255 2.0255 3.6163 3.6163 3.6214 3.6214 3.6241 3.6241 3.6274 3.6274 3.7356 3.7356 3.7410 3.7410 3.7416 3.7416 3.7455 3.7455 4.7740 4.7740 4.7757 4.7757 4.7758 4.7758 4.7768 4.7768 15.8063 15.8063 15.8066 15.8066 15.8071 15.8071 15.8100 15.8100 k = 0.5000 0.1972 0.1512 ( 4308 PWs) bands (ev): -11.9976 -11.9976 -11.9970 -11.9970 -11.9967 -11.9967 -11.9961 -11.9961 -11.2525 -11.2525 -11.2524 -11.2524 -11.2524 -11.2524 -11.2523 -11.2523 -0.5165 -0.5165 -0.5162 -0.5162 -0.5162 -0.5162 -0.5146 -0.5146 0.7212 0.7212 0.7214 0.7214 0.7216 0.7216 0.7221 0.7221 2.0325 2.0325 2.0351 2.0351 2.0393 2.0393 2.0462 2.0462 3.6084 3.6084 3.6137 3.6137 3.6149 3.6149 3.6175 3.6175 3.7620 3.7620 3.7662 3.7662 3.7666 3.7666 3.7696 3.7696 4.7762 4.7762 4.7779 4.7779 4.7779 4.7779 4.7791 4.7791 15.8044 15.8044 15.8047 15.8047 15.8053 15.8053 15.8081 15.8081 k = 0.5000 0.2062 0.1512 ( 4316 PWs) bands (ev): -11.9895 -11.9895 -11.9889 -11.9889 -11.9886 -11.9886 -11.9880 -11.9880 -11.2608 -11.2608 -11.2608 -11.2608 -11.2607 -11.2607 -11.2607 -11.2607 -0.5246 -0.5246 -0.5243 -0.5243 -0.5243 -0.5243 -0.5228 -0.5228 0.7003 0.7003 0.7004 0.7004 0.7007 0.7007 0.7012 0.7012 2.0532 2.0532 2.0556 2.0556 2.0603 2.0603 2.0668 2.0668 3.5952 3.5952 3.6006 3.6006 3.6007 3.6007 3.6029 3.6029 3.7933 3.7933 3.7961 3.7961 3.7973 3.7973 3.7992 3.7992 4.7769 4.7769 4.7786 4.7786 4.7788 4.7788 4.7799 4.7799 15.8042 15.8042 15.8044 15.8044 15.8052 15.8052 15.8079 15.8079 k = 0.5000 0.2152 0.1512 ( 4308 PWs) bands (ev): -11.9816 -11.9816 -11.9810 -11.9810 -11.9806 -11.9806 -11.9801 -11.9801 -11.2690 -11.2690 -11.2690 -11.2690 -11.2689 -11.2689 -11.2689 -11.2689 -0.5320 -0.5320 -0.5317 -0.5317 -0.5316 -0.5316 -0.5302 -0.5302 0.6799 0.6799 0.6799 0.6799 0.6803 0.6803 0.6807 0.6807 2.0736 2.0736 2.0759 2.0759 2.0810 2.0810 2.0871 2.0871 3.5798 3.5798 3.5845 3.5845 3.5852 3.5852 3.5865 3.5865 3.8265 3.8265 3.8285 3.8285 3.8300 3.8300 3.8312 3.8312 4.7763 4.7763 4.7779 4.7779 4.7784 4.7784 4.7794 4.7794 15.8055 15.8055 15.8058 15.8058 15.8067 15.8067 15.8093 15.8093 k = 0.5000 0.2241 0.1512 ( 4312 PWs) bands (ev): -11.9738 -11.9738 -11.9733 -11.9733 -11.9729 -11.9729 -11.9724 -11.9724 -11.2770 -11.2770 -11.2769 -11.2769 -11.2769 -11.2769 -11.2768 -11.2768 -0.5386 -0.5386 -0.5384 -0.5384 -0.5382 -0.5382 -0.5370 -0.5370 0.6601 0.6601 0.6602 0.6602 0.6607 0.6607 0.6610 0.6610 2.0936 2.0936 2.0956 2.0956 2.1013 2.1013 2.1070 2.1070 3.5635 3.5635 3.5676 3.5676 3.5689 3.5689 3.5696 3.5696 3.8601 3.8601 3.8616 3.8616 3.8634 3.8634 3.8640 3.8640 4.7743 4.7743 4.7759 4.7759 4.7766 4.7766 4.7776 4.7776 15.8083 15.8083 15.8086 15.8086 15.8096 15.8096 15.8121 15.8121 k = 0.5000 0.2331 0.1512 ( 4316 PWs) bands (ev): -11.9664 -11.9664 -11.9659 -11.9659 -11.9654 -11.9654 -11.9649 -11.9649 -11.2846 -11.2846 -11.2846 -11.2846 -11.2845 -11.2845 -11.2845 -11.2845 -0.5446 -0.5446 -0.5444 -0.5444 -0.5442 -0.5442 -0.5430 -0.5430 0.6413 0.6413 0.6413 0.6413 0.6419 0.6419 0.6422 0.6422 2.1128 2.1128 2.1147 2.1147 2.1209 2.1209 2.1261 2.1261 3.5471 3.5471 3.5508 3.5508 3.5525 3.5525 3.5528 3.5528 3.8934 3.8934 3.8946 3.8946 3.8965 3.8965 3.8967 3.8967 4.7711 4.7711 4.7726 4.7726 4.7736 4.7736 4.7745 4.7745 15.8123 15.8123 15.8126 15.8126 15.8138 15.8138 15.8161 15.8161 k = 0.5000 0.2420 0.1512 ( 4312 PWs) bands (ev): -11.9593 -11.9593 -11.9589 -11.9589 -11.9583 -11.9583 -11.9579 -11.9579 -11.2919 -11.2919 -11.2919 -11.2919 -11.2918 -11.2918 -11.2918 -11.2918 -0.5499 -0.5499 -0.5498 -0.5498 -0.5494 -0.5494 -0.5484 -0.5484 0.6237 0.6237 0.6237 0.6237 0.6243 0.6243 0.6245 0.6245 2.1311 2.1311 2.1328 2.1328 2.1395 2.1395 2.1442 2.1442 3.5311 3.5311 3.5344 3.5344 3.5365 3.5365 3.5366 3.5366 3.9258 3.9258 3.9268 3.9268 3.9286 3.9286 3.9287 3.9287 4.7669 4.7669 4.7683 4.7683 4.7695 4.7695 4.7704 4.7704 15.8173 15.8173 15.8175 15.8175 15.8189 15.8189 15.8211 15.8211 k = 0.5000 0.2510 0.1512 ( 4316 PWs) bands (ev): -11.9527 -11.9527 -11.9523 -11.9523 -11.9517 -11.9517 -11.9513 -11.9513 -11.2987 -11.2987 -11.2987 -11.2987 -11.2986 -11.2986 -11.2986 -11.2986 -0.5545 -0.5545 -0.5544 -0.5544 -0.5540 -0.5540 -0.5531 -0.5531 0.6073 0.6073 0.6073 0.6073 0.6080 0.6080 0.6082 0.6082 2.1483 2.1483 2.1498 2.1498 2.1569 2.1569 2.1612 2.1612 3.5159 3.5159 3.5188 3.5188 3.5212 3.5212 3.5213 3.5213 3.9568 3.9568 3.9577 3.9577 3.9592 3.9592 3.9596 3.9596 4.7617 4.7617 4.7631 4.7631 4.7645 4.7645 4.7653 4.7653 15.8230 15.8230 15.8232 15.8232 15.8247 15.8247 15.8267 15.8267 k = 0.5000 0.2600 0.1512 ( 4320 PWs) bands (ev): -11.9466 -11.9466 -11.9463 -11.9463 -11.9456 -11.9456 -11.9452 -11.9452 -11.3050 -11.3050 -11.3050 -11.3050 -11.3049 -11.3049 -11.3049 -11.3049 -0.5585 -0.5585 -0.5585 -0.5585 -0.5580 -0.5580 -0.5572 -0.5572 0.5925 0.5925 0.5925 0.5925 0.5932 0.5932 0.5933 0.5933 2.1640 2.1640 2.1654 2.1654 2.1730 2.1730 2.1768 2.1768 3.5018 3.5018 3.5044 3.5044 3.5069 3.5069 3.5071 3.5071 3.9858 3.9858 3.9868 3.9868 3.9879 3.9879 3.9886 3.9886 4.7559 4.7559 4.7571 4.7571 4.7588 4.7588 4.7596 4.7596 15.8291 15.8291 15.8292 15.8292 15.8309 15.8309 15.8327 15.8327 k = 0.5000 0.2689 0.1512 ( 4320 PWs) bands (ev): -11.9412 -11.9412 -11.9409 -11.9409 -11.9401 -11.9401 -11.9397 -11.9397 -11.3106 -11.3106 -11.3106 -11.3106 -11.3105 -11.3105 -11.3105 -11.3105 -0.5619 -0.5619 -0.5619 -0.5619 -0.5614 -0.5614 -0.5606 -0.5606 0.5793 0.5793 0.5793 0.5793 0.5801 0.5801 0.5801 0.5801 2.1782 2.1782 2.1794 2.1794 2.1875 2.1875 2.1908 2.1908 3.4890 3.4890 3.4912 3.4912 3.4940 3.4940 3.4942 3.4942 4.0126 4.0126 4.0136 4.0136 4.0143 4.0143 4.0152 4.0152 4.7497 4.7497 4.7509 4.7509 4.7529 4.7529 4.7536 4.7536 15.8353 15.8353 15.8354 15.8354 15.8372 15.8372 15.8388 15.8388 k = 0.5000 0.2779 0.1512 ( 4324 PWs) bands (ev): -11.9364 -11.9364 -11.9361 -11.9361 -11.9353 -11.9353 -11.9350 -11.9350 -11.3155 -11.3155 -11.3155 -11.3155 -11.3155 -11.3155 -11.3154 -11.3154 -0.5648 -0.5648 -0.5647 -0.5647 -0.5641 -0.5641 -0.5635 -0.5635 0.5678 0.5678 0.5679 0.5679 0.5687 0.5687 0.5687 0.5687 2.1907 2.1907 2.1916 2.1916 2.2002 2.2002 2.2030 2.2030 3.4778 3.4778 3.4797 3.4797 3.4827 3.4827 3.4829 3.4829 4.0364 4.0364 4.0376 4.0376 4.0378 4.0378 4.0390 4.0390 4.7435 4.7435 4.7446 4.7446 4.7468 4.7468 4.7475 4.7475 15.8412 15.8412 15.8413 15.8413 15.8433 15.8433 15.8447 15.8447 k = 0.5000 0.2869 0.1512 ( 4340 PWs) bands (ev): -11.9324 -11.9324 -11.9321 -11.9321 -11.9312 -11.9312 -11.9310 -11.9310 -11.3197 -11.3197 -11.3196 -11.3196 -11.3196 -11.3196 -11.3196 -11.3196 -0.5670 -0.5670 -0.5670 -0.5670 -0.5663 -0.5663 -0.5659 -0.5659 0.5583 0.5583 0.5584 0.5584 0.5592 0.5592 0.5593 0.5593 2.2011 2.2011 2.2019 2.2019 2.2109 2.2109 2.2131 2.2131 3.4684 3.4684 3.4699 3.4699 3.4731 3.4731 3.4733 3.4733 4.0568 4.0568 4.0580 4.0580 4.0581 4.0581 4.0593 4.0593 4.7377 4.7377 4.7386 4.7386 4.7412 4.7412 4.7417 4.7417 15.8466 15.8466 15.8467 15.8467 15.8488 15.8488 15.8499 15.8499 k = 0.5000 0.2958 0.1512 ( 4340 PWs) bands (ev): -11.9291 -11.9291 -11.9290 -11.9290 -11.9280 -11.9280 -11.9278 -11.9278 -11.3230 -11.3230 -11.3229 -11.3229 -11.3229 -11.3229 -11.3228 -11.3228 -0.5688 -0.5688 -0.5687 -0.5687 -0.5680 -0.5680 -0.5677 -0.5677 0.5509 0.5509 0.5509 0.5509 0.5518 0.5518 0.5518 0.5518 2.2095 2.2095 2.2100 2.2100 2.2195 2.2195 2.2212 2.2212 3.4609 3.4609 3.4620 3.4620 3.4655 3.4655 3.4657 3.4657 4.0734 4.0734 4.0743 4.0743 4.0748 4.0748 4.0757 4.0757 4.7327 4.7327 4.7334 4.7334 4.7363 4.7363 4.7367 4.7367 15.8511 15.8511 15.8512 15.8512 15.8535 15.8535 15.8543 15.8543 k = 0.5000 0.3048 0.1512 ( 4340 PWs) bands (ev): -11.9268 -11.9268 -11.9267 -11.9267 -11.9256 -11.9256 -11.9255 -11.9255 -11.3253 -11.3253 -11.3253 -11.3253 -11.3253 -11.3253 -11.3252 -11.3252 -0.5700 -0.5700 -0.5700 -0.5700 -0.5692 -0.5692 -0.5689 -0.5689 0.5455 0.5455 0.5455 0.5455 0.5464 0.5464 0.5464 0.5464 2.2155 2.2155 2.2159 2.2159 2.2258 2.2258 2.2270 2.2270 3.4555 3.4555 3.4562 3.4562 3.4600 3.4600 3.4601 3.4601 4.0857 4.0857 4.0862 4.0862 4.0872 4.0872 4.0878 4.0878 4.7288 4.7288 4.7293 4.7293 4.7325 4.7325 4.7327 4.7327 15.8546 15.8546 15.8546 15.8546 15.8571 15.8571 15.8577 15.8577 k = 0.5000 0.3138 0.1512 ( 4344 PWs) bands (ev): -11.9254 -11.9254 -11.9253 -11.9253 -11.9242 -11.9242 -11.9241 -11.9241 -11.3268 -11.3268 -11.3268 -11.3268 -11.3267 -11.3267 -11.3267 -11.3267 -0.5707 -0.5707 -0.5707 -0.5707 -0.5698 -0.5698 -0.5697 -0.5697 0.5422 0.5422 0.5422 0.5422 0.5431 0.5431 0.5431 0.5431 2.2193 2.2193 2.2195 2.2195 2.2298 2.2298 2.2304 2.2304 3.4522 3.4522 3.4526 3.4526 3.4566 3.4566 3.4567 3.4567 4.0932 4.0932 4.0935 4.0935 4.0948 4.0948 4.0951 4.0951 4.7264 4.7264 4.7266 4.7266 4.7301 4.7301 4.7302 4.7302 15.8567 15.8567 15.8568 15.8568 15.8594 15.8594 15.8597 15.8597 k = 0.5000 0.3227 0.1512 ( 4352 PWs) bands (ev): -11.9249 -11.9249 -11.9249 -11.9249 -11.9237 -11.9237 -11.9237 -11.9237 -11.3273 -11.3273 -11.3273 -11.3273 -11.3272 -11.3272 -11.3272 -11.3272 -0.5709 -0.5709 -0.5709 -0.5709 -0.5700 -0.5700 -0.5700 -0.5700 0.5411 0.5411 0.5411 0.5411 0.5420 0.5420 0.5420 0.5420 2.2206 2.2206 2.2206 2.2206 2.2313 2.2313 2.2313 2.2313 3.4513 3.4513 3.4513 3.4513 3.4555 3.4555 3.4555 3.4555 4.0959 4.0959 4.0959 4.0959 4.0975 4.0975 4.0975 4.0975 4.7257 4.7257 4.7257 4.7257 4.7293 4.7293 4.7293 4.7293 15.8575 15.8575 15.8575 15.8575 15.8602 15.8602 15.8602 15.8602 k = 0.5000 0.3227 0.1512 ( 4352 PWs) bands (ev): -11.9249 -11.9249 -11.9249 -11.9249 -11.9237 -11.9237 -11.9237 -11.9237 -11.3273 -11.3273 -11.3273 -11.3273 -11.3272 -11.3272 -11.3272 -11.3272 -0.5709 -0.5709 -0.5709 -0.5709 -0.5700 -0.5700 -0.5700 -0.5700 0.5411 0.5411 0.5411 0.5411 0.5420 0.5420 0.5420 0.5420 2.2206 2.2206 2.2206 2.2206 2.2313 2.2313 2.2313 2.2313 3.4513 3.4513 3.4513 3.4513 3.4555 3.4555 3.4555 3.4555 4.0959 4.0959 4.0959 4.0959 4.0975 4.0975 4.0975 4.0975 4.7257 4.7257 4.7257 4.7257 4.7293 4.7293 4.7293 4.7293 15.8575 15.8575 15.8575 15.8575 15.8602 15.8602 15.8602 15.8602 k = 0.4911 0.3227 0.1512 ( 4352 PWs) bands (ev): -11.9353 -11.9353 -11.9353 -11.9353 -11.9153 -11.9153 -11.9153 -11.9153 -11.3364 -11.3364 -11.3364 -11.3364 -11.3178 -11.3178 -11.3178 -11.3178 -0.5817 -0.5817 -0.5817 -0.5817 -0.5566 -0.5566 -0.5566 -0.5566 0.5385 0.5385 0.5385 0.5385 0.5471 0.5471 0.5471 0.5471 2.2077 2.2077 2.2077 2.2077 2.2427 2.2427 2.2427 2.2427 3.4391 3.4391 3.4391 3.4391 3.4684 3.4684 3.4684 3.4684 4.0947 4.0947 4.0947 4.0947 4.0989 4.0989 4.0989 4.0989 4.7206 4.7206 4.7206 4.7206 4.7346 4.7346 4.7346 4.7346 15.8347 15.8347 15.8347 15.8347 15.8837 15.8837 15.8837 15.8837 k = 0.4821 0.3227 0.1512 ( 4356 PWs) bands (ev): -11.9483 -11.9483 -11.9483 -11.9483 -11.9085 -11.9085 -11.9085 -11.9085 -11.3453 -11.3453 -11.3453 -11.3453 -11.3081 -11.3081 -11.3081 -11.3081 -0.5903 -0.5903 -0.5903 -0.5903 -0.5402 -0.5402 -0.5402 -0.5402 0.5378 0.5378 0.5378 0.5378 0.5552 0.5552 0.5552 0.5552 2.1895 2.1895 2.1895 2.1895 2.2567 2.2567 2.2567 2.2567 3.4261 3.4261 3.4261 3.4261 3.4837 3.4837 3.4837 3.4837 4.0933 4.0933 4.0933 4.0933 4.1013 4.1013 4.1013 4.1013 4.7143 4.7143 4.7143 4.7143 4.7417 4.7417 4.7417 4.7417 15.8113 15.8113 15.8113 15.8113 15.9091 15.9091 15.9091 15.9091 k = 0.4732 0.3227 0.1512 ( 4356 PWs) bands (ev): -11.9633 -11.9633 -11.9633 -11.9633 -11.9036 -11.9036 -11.9036 -11.9036 -11.3540 -11.3540 -11.3540 -11.3540 -11.2982 -11.2982 -11.2982 -11.2982 -0.5963 -0.5963 -0.5963 -0.5963 -0.5210 -0.5210 -0.5210 -0.5210 0.5393 0.5393 0.5393 0.5393 0.5660 0.5660 0.5660 0.5660 2.1700 2.1700 2.1700 2.1700 2.2694 2.2694 2.2694 2.2694 3.4141 3.4141 3.4141 3.4141 3.4993 3.4993 3.4993 3.4993 4.0920 4.0920 4.0920 4.0920 4.1041 4.1041 4.1041 4.1041 4.7083 4.7083 4.7083 4.7083 4.7491 4.7491 4.7491 4.7491 15.7889 15.7889 15.7889 15.7889 15.9348 15.9348 15.9348 15.9348 k = 0.4643 0.3227 0.1512 ( 4336 PWs) bands (ev): -11.9801 -11.9801 -11.9801 -11.9801 -11.9008 -11.9008 -11.9008 -11.9008 -11.3624 -11.3624 -11.3624 -11.3624 -11.2881 -11.2881 -11.2881 -11.2881 -0.5998 -0.5998 -0.5998 -0.5998 -0.4993 -0.4993 -0.4993 -0.4993 0.5430 0.5430 0.5430 0.5430 0.5795 0.5795 0.5795 0.5795 2.1495 2.1495 2.1495 2.1495 2.2805 2.2805 2.2805 2.2805 3.4034 3.4034 3.4034 3.4034 3.5148 3.5148 3.5148 3.5148 4.0909 4.0909 4.0909 4.0909 4.1075 4.1075 4.1075 4.1075 4.7026 4.7026 4.7026 4.7026 4.7567 4.7567 4.7567 4.7567 15.7673 15.7673 15.7673 15.7673 15.9607 15.9607 15.9607 15.9607 k = 0.4554 0.3227 0.1512 ( 4340 PWs) bands (ev): -11.9988 -11.9988 -11.9988 -11.9988 -11.9000 -11.9000 -11.9000 -11.9000 -11.3707 -11.3707 -11.3707 -11.3707 -11.2779 -11.2779 -11.2779 -11.2779 -0.6009 -0.6009 -0.6009 -0.6009 -0.4749 -0.4749 -0.4749 -0.4749 0.5487 0.5487 0.5487 0.5487 0.5957 0.5957 0.5957 0.5957 2.1282 2.1282 2.1282 2.1282 2.2900 2.2900 2.2900 2.2900 3.3941 3.3941 3.3941 3.3941 3.5301 3.5301 3.5301 3.5301 4.0900 4.0900 4.0900 4.0900 4.1114 4.1114 4.1114 4.1114 4.6972 4.6972 4.6972 4.6972 4.7645 4.7645 4.7645 4.7645 15.7466 15.7466 15.7466 15.7466 15.9865 15.9865 15.9865 15.9865 k = 0.4464 0.3227 0.1512 ( 4336 PWs) bands (ev): -12.0191 -12.0191 -12.0191 -12.0191 -11.9011 -11.9011 -11.9011 -11.9011 -11.3788 -11.3788 -11.3788 -11.3788 -11.2676 -11.2676 -11.2676 -11.2676 -0.5996 -0.5996 -0.5996 -0.5996 -0.4480 -0.4480 -0.4480 -0.4480 0.5562 0.5562 0.5562 0.5562 0.6147 0.6147 0.6147 0.6147 2.1066 2.1066 2.1066 2.1066 2.2979 2.2979 2.2979 2.2979 3.3863 3.3863 3.3863 3.3863 3.5448 3.5448 3.5448 3.5448 4.0893 4.0893 4.0893 4.0893 4.1161 4.1161 4.1161 4.1161 4.6921 4.6921 4.6921 4.6921 4.7724 4.7724 4.7724 4.7724 15.7268 15.7268 15.7268 15.7268 16.0119 16.0119 16.0119 16.0119 k = 0.4375 0.3227 0.1512 ( 4336 PWs) bands (ev): -12.0410 -12.0410 -12.0410 -12.0410 -11.9039 -11.9039 -11.9039 -11.9039 -11.3869 -11.3869 -11.3869 -11.3869 -11.2574 -11.2574 -11.2574 -11.2574 -0.5960 -0.5960 -0.5960 -0.5960 -0.4185 -0.4185 -0.4185 -0.4185 0.5653 0.5653 0.5653 0.5653 0.6364 0.6364 0.6364 0.6364 2.0847 2.0847 2.0847 2.0847 2.3044 2.3044 2.3044 2.3044 3.3800 3.3800 3.3800 3.3800 3.5586 3.5586 3.5586 3.5586 4.0889 4.0889 4.0889 4.0889 4.1215 4.1215 4.1215 4.1215 4.6873 4.6873 4.6873 4.6873 4.7804 4.7804 4.7804 4.7804 15.7079 15.7079 15.7079 15.7079 16.0364 16.0364 16.0364 16.0364 k = 0.4286 0.3227 0.1512 ( 4332 PWs) bands (ev): -12.0643 -12.0643 -12.0643 -12.0643 -11.9085 -11.9085 -11.9085 -11.9085 -11.3950 -11.3950 -11.3950 -11.3950 -11.2473 -11.2473 -11.2473 -11.2473 -0.5903 -0.5903 -0.5903 -0.5903 -0.3865 -0.3865 -0.3865 -0.3865 0.5759 0.5759 0.5759 0.5759 0.6610 0.6610 0.6610 0.6610 2.0628 2.0628 2.0628 2.0628 2.3096 2.3096 2.3096 2.3096 3.3751 3.3751 3.3751 3.3751 3.5713 3.5713 3.5713 3.5713 4.0886 4.0886 4.0886 4.0886 4.1278 4.1278 4.1278 4.1278 4.6829 4.6829 4.6829 4.6829 4.7886 4.7886 4.7886 4.7886 15.6898 15.6898 15.6898 15.6898 16.0598 16.0598 16.0598 16.0598 k = 0.4196 0.3227 0.1512 ( 4324 PWs) bands (ev): -12.0890 -12.0890 -12.0890 -12.0890 -11.9147 -11.9147 -11.9147 -11.9147 -11.4031 -11.4031 -11.4031 -11.4031 -11.2373 -11.2373 -11.2373 -11.2373 -0.5825 -0.5825 -0.5825 -0.5825 -0.3522 -0.3522 -0.3522 -0.3522 0.5877 0.5877 0.5877 0.5877 0.6883 0.6883 0.6883 0.6883 2.0413 2.0413 2.0413 2.0413 2.3137 2.3137 2.3137 2.3137 3.3718 3.3718 3.3718 3.3718 3.5828 3.5828 3.5828 3.5828 4.0887 4.0887 4.0887 4.0887 4.1350 4.1350 4.1350 4.1350 4.6789 4.6789 4.6789 4.6789 4.7968 4.7968 4.7968 4.7968 15.6725 15.6725 15.6725 15.6725 16.0814 16.0814 16.0814 16.0814 k = 0.4107 0.3227 0.1512 ( 4320 PWs) bands (ev): -12.1149 -12.1149 -12.1149 -12.1149 -11.9225 -11.9225 -11.9225 -11.9225 -11.4112 -11.4112 -11.4112 -11.4112 -11.2276 -11.2276 -11.2276 -11.2276 -0.5729 -0.5729 -0.5729 -0.5729 -0.3156 -0.3156 -0.3156 -0.3156 0.6006 0.6006 0.6006 0.6006 0.7185 0.7185 0.7185 0.7185 2.0202 2.0202 2.0202 2.0202 2.3169 2.3169 2.3169 2.3169 3.3699 3.3699 3.3699 3.3699 3.5928 3.5928 3.5928 3.5928 4.0890 4.0890 4.0890 4.0890 4.1431 4.1431 4.1431 4.1431 4.6751 4.6751 4.6751 4.6751 4.8050 4.8050 4.8050 4.8050 15.6558 15.6558 15.6558 15.6558 16.1009 16.1009 16.1009 16.1009 k = 0.4018 0.3227 0.1512 ( 4320 PWs) bands (ev): -12.1418 -12.1418 -12.1418 -12.1418 -11.9316 -11.9316 -11.9316 -11.9316 -11.4195 -11.4195 -11.4195 -11.4195 -11.2182 -11.2182 -11.2182 -11.2182 -0.5615 -0.5615 -0.5615 -0.5615 -0.2768 -0.2768 -0.2768 -0.2768 0.6143 0.6143 0.6143 0.6143 0.7513 0.7513 0.7513 0.7513 2.0000 2.0000 2.0000 2.0000 2.3196 2.3196 2.3196 2.3196 3.3693 3.3693 3.3693 3.3693 3.6011 3.6011 3.6011 3.6011 4.0895 4.0895 4.0895 4.0895 4.1523 4.1523 4.1523 4.1523 4.6717 4.6717 4.6717 4.6717 4.8131 4.8131 4.8131 4.8131 15.6397 15.6397 15.6397 15.6397 16.1176 16.1176 16.1176 16.1176 k = 0.3929 0.3227 0.1512 ( 4324 PWs) bands (ev): -12.1696 -12.1696 -12.1696 -12.1696 -11.9420 -11.9420 -11.9420 -11.9420 -11.4280 -11.4280 -11.4280 -11.4280 -11.2092 -11.2092 -11.2092 -11.2092 -0.5486 -0.5486 -0.5486 -0.5486 -0.2360 -0.2360 -0.2360 -0.2360 0.6287 0.6287 0.6287 0.6287 0.7868 0.7868 0.7868 0.7868 1.9808 1.9808 1.9808 1.9808 2.3221 2.3221 2.3221 2.3221 3.3701 3.3701 3.3701 3.3701 3.6078 3.6078 3.6078 3.6078 4.0904 4.0904 4.0904 4.0904 4.1623 4.1623 4.1623 4.1623 4.6687 4.6687 4.6687 4.6687 4.8213 4.8213 4.8213 4.8213 15.6240 15.6240 15.6240 15.6240 16.1313 16.1313 16.1313 16.1313 k = 0.3839 0.3227 0.1512 ( 4316 PWs) bands (ev): -12.1983 -12.1983 -12.1983 -12.1983 -11.9536 -11.9536 -11.9536 -11.9536 -11.4366 -11.4366 -11.4366 -11.4366 -11.2007 -11.2007 -11.2007 -11.2007 -0.5343 -0.5343 -0.5343 -0.5343 -0.1933 -0.1933 -0.1933 -0.1933 0.6434 0.6434 0.6434 0.6434 0.8250 0.8250 0.8250 0.8250 1.9630 1.9630 1.9630 1.9630 2.3246 2.3246 2.3246 2.3246 3.3720 3.3720 3.3720 3.3720 3.6128 3.6128 3.6128 3.6128 4.0915 4.0915 4.0915 4.0915 4.1733 4.1733 4.1733 4.1733 4.6660 4.6660 4.6660 4.6660 4.8294 4.8294 4.8294 4.8294 15.6086 15.6086 15.6086 15.6086 16.1414 16.1414 16.1414 16.1414 k = 0.3750 0.3227 0.1512 ( 4324 PWs) bands (ev): -12.2277 -12.2277 -12.2277 -12.2277 -11.9662 -11.9662 -11.9662 -11.9662 -11.4455 -11.4455 -11.4455 -11.4455 -11.1926 -11.1926 -11.1926 -11.1926 -0.5189 -0.5189 -0.5189 -0.5189 -0.1489 -0.1489 -0.1489 -0.1489 0.6584 0.6584 0.6584 0.6584 0.8657 0.8657 0.8657 0.8657 1.9467 1.9467 1.9467 1.9467 2.3274 2.3274 2.3274 2.3274 3.3752 3.3752 3.3752 3.3752 3.6161 3.6161 3.6161 3.6161 4.0929 4.0929 4.0929 4.0929 4.1850 4.1850 4.1850 4.1850 4.6636 4.6636 4.6636 4.6636 4.8373 4.8373 4.8373 4.8373 15.5933 15.5933 15.5933 15.5933 16.1478 16.1478 16.1478 16.1478 k = 0.3661 0.3227 0.1512 ( 4328 PWs) bands (ev): -12.2576 -12.2576 -12.2576 -12.2576 -11.9799 -11.9799 -11.9799 -11.9799 -11.4546 -11.4546 -11.4546 -11.4546 -11.1851 -11.1851 -11.1851 -11.1851 -0.5025 -0.5025 -0.5025 -0.5025 -0.1029 -0.1029 -0.1029 -0.1029 0.6735 0.6735 0.6735 0.6735 0.9089 0.9089 0.9089 0.9089 1.9323 1.9323 1.9323 1.9323 2.3309 2.3309 2.3309 2.3309 3.3795 3.3795 3.3795 3.3795 3.6178 3.6178 3.6178 3.6178 4.0945 4.0945 4.0945 4.0945 4.1974 4.1974 4.1974 4.1974 4.6615 4.6615 4.6615 4.6615 4.8452 4.8452 4.8452 4.8452 15.5780 15.5780 15.5780 15.5780 16.1503 16.1503 16.1503 16.1503 k = 0.3571 0.3227 0.1512 ( 4328 PWs) bands (ev): -12.2881 -12.2881 -12.2881 -12.2881 -11.9944 -11.9944 -11.9944 -11.9944 -11.4639 -11.4639 -11.4639 -11.4639 -11.1781 -11.1781 -11.1781 -11.1781 -0.4854 -0.4854 -0.4854 -0.4854 -0.0557 -0.0557 -0.0557 -0.0557 0.6886 0.6886 0.6886 0.6886 0.9545 0.9545 0.9545 0.9545 1.9200 1.9200 1.9200 1.9200 2.3353 2.3353 2.3353 2.3353 3.3849 3.3849 3.3849 3.3849 3.6179 3.6179 3.6179 3.6179 4.0963 4.0963 4.0963 4.0963 4.2103 4.2103 4.2103 4.2103 4.6598 4.6598 4.6598 4.6598 4.8529 4.8529 4.8529 4.8529 15.5625 15.5625 15.5625 15.5625 16.1490 16.1490 16.1490 16.1490 k = 0.3482 0.3227 0.1512 ( 4328 PWs) bands (ev): -12.3189 -12.3189 -12.3189 -12.3189 -12.0097 -12.0097 -12.0097 -12.0097 -11.4735 -11.4735 -11.4735 -11.4735 -11.1717 -11.1717 -11.1717 -11.1717 -0.4678 -0.4678 -0.4678 -0.4678 -0.0076 -0.0076 -0.0076 -0.0076 0.7035 0.7035 0.7035 0.7035 1.0024 1.0024 1.0024 1.0024 1.9101 1.9101 1.9101 1.9101 2.3409 2.3409 2.3409 2.3409 3.3915 3.3915 3.3915 3.3915 3.6166 3.6166 3.6166 3.6166 4.0983 4.0983 4.0983 4.0983 4.2234 4.2234 4.2234 4.2234 4.6584 4.6584 4.6584 4.6584 4.8605 4.8605 4.8605 4.8605 15.5465 15.5465 15.5465 15.5465 16.1439 16.1439 16.1439 16.1439 k = 0.3393 0.3227 0.1512 ( 4324 PWs) bands (ev): -12.3500 -12.3500 -12.3500 -12.3500 -12.0257 -12.0257 -12.0257 -12.0257 -11.4833 -11.4833 -11.4833 -11.4833 -11.1659 -11.1659 -11.1659 -11.1659 -0.4500 -0.4500 -0.4500 -0.4500 0.0412 0.0412 0.0412 0.0412 0.7183 0.7183 0.7183 0.7183 1.0525 1.0525 1.0525 1.0525 1.9028 1.9028 1.9028 1.9028 2.3478 2.3478 2.3478 2.3478 3.3992 3.3992 3.3992 3.3992 3.6139 3.6139 3.6139 3.6139 4.1005 4.1005 4.1005 4.1005 4.2368 4.2368 4.2368 4.2368 4.6573 4.6573 4.6573 4.6573 4.8678 4.8678 4.8678 4.8678 15.5300 15.5300 15.5300 15.5300 16.1353 16.1353 16.1353 16.1353 k = 0.3304 0.3227 0.1512 ( 4320 PWs) bands (ev): -12.3813 -12.3813 -12.3813 -12.3813 -12.0423 -12.0423 -12.0423 -12.0423 -11.4934 -11.4934 -11.4934 -11.4934 -11.1607 -11.1607 -11.1607 -11.1607 -0.4322 -0.4322 -0.4322 -0.4322 0.0903 0.0903 0.0903 0.0903 0.7330 0.7330 0.7330 0.7330 1.1046 1.1046 1.1046 1.1046 1.8984 1.8984 1.8984 1.8984 2.3561 2.3561 2.3561 2.3561 3.4083 3.4083 3.4083 3.4083 3.6102 3.6102 3.6102 3.6102 4.1027 4.1027 4.1027 4.1027 4.2501 4.2501 4.2501 4.2501 4.6566 4.6566 4.6566 4.6566 4.8750 4.8750 4.8750 4.8750 15.5126 15.5126 15.5126 15.5126 16.1232 16.1232 16.1232 16.1232 k = 0.3214 0.3227 0.1512 ( 4316 PWs) bands (ev): -12.4127 -12.4127 -12.4127 -12.4127 -12.0594 -12.0594 -12.0594 -12.0594 -11.5037 -11.5037 -11.5037 -11.5037 -11.1561 -11.1561 -11.1561 -11.1561 -0.4147 -0.4147 -0.4147 -0.4147 0.1390 0.1390 0.1390 0.1390 0.7479 0.7479 0.7479 0.7479 1.1587 1.1587 1.1587 1.1587 1.8971 1.8971 1.8971 1.8971 2.3661 2.3661 2.3661 2.3661 3.4186 3.4186 3.4186 3.4186 3.6054 3.6054 3.6054 3.6054 4.1050 4.1050 4.1050 4.1050 4.2632 4.2632 4.2632 4.2632 4.6562 4.6562 4.6562 4.6562 4.8819 4.8819 4.8819 4.8819 15.4942 15.4942 15.4942 15.4942 16.1078 16.1078 16.1078 16.1078 k = 0.3125 0.3227 0.1512 ( 4308 PWs) bands (ev): -12.4441 -12.4441 -12.4441 -12.4441 -12.0769 -12.0769 -12.0769 -12.0769 -11.5141 -11.5141 -11.5141 -11.5141 -11.1522 -11.1522 -11.1522 -11.1522 -0.3977 -0.3977 -0.3977 -0.3977 0.1870 0.1870 0.1870 0.1870 0.7632 0.7632 0.7632 0.7632 1.2146 1.2146 1.2146 1.2146 1.8992 1.8992 1.8992 1.8992 2.3778 2.3778 2.3778 2.3778 3.4304 3.4304 3.4304 3.4304 3.5998 3.5998 3.5998 3.5998 4.1072 4.1072 4.1072 4.1072 4.2759 4.2759 4.2759 4.2759 4.6561 4.6561 4.6561 4.6561 4.8886 4.8886 4.8886 4.8886 15.4746 15.4746 15.4746 15.4746 16.0892 16.0892 16.0892 16.0892 k = 0.3036 0.3227 0.1512 ( 4312 PWs) bands (ev): -12.4754 -12.4754 -12.4754 -12.4754 -12.0948 -12.0948 -12.0948 -12.0948 -11.5248 -11.5248 -11.5248 -11.5248 -11.1488 -11.1488 -11.1488 -11.1488 -0.3815 -0.3815 -0.3815 -0.3815 0.2334 0.2334 0.2334 0.2334 0.7794 0.7794 0.7794 0.7794 1.2722 1.2722 1.2722 1.2722 1.9048 1.9048 1.9048 1.9048 2.3911 2.3911 2.3911 2.3911 3.4437 3.4437 3.4437 3.4437 3.5935 3.5935 3.5935 3.5935 4.1094 4.1094 4.1094 4.1094 4.2882 4.2882 4.2882 4.2882 4.6563 4.6563 4.6563 4.6563 4.8950 4.8950 4.8950 4.8950 15.4537 15.4537 15.4537 15.4537 16.0675 16.0675 16.0675 16.0675 k = 0.2946 0.3227 0.1512 ( 4308 PWs) bands (ev): -12.5066 -12.5066 -12.5066 -12.5066 -12.1130 -12.1130 -12.1130 -12.1130 -11.5356 -11.5356 -11.5356 -11.5356 -11.1460 -11.1460 -11.1460 -11.1460 -0.3661 -0.3661 -0.3661 -0.3661 0.2774 0.2774 0.2774 0.2774 0.7970 0.7970 0.7970 0.7970 1.3312 1.3312 1.3312 1.3312 1.9141 1.9141 1.9141 1.9141 2.4061 2.4061 2.4061 2.4061 3.4587 3.4587 3.4587 3.4587 3.5866 3.5866 3.5866 3.5866 4.1114 4.1114 4.1114 4.1114 4.2998 4.2998 4.2998 4.2998 4.6569 4.6569 4.6569 4.6569 4.9012 4.9012 4.9012 4.9012 15.4312 15.4312 15.4312 15.4312 16.0429 16.0429 16.0429 16.0429 k = 0.2857 0.3227 0.1512 ( 4308 PWs) bands (ev): -12.5375 -12.5375 -12.5375 -12.5375 -12.1313 -12.1313 -12.1313 -12.1313 -11.5466 -11.5466 -11.5466 -11.5466 -11.1438 -11.1438 -11.1438 -11.1438 -0.3519 -0.3519 -0.3519 -0.3519 0.3182 0.3182 0.3182 0.3182 0.8167 0.8167 0.8167 0.8167 1.3916 1.3916 1.3916 1.3916 1.9272 1.9272 1.9272 1.9272 2.4227 2.4227 2.4227 2.4227 3.4753 3.4753 3.4753 3.4753 3.5793 3.5793 3.5793 3.5793 4.1133 4.1133 4.1133 4.1133 4.3106 4.3106 4.3106 4.3106 4.6577 4.6577 4.6577 4.6577 4.9070 4.9070 4.9070 4.9070 15.4070 15.4070 15.4070 15.4070 16.0154 16.0154 16.0154 16.0154 k = 0.2768 0.3227 0.1512 ( 4304 PWs) bands (ev): -12.5682 -12.5682 -12.5682 -12.5682 -12.1498 -12.1498 -12.1498 -12.1498 -11.5576 -11.5576 -11.5576 -11.5576 -11.1421 -11.1421 -11.1421 -11.1421 -0.3391 -0.3391 -0.3391 -0.3391 0.3549 0.3549 0.3549 0.3549 0.8392 0.8392 0.8392 0.8392 1.4531 1.4531 1.4531 1.4531 1.9442 1.9442 1.9442 1.9442 2.4407 2.4407 2.4407 2.4407 3.4937 3.4937 3.4937 3.4937 3.5717 3.5717 3.5717 3.5717 4.1150 4.1150 4.1150 4.1150 4.3206 4.3206 4.3206 4.3206 4.6589 4.6589 4.6589 4.6589 4.9125 4.9125 4.9125 4.9125 15.3810 15.3810 15.3810 15.3810 15.9851 15.9851 15.9851 15.9851 k = 0.2679 0.3227 0.1512 ( 4300 PWs) bands (ev): -12.5985 -12.5985 -12.5985 -12.5985 -12.1684 -12.1684 -12.1684 -12.1684 -11.5688 -11.5688 -11.5688 -11.5688 -11.1410 -11.1410 -11.1410 -11.1410 -0.3276 -0.3276 -0.3276 -0.3276 0.3867 0.3867 0.3867 0.3867 0.8653 0.8653 0.8653 0.8653 1.5155 1.5155 1.5155 1.5155 1.9652 1.9652 1.9652 1.9652 2.4602 2.4602 2.4602 2.4602 3.5139 3.5139 3.5139 3.5139 3.5641 3.5641 3.5641 3.5641 4.1166 4.1166 4.1166 4.1166 4.3297 4.3297 4.3297 4.3297 4.6603 4.6603 4.6603 4.6603 4.9176 4.9176 4.9176 4.9176 15.3530 15.3530 15.3530 15.3530 15.9520 15.9520 15.9520 15.9520 k = 0.2589 0.3227 0.1512 ( 4304 PWs) bands (ev): -12.6284 -12.6284 -12.6284 -12.6284 -12.1870 -12.1870 -12.1870 -12.1870 -11.5800 -11.5800 -11.5800 -11.5800 -11.1403 -11.1403 -11.1403 -11.1403 -0.3176 -0.3176 -0.3176 -0.3176 0.4129 0.4129 0.4129 0.4129 0.8951 0.8951 0.8951 0.8951 1.5786 1.5786 1.5786 1.5786 1.9903 1.9903 1.9903 1.9903 2.4809 2.4809 2.4809 2.4809 3.5354 3.5354 3.5354 3.5354 3.5570 3.5570 3.5570 3.5570 4.1180 4.1180 4.1180 4.1180 4.3376 4.3376 4.3376 4.3376 4.6620 4.6620 4.6620 4.6620 4.9224 4.9224 4.9224 4.9224 15.3231 15.3231 15.3231 15.3231 15.9163 15.9163 15.9163 15.9163 k = 0.2500 0.3227 0.1512 ( 4308 PWs) bands (ev): -12.6578 -12.6578 -12.6578 -12.6578 -12.2055 -12.2055 -12.2055 -12.2055 -11.5912 -11.5912 -11.5912 -11.5912 -11.1401 -11.1401 -11.1401 -11.1401 -0.3092 -0.3092 -0.3092 -0.3092 0.4336 0.4336 0.4336 0.4336 0.9289 0.9289 0.9289 0.9289 1.6423 1.6423 1.6423 1.6423 2.0192 2.0192 2.0192 2.0192 2.5029 2.5029 2.5029 2.5029 3.5462 3.5462 3.5462 3.5462 3.5624 3.5624 3.5624 3.5624 4.1192 4.1192 4.1192 4.1192 4.3445 4.3445 4.3445 4.3445 4.6640 4.6640 4.6640 4.6640 4.9268 4.9268 4.9268 4.9268 15.2911 15.2911 15.2911 15.2911 15.8781 15.8781 15.8781 15.8781 k = 0.2411 0.3227 0.1512 ( 4288 PWs) bands (ev): -12.6866 -12.6866 -12.6866 -12.6866 -12.2239 -12.2239 -12.2239 -12.2239 -11.6024 -11.6024 -11.6024 -11.6024 -11.1404 -11.1404 -11.1404 -11.1404 -0.3024 -0.3024 -0.3024 -0.3024 0.4487 0.4487 0.4487 0.4487 0.9663 0.9663 0.9663 0.9663 1.7062 1.7062 1.7062 1.7062 2.0521 2.0521 2.0521 2.0521 2.5260 2.5260 2.5260 2.5260 3.5398 3.5398 3.5398 3.5398 3.5870 3.5870 3.5870 3.5870 4.1204 4.1204 4.1204 4.1204 4.3502 4.3502 4.3502 4.3502 4.6662 4.6662 4.6662 4.6662 4.9309 4.9309 4.9309 4.9309 15.2572 15.2572 15.2572 15.2572 15.8374 15.8374 15.8374 15.8374 k = 0.2321 0.3227 0.1512 ( 4292 PWs) bands (ev): -12.7149 -12.7149 -12.7149 -12.7149 -12.2420 -12.2420 -12.2420 -12.2420 -11.6135 -11.6135 -11.6135 -11.6135 -11.1410 -11.1410 -11.1410 -11.1410 -0.2972 -0.2972 -0.2972 -0.2972 0.4588 0.4588 0.4588 0.4588 1.0066 1.0066 1.0066 1.0066 1.7701 1.7701 1.7701 1.7701 2.0888 2.0888 2.0888 2.0888 2.5501 2.5501 2.5501 2.5501 3.5328 3.5328 3.5328 3.5328 3.6140 3.6140 3.6140 3.6140 4.1216 4.1216 4.1216 4.1216 4.3547 4.3547 4.3547 4.3547 4.6686 4.6686 4.6686 4.6686 4.9344 4.9344 4.9344 4.9344 15.2212 15.2212 15.2212 15.2212 15.7944 15.7944 15.7944 15.7944 k = 0.2232 0.3227 0.1512 ( 4292 PWs) bands (ev): -12.7425 -12.7425 -12.7425 -12.7425 -12.2600 -12.2600 -12.2600 -12.2600 -11.6245 -11.6245 -11.6245 -11.6245 -11.1420 -11.1420 -11.1420 -11.1420 -0.2935 -0.2935 -0.2935 -0.2935 0.4647 0.4647 0.4647 0.4647 1.0491 1.0491 1.0491 1.0491 1.8338 1.8338 1.8338 1.8338 2.1290 2.1290 2.1290 2.1290 2.5754 2.5754 2.5754 2.5754 3.5261 3.5261 3.5261 3.5261 3.6425 3.6425 3.6425 3.6425 4.1229 4.1229 4.1229 4.1229 4.3579 4.3579 4.3579 4.3579 4.6713 4.6713 4.6713 4.6713 4.9376 4.9376 4.9376 4.9376 15.1834 15.1834 15.1834 15.1834 15.7492 15.7492 15.7492 15.7492 k = 0.2143 0.3227 0.1512 ( 4296 PWs) bands (ev): -12.7694 -12.7694 -12.7694 -12.7694 -12.2777 -12.2777 -12.2777 -12.2777 -11.6354 -11.6354 -11.6354 -11.6354 -11.1433 -11.1433 -11.1433 -11.1433 -0.2913 -0.2913 -0.2913 -0.2913 0.4669 0.4669 0.4669 0.4669 1.0930 1.0930 1.0930 1.0930 1.8970 1.8970 1.8970 1.8970 2.1725 2.1725 2.1725 2.1725 2.6016 2.6016 2.6016 2.6016 3.5200 3.5200 3.5200 3.5200 3.6719 3.6719 3.6719 3.6719 4.1246 4.1246 4.1246 4.1246 4.3597 4.3597 4.3597 4.3597 4.6741 4.6741 4.6741 4.6741 4.9403 4.9403 4.9403 4.9403 15.1437 15.1437 15.1437 15.1437 15.7021 15.7021 15.7021 15.7021 k = 0.2054 0.3227 0.1512 ( 4300 PWs) bands (ev): -12.7955 -12.7955 -12.7955 -12.7955 -12.2950 -12.2950 -12.2950 -12.2950 -11.6462 -11.6462 -11.6462 -11.6462 -11.1449 -11.1449 -11.1449 -11.1449 -0.2904 -0.2904 -0.2904 -0.2904 0.4661 0.4661 0.4661 0.4661 1.1373 1.1373 1.1373 1.1373 1.9596 1.9596 1.9596 1.9596 2.2192 2.2192 2.2192 2.2192 2.6290 2.6290 2.6290 2.6290 3.5146 3.5146 3.5146 3.5146 3.7019 3.7019 3.7019 3.7019 4.1269 4.1269 4.1269 4.1269 4.3602 4.3602 4.3602 4.3602 4.6772 4.6772 4.6772 4.6772 4.9425 4.9425 4.9425 4.9425 15.1024 15.1024 15.1024 15.1024 15.6532 15.6532 15.6532 15.6532 k = 0.1964 0.3227 0.1512 ( 4296 PWs) bands (ev): -12.8209 -12.8209 -12.8209 -12.8209 -12.3119 -12.3119 -12.3119 -12.3119 -11.6568 -11.6568 -11.6568 -11.6568 -11.1468 -11.1468 -11.1468 -11.1468 -0.2908 -0.2908 -0.2908 -0.2908 0.4629 0.4629 0.4629 0.4629 1.1816 1.1816 1.1816 1.1816 2.0212 2.0212 2.0212 2.0212 2.2685 2.2685 2.2685 2.2685 2.6574 2.6574 2.6574 2.6574 3.5100 3.5100 3.5100 3.5100 3.7317 3.7317 3.7317 3.7317 4.1300 4.1300 4.1300 4.1300 4.3593 4.3593 4.3593 4.3593 4.6804 4.6804 4.6804 4.6804 4.9443 4.9443 4.9443 4.9443 15.0597 15.0597 15.0597 15.0597 15.6029 15.6029 15.6029 15.6029 k = 0.1875 0.3227 0.1512 ( 4300 PWs) bands (ev): -12.8454 -12.8454 -12.8454 -12.8454 -12.3284 -12.3284 -12.3284 -12.3284 -11.6671 -11.6671 -11.6671 -11.6671 -11.1488 -11.1488 -11.1488 -11.1488 -0.2924 -0.2924 -0.2924 -0.2924 0.4579 0.4579 0.4579 0.4579 1.2250 1.2250 1.2250 1.2250 2.0816 2.0816 2.0816 2.0816 2.3202 2.3202 2.3202 2.3202 2.6869 2.6869 2.6869 2.6869 3.5065 3.5065 3.5065 3.5065 3.7607 3.7607 3.7607 3.7607 4.1346 4.1346 4.1346 4.1346 4.3570 4.3570 4.3570 4.3570 4.6838 4.6838 4.6838 4.6838 4.9456 4.9456 4.9456 4.9456 15.0157 15.0157 15.0157 15.0157 15.5512 15.5512 15.5512 15.5512 k = 0.1786 0.3227 0.1512 ( 4304 PWs) bands (ev): -12.8690 -12.8690 -12.8690 -12.8690 -12.3444 -12.3444 -12.3444 -12.3444 -11.6772 -11.6772 -11.6772 -11.6772 -11.1511 -11.1511 -11.1511 -11.1511 -0.2949 -0.2949 -0.2949 -0.2949 0.4515 0.4515 0.4515 0.4515 1.2672 1.2672 1.2672 1.2672 2.1408 2.1408 2.1408 2.1408 2.3738 2.3738 2.3738 2.3738 2.7177 2.7177 2.7177 2.7177 3.5041 3.5041 3.5041 3.5041 3.7882 3.7882 3.7882 3.7882 4.1410 4.1410 4.1410 4.1410 4.3532 4.3532 4.3532 4.3532 4.6874 4.6874 4.6874 4.6874 4.9465 4.9465 4.9465 4.9465 14.9706 14.9706 14.9706 14.9706 15.4986 15.4986 15.4986 15.4986 k = 0.1696 0.3227 0.1512 ( 4308 PWs) bands (ev): -12.8917 -12.8917 -12.8917 -12.8917 -12.3599 -12.3599 -12.3599 -12.3599 -11.6871 -11.6871 -11.6871 -11.6871 -11.1535 -11.1535 -11.1535 -11.1535 -0.2983 -0.2983 -0.2983 -0.2983 0.4439 0.4439 0.4439 0.4439 1.3076 1.3076 1.3076 1.3076 2.1984 2.1984 2.1984 2.1984 2.4288 2.4288 2.4288 2.4288 2.7496 2.7496 2.7496 2.7496 3.5031 3.5031 3.5031 3.5031 3.8131 3.8131 3.8131 3.8131 4.1498 4.1498 4.1498 4.1498 4.3479 4.3479 4.3479 4.3479 4.6912 4.6912 4.6912 4.6912 4.9469 4.9469 4.9469 4.9469 14.9249 14.9249 14.9249 14.9249 15.4452 15.4452 15.4452 15.4452 k = 0.1607 0.3227 0.1512 ( 4308 PWs) bands (ev): -12.9135 -12.9135 -12.9135 -12.9135 -12.3749 -12.3749 -12.3749 -12.3749 -11.6966 -11.6966 -11.6966 -11.6966 -11.1560 -11.1560 -11.1560 -11.1560 -0.3024 -0.3024 -0.3024 -0.3024 0.4356 0.4356 0.4356 0.4356 1.3461 1.3461 1.3461 1.3461 2.2543 2.2543 2.2543 2.2543 2.4847 2.4847 2.4847 2.4847 2.7826 2.7826 2.7826 2.7826 3.5037 3.5037 3.5037 3.5037 3.8347 3.8347 3.8347 3.8347 4.1615 4.1615 4.1615 4.1615 4.3410 4.3410 4.3410 4.3410 4.6951 4.6951 4.6951 4.6951 4.9469 4.9469 4.9469 4.9469 14.8786 14.8786 14.8786 14.8786 15.3915 15.3915 15.3915 15.3915 k = 0.1518 0.3227 0.1512 ( 4304 PWs) bands (ev): -12.9342 -12.9342 -12.9342 -12.9342 -12.3892 -12.3892 -12.3892 -12.3892 -11.7057 -11.7057 -11.7057 -11.7057 -11.1586 -11.1586 -11.1586 -11.1586 -0.3071 -0.3071 -0.3071 -0.3071 0.4267 0.4267 0.4267 0.4267 1.3822 1.3822 1.3822 1.3822 2.3083 2.3083 2.3083 2.3083 2.5409 2.5409 2.5409 2.5409 2.8168 2.8168 2.8168 2.8168 3.5061 3.5061 3.5061 3.5061 3.8522 3.8522 3.8522 3.8522 4.1765 4.1765 4.1765 4.1765 4.3326 4.3326 4.3326 4.3326 4.6992 4.6992 4.6992 4.6992 4.9464 4.9464 4.9464 4.9464 14.8323 14.8323 14.8323 14.8323 15.3378 15.3378 15.3378 15.3378 k = 0.1429 0.3227 0.1512 ( 4300 PWs) bands (ev): -12.9540 -12.9540 -12.9540 -12.9540 -12.4029 -12.4029 -12.4029 -12.4029 -11.7145 -11.7145 -11.7145 -11.7145 -11.1612 -11.1612 -11.1612 -11.1612 -0.3123 -0.3123 -0.3123 -0.3123 0.4176 0.4176 0.4176 0.4176 1.4159 1.4159 1.4159 1.4159 2.3601 2.3601 2.3601 2.3601 2.5970 2.5970 2.5970 2.5970 2.8520 2.8520 2.8520 2.8520 3.5104 3.5104 3.5104 3.5104 3.8653 3.8653 3.8653 3.8653 4.1947 4.1947 4.1947 4.1947 4.3226 4.3226 4.3226 4.3226 4.7035 4.7035 4.7035 4.7035 4.9456 4.9456 4.9456 4.9456 14.7861 14.7861 14.7861 14.7861 15.2844 15.2844 15.2844 15.2844 k = 0.1339 0.3227 0.1512 ( 4304 PWs) bands (ev): -12.9727 -12.9727 -12.9727 -12.9727 -12.4159 -12.4159 -12.4159 -12.4159 -11.7229 -11.7229 -11.7229 -11.7229 -11.1638 -11.1638 -11.1638 -11.1638 -0.3178 -0.3178 -0.3178 -0.3178 0.4083 0.4083 0.4083 0.4083 1.4470 1.4470 1.4470 1.4470 2.4096 2.4096 2.4096 2.4096 2.6524 2.6524 2.6524 2.6524 2.8881 2.8881 2.8881 2.8881 3.5170 3.5170 3.5170 3.5170 3.8740 3.8740 3.8740 3.8740 4.2157 4.2157 4.2157 4.2157 4.3111 4.3111 4.3111 4.3111 4.7080 4.7080 4.7080 4.7080 4.9444 4.9444 4.9444 4.9444 14.7404 14.7404 14.7404 14.7404 15.2317 15.2317 15.2317 15.2317 k = 0.1250 0.3227 0.1512 ( 4304 PWs) bands (ev): -12.9903 -12.9903 -12.9903 -12.9903 -12.4283 -12.4283 -12.4283 -12.4283 -11.7309 -11.7309 -11.7309 -11.7309 -11.1664 -11.1664 -11.1664 -11.1664 -0.3234 -0.3234 -0.3234 -0.3234 0.3990 0.3990 0.3990 0.3990 1.4755 1.4755 1.4755 1.4755 2.4566 2.4566 2.4566 2.4566 2.7066 2.7066 2.7066 2.7066 2.9248 2.9248 2.9248 2.9248 3.5260 3.5260 3.5260 3.5260 3.8787 3.8787 3.8787 3.8787 4.2388 4.2388 4.2388 4.2388 4.2981 4.2981 4.2981 4.2981 4.7127 4.7127 4.7127 4.7127 4.9429 4.9429 4.9429 4.9429 14.6956 14.6956 14.6956 14.6956 15.1801 15.1801 15.1801 15.1801 k = 0.1161 0.3227 0.1512 ( 4300 PWs) bands (ev): -13.0068 -13.0068 -13.0068 -13.0068 -12.4399 -12.4399 -12.4399 -12.4399 -11.7385 -11.7385 -11.7385 -11.7385 -11.1690 -11.1690 -11.1690 -11.1690 -0.3292 -0.3292 -0.3292 -0.3292 0.3900 0.3900 0.3900 0.3900 1.5014 1.5014 1.5014 1.5014 2.5007 2.5007 2.5007 2.5007 2.7590 2.7590 2.7590 2.7590 2.9620 2.9620 2.9620 2.9620 3.5376 3.5376 3.5376 3.5376 3.8797 3.8797 3.8797 3.8797 4.2614 4.2614 4.2614 4.2614 4.2853 4.2853 4.2853 4.2853 4.7176 4.7176 4.7176 4.7176 4.9411 4.9411 4.9411 4.9411 14.6519 14.6519 14.6519 14.6519 15.1299 15.1299 15.1299 15.1299 k = 0.1071 0.3227 0.1512 ( 4304 PWs) bands (ev): -13.0222 -13.0222 -13.0222 -13.0222 -12.4507 -12.4507 -12.4507 -12.4507 -11.7455 -11.7455 -11.7455 -11.7455 -11.1715 -11.1715 -11.1715 -11.1715 -0.3349 -0.3349 -0.3349 -0.3349 0.3812 0.3812 0.3812 0.3812 1.5247 1.5247 1.5247 1.5247 2.5417 2.5417 2.5417 2.5417 2.8093 2.8093 2.8093 2.8093 2.9994 2.9994 2.9994 2.9994 3.5520 3.5520 3.5520 3.5520 3.8777 3.8777 3.8777 3.8777 4.2623 4.2623 4.2623 4.2623 4.2931 4.2931 4.2931 4.2931 4.7228 4.7228 4.7228 4.7228 4.9391 4.9391 4.9391 4.9391 14.6098 14.6098 14.6098 14.6098 15.0815 15.0815 15.0815 15.0815 k = 0.0982 0.3227 0.1512 ( 4300 PWs) bands (ev): -13.0364 -13.0364 -13.0364 -13.0364 -12.4608 -12.4608 -12.4608 -12.4608 -11.7521 -11.7521 -11.7521 -11.7521 -11.1739 -11.1739 -11.1739 -11.1739 -0.3406 -0.3406 -0.3406 -0.3406 0.3727 0.3727 0.3727 0.3727 1.5455 1.5455 1.5455 1.5455 2.5795 2.5795 2.5795 2.5795 2.8569 2.8569 2.8569 2.8569 3.0366 3.0366 3.0366 3.0366 3.5693 3.5693 3.5693 3.5693 3.8733 3.8733 3.8733 3.8733 4.2452 4.2452 4.2452 4.2452 4.3169 4.3169 4.3169 4.3169 4.7282 4.7282 4.7282 4.7282 4.9369 4.9369 4.9369 4.9369 14.5696 14.5696 14.5696 14.5696 15.0354 15.0354 15.0354 15.0354 k = 0.0893 0.3227 0.1512 ( 4288 PWs) bands (ev): -13.0495 -13.0495 -13.0495 -13.0495 -12.4701 -12.4701 -12.4701 -12.4701 -11.7582 -11.7582 -11.7582 -11.7582 -11.1761 -11.1761 -11.1761 -11.1761 -0.3460 -0.3460 -0.3460 -0.3460 0.3648 0.3648 0.3648 0.3648 1.5640 1.5640 1.5640 1.5640 2.6139 2.6139 2.6139 2.6139 2.9014 2.9014 2.9014 2.9014 3.0733 3.0733 3.0733 3.0733 3.5897 3.5897 3.5897 3.5897 3.8669 3.8669 3.8669 3.8669 4.2252 4.2252 4.2252 4.2252 4.3409 4.3409 4.3409 4.3409 4.7339 4.7339 4.7339 4.7339 4.9346 4.9346 4.9346 4.9346 14.5316 14.5316 14.5316 14.5316 14.9918 14.9918 14.9918 14.9918 k = 0.0804 0.3227 0.1512 ( 4300 PWs) bands (ev): -13.0613 -13.0613 -13.0613 -13.0613 -12.4785 -12.4785 -12.4785 -12.4785 -11.7637 -11.7637 -11.7637 -11.7637 -11.1782 -11.1782 -11.1782 -11.1782 -0.3511 -0.3511 -0.3511 -0.3511 0.3574 0.3574 0.3574 0.3574 1.5802 1.5802 1.5802 1.5802 2.6448 2.6448 2.6448 2.6448 2.9424 2.9424 2.9424 2.9424 3.1090 3.1090 3.1090 3.1090 3.6130 3.6130 3.6130 3.6130 3.8590 3.8590 3.8590 3.8590 4.2033 4.2033 4.2033 4.2033 4.3637 4.3637 4.3637 4.3637 4.7396 4.7396 4.7396 4.7396 4.9323 4.9323 4.9323 4.9323 14.4961 14.4961 14.4961 14.4961 14.9511 14.9511 14.9511 14.9511 k = 0.0714 0.3227 0.1512 ( 4300 PWs) bands (ev): -13.0720 -13.0720 -13.0720 -13.0720 -12.4861 -12.4861 -12.4861 -12.4861 -11.7687 -11.7687 -11.7687 -11.7687 -11.1802 -11.1802 -11.1802 -11.1802 -0.3559 -0.3559 -0.3559 -0.3559 0.3506 0.3506 0.3506 0.3506 1.5942 1.5942 1.5942 1.5942 2.6721 2.6721 2.6721 2.6721 2.9797 2.9797 2.9797 2.9797 3.1434 3.1434 3.1434 3.1434 3.6390 3.6390 3.6390 3.6390 3.8499 3.8499 3.8499 3.8499 4.1795 4.1795 4.1795 4.1795 4.3847 4.3847 4.3847 4.3847 4.7454 4.7454 4.7454 4.7454 4.9300 4.9300 4.9300 4.9300 14.4634 14.4634 14.4634 14.4634 14.9137 14.9137 14.9137 14.9137 k = 0.0625 0.3227 0.1512 ( 4312 PWs) bands (ev): -13.0814 -13.0814 -13.0814 -13.0814 -12.4929 -12.4929 -12.4929 -12.4929 -11.7732 -11.7732 -11.7732 -11.7732 -11.1819 -11.1819 -11.1819 -11.1819 -0.3603 -0.3603 -0.3603 -0.3603 0.3445 0.3445 0.3445 0.3445 1.6063 1.6063 1.6063 1.6063 2.6959 2.6959 2.6959 2.6959 3.0129 3.0129 3.0129 3.0129 3.1759 3.1759 3.1759 3.1759 3.6676 3.6676 3.6676 3.6676 3.8401 3.8401 3.8401 3.8401 4.1541 4.1541 4.1541 4.1541 4.4035 4.4035 4.4035 4.4035 4.7512 4.7512 4.7512 4.7512 4.9278 4.9278 4.9278 4.9278 14.4339 14.4339 14.4339 14.4339 14.8799 14.8799 14.8799 14.8799 k = 0.0536 0.3227 0.1512 ( 4316 PWs) bands (ev): -13.0897 -13.0897 -13.0897 -13.0897 -12.4988 -12.4988 -12.4988 -12.4988 -11.7771 -11.7771 -11.7771 -11.7771 -11.1835 -11.1835 -11.1835 -11.1835 -0.3642 -0.3642 -0.3642 -0.3642 0.3392 0.3392 0.3392 0.3392 1.6165 1.6165 1.6165 1.6165 2.7162 2.7162 2.7162 2.7162 3.0420 3.0420 3.0420 3.0420 3.2060 3.2060 3.2060 3.2060 3.6983 3.6983 3.6983 3.6983 3.8300 3.8300 3.8300 3.8300 4.1271 4.1271 4.1271 4.1271 4.4200 4.4200 4.4200 4.4200 4.7567 4.7567 4.7567 4.7567 4.9257 4.9257 4.9257 4.9257 14.4077 14.4077 14.4077 14.4077 14.8500 14.8500 14.8500 14.8500 k = 0.0446 0.3227 0.1512 ( 4320 PWs) bands (ev): -13.0966 -13.0966 -13.0966 -13.0966 -12.5038 -12.5038 -12.5038 -12.5038 -11.7804 -11.7804 -11.7804 -11.7804 -11.1848 -11.1848 -11.1848 -11.1848 -0.3676 -0.3676 -0.3676 -0.3676 0.3345 0.3345 0.3345 0.3345 1.6249 1.6249 1.6249 1.6249 2.7330 2.7330 2.7330 2.7330 3.0667 3.0667 3.0667 3.0667 3.2332 3.2332 3.2332 3.2332 3.7306 3.7306 3.7306 3.7306 3.8202 3.8202 3.8202 3.8202 4.0988 4.0988 4.0988 4.0988 4.4340 4.4340 4.4340 4.4340 4.7619 4.7619 4.7619 4.7619 4.9238 4.9238 4.9238 4.9238 14.3852 14.3852 14.3852 14.3852 14.8242 14.8242 14.8242 14.8242 k = 0.0357 0.3227 0.1512 ( 4324 PWs) bands (ev): -13.1023 -13.1023 -13.1023 -13.1023 -12.5079 -12.5079 -12.5079 -12.5079 -11.7831 -11.7831 -11.7831 -11.7831 -11.1859 -11.1859 -11.1859 -11.1859 -0.3704 -0.3704 -0.3704 -0.3704 0.3307 0.3307 0.3307 0.3307 1.6316 1.6316 1.6316 1.6316 2.7466 2.7466 2.7466 2.7466 3.0870 3.0870 3.0870 3.0870 3.2567 3.2567 3.2567 3.2567 3.7637 3.7637 3.7637 3.7637 3.8110 3.8110 3.8110 3.8110 4.0696 4.0696 4.0696 4.0696 4.4454 4.4454 4.4454 4.4454 4.7665 4.7665 4.7665 4.7665 4.9222 4.9222 4.9222 4.9222 14.3664 14.3664 14.3664 14.3664 14.8027 14.8027 14.8027 14.8027 k = 0.0268 0.3227 0.1512 ( 4328 PWs) bands (ev): -13.1068 -13.1068 -13.1068 -13.1068 -12.5111 -12.5111 -12.5111 -12.5111 -11.7852 -11.7852 -11.7852 -11.7852 -11.1868 -11.1868 -11.1868 -11.1868 -0.3726 -0.3726 -0.3726 -0.3726 0.3277 0.3277 0.3277 0.3277 1.6368 1.6368 1.6368 1.6368 2.7570 2.7570 2.7570 2.7570 3.1028 3.1028 3.1028 3.1028 3.2760 3.2760 3.2760 3.2760 3.7953 3.7953 3.7953 3.7953 3.8045 3.8045 3.8045 3.8045 4.0399 4.0399 4.0399 4.0399 4.4542 4.4542 4.4542 4.4542 4.7703 4.7703 4.7703 4.7703 4.9209 4.9209 4.9209 4.9209 14.3517 14.3517 14.3517 14.3517 14.7858 14.7858 14.7858 14.7858 k = 0.0179 0.3227 0.1512 ( 4320 PWs) bands (ev): -13.1100 -13.1100 -13.1100 -13.1100 -12.5134 -12.5134 -12.5134 -12.5134 -11.7867 -11.7867 -11.7867 -11.7867 -11.1875 -11.1875 -11.1875 -11.1875 -0.3742 -0.3742 -0.3742 -0.3742 0.3256 0.3256 0.3256 0.3256 1.6404 1.6404 1.6404 1.6404 2.7643 2.7643 2.7643 2.7643 3.1141 3.1141 3.1141 3.1141 3.2903 3.2903 3.2903 3.2903 3.7960 3.7960 3.7960 3.7960 3.8287 3.8287 3.8287 3.8287 4.0113 4.0113 4.0113 4.0113 4.4604 4.4604 4.4604 4.4604 4.7732 4.7732 4.7732 4.7732 4.9200 4.9200 4.9200 4.9200 14.3411 14.3411 14.3411 14.3411 14.7737 14.7737 14.7737 14.7737 k = 0.0089 0.3227 0.1512 ( 4328 PWs) bands (ev): -13.1119 -13.1119 -13.1119 -13.1119 -12.5148 -12.5148 -12.5148 -12.5148 -11.7876 -11.7876 -11.7876 -11.7876 -11.1878 -11.1878 -11.1878 -11.1878 -0.3752 -0.3752 -0.3752 -0.3752 0.3243 0.3243 0.3243 0.3243 1.6426 1.6426 1.6426 1.6426 2.7687 2.7687 2.7687 2.7687 3.1209 3.1209 3.1209 3.1209 3.2992 3.2992 3.2992 3.2992 3.7922 3.7922 3.7922 3.7922 3.8541 3.8541 3.8541 3.8541 3.9875 3.9875 3.9875 3.9875 4.4642 4.4642 4.4642 4.4642 4.7749 4.7749 4.7749 4.7749 4.9194 4.9194 4.9194 4.9194 14.3346 14.3346 14.3346 14.3346 14.7663 14.7663 14.7663 14.7663 k = 0.0000 0.3227 0.1512 ( 4332 PWs) bands (ev): -13.1125 -13.1125 -13.1125 -13.1125 -12.5152 -12.5152 -12.5152 -12.5152 -11.7879 -11.7879 -11.7879 -11.7879 -11.1880 -11.1880 -11.1880 -11.1880 -0.3755 -0.3755 -0.3755 -0.3755 0.3238 0.3238 0.3238 0.3238 1.6433 1.6433 1.6433 1.6433 2.7701 2.7701 2.7701 2.7701 3.1232 3.1232 3.1232 3.1232 3.3022 3.3022 3.3022 3.3022 3.7909 3.7909 3.7909 3.7909 3.8651 3.8651 3.8651 3.8651 3.9770 3.9770 3.9770 3.9770 4.4654 4.4654 4.4654 4.4654 4.7755 4.7755 4.7755 4.7755 4.9192 4.9192 4.9192 4.9192 14.3325 14.3325 14.3325 14.3325 14.7639 14.7639 14.7639 14.7639 k = 0.0000 0.3227 0.1512 ( 4332 PWs) bands (ev): -13.1125 -13.1125 -13.1125 -13.1125 -12.5152 -12.5152 -12.5152 -12.5152 -11.7879 -11.7879 -11.7879 -11.7879 -11.1880 -11.1880 -11.1880 -11.1880 -0.3755 -0.3755 -0.3755 -0.3755 0.3238 0.3238 0.3238 0.3238 1.6433 1.6433 1.6433 1.6433 2.7701 2.7701 2.7701 2.7701 3.1232 3.1232 3.1232 3.1232 3.3022 3.3022 3.3022 3.3022 3.7909 3.7909 3.7909 3.7909 3.8651 3.8651 3.8651 3.8651 3.9770 3.9770 3.9770 3.9770 4.4654 4.4654 4.4654 4.4654 4.7755 4.7755 4.7755 4.7755 4.9192 4.9192 4.9192 4.9192 14.3325 14.3325 14.3325 14.3325 14.7639 14.7639 14.7639 14.7639 k = 0.0000 0.3138 0.1512 ( 4334 PWs) bands (ev): -13.1143 -13.1143 -13.1143 -13.1143 -12.5135 -12.5135 -12.5135 -12.5135 -11.7880 -11.7880 -11.7880 -11.7880 -11.1875 -11.1875 -11.1875 -11.1875 -0.3761 -0.3761 -0.3761 -0.3761 0.3252 0.3252 0.3252 0.3252 1.6394 1.6394 1.6394 1.6394 2.7748 2.7748 2.7748 2.7748 3.1204 3.1204 3.1204 3.1204 3.3050 3.3050 3.3050 3.3050 3.7883 3.7883 3.7883 3.7883 3.8631 3.8631 3.8631 3.8631 3.9768 3.9768 3.9768 3.9768 4.4670 4.4670 4.4670 4.4670 4.7757 4.7757 4.7757 4.7757 4.9201 4.9201 4.9201 4.9201 14.3234 14.3234 14.3234 14.3234 14.7706 14.7706 14.7706 14.7706 k = 0.0000 0.3048 0.1512 ( 4326 PWs) bands (ev): -13.1195 -13.1195 -13.1195 -13.1195 -12.5085 -12.5085 -12.5085 -12.5085 -11.7883 -11.7883 -11.7883 -11.7883 -11.1860 -11.1860 -11.1860 -11.1860 -0.3781 -0.3781 -0.3781 -0.3781 0.3295 0.3295 0.3295 0.3295 1.6278 1.6278 1.6278 1.6278 2.7887 2.7887 2.7887 2.7887 3.1127 3.1127 3.1127 3.1127 3.3129 3.3129 3.3129 3.3129 3.7806 3.7806 3.7806 3.7806 3.8572 3.8572 3.8572 3.8572 3.9764 3.9764 3.9764 3.9764 4.4718 4.4718 4.4718 4.4718 4.7764 4.7764 4.7764 4.7764 4.9225 4.9225 4.9225 4.9225 14.2979 14.2979 14.2979 14.2979 14.7890 14.7890 14.7890 14.7890 k = 0.0000 0.2958 0.1512 ( 4326 PWs) bands (ev): -13.1280 -13.1280 -13.1280 -13.1280 -12.5003 -12.5003 -12.5003 -12.5003 -11.7887 -11.7887 -11.7887 -11.7887 -11.1836 -11.1836 -11.1836 -11.1836 -0.3812 -0.3812 -0.3812 -0.3812 0.3365 0.3365 0.3365 0.3365 1.6094 1.6094 1.6094 1.6094 2.8109 2.8109 2.8109 2.8109 3.1012 3.1012 3.1012 3.1012 3.3248 3.3248 3.3248 3.3248 3.7680 3.7680 3.7680 3.7680 3.8475 3.8475 3.8475 3.8475 3.9756 3.9756 3.9756 3.9756 4.4795 4.4795 4.4795 4.4795 4.7775 4.7775 4.7775 4.7775 4.9266 4.9266 4.9266 4.9266 14.2597 14.2597 14.2597 14.2597 14.8154 14.8154 14.8154 14.8154 k = 0.0000 0.2869 0.1512 ( 4324 PWs) bands (ev): -13.1394 -13.1394 -13.1394 -13.1394 -12.4894 -12.4894 -12.4894 -12.4894 -11.7893 -11.7893 -11.7893 -11.7893 -11.1803 -11.1803 -11.1803 -11.1803 -0.3855 -0.3855 -0.3855 -0.3855 0.3460 0.3460 0.3460 0.3460 1.5853 1.5853 1.5853 1.5853 2.8404 2.8404 2.8404 2.8404 3.0869 3.0869 3.0869 3.0869 3.3396 3.3396 3.3396 3.3396 3.7507 3.7507 3.7507 3.7507 3.8346 3.8346 3.8346 3.8346 3.9745 3.9745 3.9745 3.9745 4.4898 4.4898 4.4898 4.4898 4.7790 4.7790 4.7790 4.7790 4.9320 4.9320 4.9320 4.9320 14.2124 14.2124 14.2124 14.2124 14.8460 14.8460 14.8460 14.8460 k = 0.0000 0.2779 0.1512 ( 4322 PWs) bands (ev): -13.1533 -13.1533 -13.1533 -13.1533 -12.4762 -12.4762 -12.4762 -12.4762 -11.7898 -11.7898 -11.7898 -11.7898 -11.1761 -11.1761 -11.1761 -11.1761 -0.3909 -0.3909 -0.3909 -0.3909 0.3579 0.3579 0.3579 0.3579 1.5566 1.5566 1.5566 1.5566 2.8757 2.8757 2.8757 2.8757 3.0708 3.0708 3.0708 3.0708 3.3562 3.3562 3.3562 3.3562 3.7290 3.7290 3.7290 3.7290 3.8188 3.8188 3.8188 3.8188 3.9731 3.9731 3.9731 3.9731 4.5023 4.5023 4.5023 4.5023 4.7809 4.7809 4.7809 4.7809 4.9387 4.9387 4.9387 4.9387 14.1589 14.1589 14.1589 14.1589 14.8780 14.8780 14.8780 14.8780 k = 0.0000 0.2689 0.1512 ( 4322 PWs) bands (ev): -13.1692 -13.1692 -13.1692 -13.1692 -12.4612 -12.4612 -12.4612 -12.4612 -11.7903 -11.7903 -11.7903 -11.7903 -11.1711 -11.1711 -11.1711 -11.1711 -0.3972 -0.3972 -0.3972 -0.3972 0.3718 0.3718 0.3718 0.3718 1.5249 1.5249 1.5249 1.5249 2.9156 2.9156 2.9156 2.9156 3.0536 3.0536 3.0536 3.0536 3.3740 3.3740 3.3740 3.3740 3.7031 3.7031 3.7031 3.7031 3.8008 3.8008 3.8008 3.8008 3.9715 3.9715 3.9715 3.9715 4.5166 4.5166 4.5166 4.5166 4.7832 4.7832 4.7832 4.7832 4.9465 4.9465 4.9465 4.9465 14.1012 14.1012 14.1012 14.1012 14.9094 14.9094 14.9094 14.9094 k = 0.0000 0.2600 0.1512 ( 4318 PWs) bands (ev): -13.1869 -13.1869 -13.1869 -13.1869 -12.4448 -12.4448 -12.4448 -12.4448 -11.7906 -11.7906 -11.7906 -11.7906 -11.1653 -11.1653 -11.1653 -11.1653 -0.4045 -0.4045 -0.4045 -0.4045 0.3876 0.3876 0.3876 0.3876 1.4912 1.4912 1.4912 1.4912 2.9586 2.9586 2.9586 2.9586 3.0359 3.0359 3.0359 3.0359 3.3926 3.3926 3.3926 3.3926 3.6735 3.6735 3.6735 3.6735 3.7813 3.7813 3.7813 3.7813 3.9696 3.9696 3.9696 3.9696 4.5322 4.5322 4.5322 4.5322 4.7859 4.7859 4.7859 4.7859 4.9551 4.9551 4.9551 4.9551 14.0405 14.0405 14.0405 14.0405 14.9390 14.9390 14.9390 14.9390 k = 0.0000 0.2510 0.1512 ( 4314 PWs) bands (ev): -13.2059 -13.2059 -13.2059 -13.2059 -12.4275 -12.4275 -12.4275 -12.4275 -11.7906 -11.7906 -11.7906 -11.7906 -11.1589 -11.1589 -11.1589 -11.1589 -0.4126 -0.4126 -0.4126 -0.4126 0.4049 0.4049 0.4049 0.4049 1.4568 1.4568 1.4568 1.4568 3.0029 3.0029 3.0029 3.0029 3.0181 3.0181 3.0181 3.0181 3.4116 3.4116 3.4116 3.4116 3.6404 3.6404 3.6404 3.6404 3.7611 3.7611 3.7611 3.7611 3.9675 3.9675 3.9675 3.9675 4.5488 4.5488 4.5488 4.5488 4.7889 4.7889 4.7889 4.7889 4.9644 4.9644 4.9644 4.9644 13.9778 13.9778 13.9778 13.9778 14.9659 14.9659 14.9659 14.9659 k = 0.0000 0.2420 0.1512 ( 4300 PWs) bands (ev): -13.2259 -13.2259 -13.2259 -13.2259 -12.4098 -12.4098 -12.4098 -12.4098 -11.7901 -11.7901 -11.7901 -11.7901 -11.1519 -11.1519 -11.1519 -11.1519 -0.4215 -0.4215 -0.4215 -0.4215 0.4232 0.4232 0.4232 0.4232 1.4228 1.4228 1.4228 1.4228 2.9992 2.9992 2.9992 2.9992 3.0485 3.0485 3.0485 3.0485 3.4307 3.4307 3.4307 3.4307 3.6042 3.6042 3.6042 3.6042 3.7411 3.7411 3.7411 3.7411 3.9653 3.9653 3.9653 3.9653 4.5661 4.5661 4.5661 4.5661 4.7922 4.7922 4.7922 4.7922 4.9742 4.9742 4.9742 4.9742 13.9137 13.9137 13.9137 13.9137 14.9898 14.9898 14.9898 14.9898 k = 0.0000 0.2331 0.1512 ( 4302 PWs) bands (ev): -13.2465 -13.2465 -13.2465 -13.2465 -12.3920 -12.3920 -12.3920 -12.3920 -11.7891 -11.7891 -11.7891 -11.7891 -11.1443 -11.1443 -11.1443 -11.1443 -0.4311 -0.4311 -0.4311 -0.4311 0.4423 0.4423 0.4423 0.4423 1.3901 1.3901 1.3901 1.3901 2.9811 2.9811 2.9811 2.9811 3.0920 3.0920 3.0920 3.0920 3.4498 3.4498 3.4498 3.4498 3.5652 3.5652 3.5652 3.5652 3.7225 3.7225 3.7225 3.7225 3.9629 3.9629 3.9629 3.9629 4.5835 4.5835 4.5835 4.5835 4.7958 4.7958 4.7958 4.7958 4.9845 4.9845 4.9845 4.9845 13.8488 13.8488 13.8488 13.8488 15.0106 15.0106 15.0106 15.0106 k = 0.0000 0.2241 0.1512 ( 4306 PWs) bands (ev): -13.2676 -13.2676 -13.2676 -13.2676 -12.3744 -12.3744 -12.3744 -12.3744 -11.7874 -11.7874 -11.7874 -11.7874 -11.1363 -11.1363 -11.1363 -11.1363 -0.4413 -0.4413 -0.4413 -0.4413 0.4616 0.4616 0.4616 0.4616 1.3597 1.3597 1.3597 1.3597 2.9631 2.9631 2.9631 2.9631 3.1324 3.1324 3.1324 3.1324 3.4686 3.4686 3.4686 3.4686 3.5240 3.5240 3.5240 3.5240 3.7066 3.7066 3.7066 3.7066 3.9603 3.9603 3.9603 3.9603 4.6009 4.6009 4.6009 4.6009 4.7996 4.7996 4.7996 4.7996 4.9950 4.9950 4.9950 4.9950 13.7836 13.7836 13.7836 13.7836 15.0284 15.0284 15.0284 15.0284 k = 0.0000 0.2152 0.1512 ( 4310 PWs) bands (ev): -13.2889 -13.2889 -13.2889 -13.2889 -12.3574 -12.3574 -12.3574 -12.3574 -11.7850 -11.7850 -11.7850 -11.7850 -11.1279 -11.1279 -11.1279 -11.1279 -0.4522 -0.4522 -0.4522 -0.4522 0.4808 0.4808 0.4808 0.4808 1.3324 1.3324 1.3324 1.3324 2.9453 2.9453 2.9453 2.9453 3.1677 3.1677 3.1677 3.1677 3.4782 3.4782 3.4782 3.4782 3.4898 3.4898 3.4898 3.4898 3.6951 3.6951 3.6951 3.6951 3.9577 3.9577 3.9577 3.9577 4.6181 4.6181 4.6181 4.6181 4.8036 4.8036 4.8036 4.8036 5.0059 5.0059 5.0059 5.0059 13.7183 13.7183 13.7183 13.7183 15.0434 15.0434 15.0434 15.0434 k = 0.0000 0.2062 0.1512 ( 4304 PWs) bands (ev): -13.3101 -13.3101 -13.3101 -13.3101 -12.3413 -12.3413 -12.3413 -12.3413 -11.7816 -11.7816 -11.7816 -11.7816 -11.1192 -11.1192 -11.1192 -11.1192 -0.4637 -0.4637 -0.4637 -0.4637 0.4993 0.4993 0.4993 0.4993 1.3089 1.3089 1.3089 1.3089 2.9279 2.9279 2.9279 2.9279 3.1955 3.1955 3.1955 3.1955 3.4352 3.4352 3.4352 3.4352 3.5064 3.5064 3.5064 3.5064 3.6897 3.6897 3.6897 3.6897 3.9551 3.9551 3.9551 3.9551 4.6346 4.6346 4.6346 4.6346 4.8078 4.8078 4.8078 4.8078 5.0169 5.0169 5.0169 5.0169 13.6532 13.6532 13.6532 13.6532 15.0558 15.0558 15.0558 15.0558 k = 0.0000 0.1972 0.1512 ( 4304 PWs) bands (ev): -13.3313 -13.3313 -13.3313 -13.3313 -12.3261 -12.3261 -12.3261 -12.3261 -11.7772 -11.7772 -11.7772 -11.7772 -11.1103 -11.1103 -11.1103 -11.1103 -0.4758 -0.4758 -0.4758 -0.4758 0.5168 0.5168 0.5168 0.5168 1.2899 1.2899 1.2899 1.2899 2.9110 2.9110 2.9110 2.9110 3.2135 3.2135 3.2135 3.2135 3.3897 3.3897 3.3897 3.3897 3.5242 3.5242 3.5242 3.5242 3.6921 3.6921 3.6921 3.6921 3.9524 3.9524 3.9524 3.9524 4.6505 4.6505 4.6505 4.6505 4.8122 4.8122 4.8122 4.8122 5.0282 5.0282 5.0282 5.0282 13.5888 13.5888 13.5888 13.5888 15.0661 15.0661 15.0661 15.0661 k = 0.0000 0.1883 0.1512 ( 4300 PWs) bands (ev): -13.3521 -13.3521 -13.3521 -13.3521 -12.3122 -12.3122 -12.3122 -12.3122 -11.7718 -11.7718 -11.7718 -11.7718 -11.1013 -11.1013 -11.1013 -11.1013 -0.4885 -0.4885 -0.4885 -0.4885 0.5329 0.5329 0.5329 0.5329 1.2760 1.2760 1.2760 1.2760 2.8944 2.8944 2.8944 2.8944 3.2200 3.2200 3.2200 3.2200 3.3444 3.3444 3.3444 3.3444 3.5415 3.5415 3.5415 3.5415 3.7033 3.7033 3.7033 3.7033 3.9498 3.9498 3.9498 3.9498 4.6655 4.6655 4.6655 4.6655 4.8166 4.8166 4.8166 4.8166 5.0397 5.0397 5.0397 5.0397 13.5252 13.5252 13.5252 13.5252 15.0745 15.0745 15.0745 15.0745 k = 0.0000 0.1793 0.1512 ( 4296 PWs) bands (ev): -13.3725 -13.3725 -13.3725 -13.3725 -12.2996 -12.2996 -12.2996 -12.2996 -11.7654 -11.7654 -11.7654 -11.7654 -11.0921 -11.0921 -11.0921 -11.0921 -0.5018 -0.5018 -0.5018 -0.5018 0.5473 0.5473 0.5473 0.5473 1.2674 1.2674 1.2674 1.2674 2.8784 2.8784 2.8784 2.8784 3.2134 3.2134 3.2134 3.2134 3.3011 3.3011 3.3011 3.3011 3.5583 3.5583 3.5583 3.5583 3.7230 3.7230 3.7230 3.7230 3.9473 3.9473 3.9473 3.9473 4.6794 4.6794 4.6794 4.6794 4.8211 4.8211 4.8211 4.8211 5.0514 5.0514 5.0514 5.0514 13.4627 13.4627 13.4627 13.4627 15.0812 15.0812 15.0812 15.0812 k = 0.0000 0.1703 0.1512 ( 4300 PWs) bands (ev): -13.3924 -13.3924 -13.3924 -13.3924 -12.2885 -12.2885 -12.2885 -12.2885 -11.7579 -11.7579 -11.7579 -11.7579 -11.0830 -11.0830 -11.0830 -11.0830 -0.5156 -0.5156 -0.5156 -0.5156 0.5598 0.5598 0.5598 0.5598 1.2645 1.2645 1.2645 1.2645 2.8630 2.8630 2.8630 2.8630 3.1925 3.1925 3.1925 3.1925 3.2625 3.2625 3.2625 3.2625 3.5744 3.5744 3.5744 3.5744 3.7498 3.7498 3.7498 3.7498 3.9449 3.9449 3.9449 3.9449 4.6923 4.6923 4.6923 4.6923 4.8257 4.8257 4.8257 4.8257 5.0634 5.0634 5.0634 5.0634 13.4014 13.4014 13.4014 13.4014 15.0865 15.0865 15.0865 15.0865 k = 0.0000 0.1614 0.1512 ( 4302 PWs) bands (ev): -13.4117 -13.4117 -13.4117 -13.4117 -12.2787 -12.2787 -12.2787 -12.2787 -11.7496 -11.7496 -11.7496 -11.7496 -11.0739 -11.0739 -11.0739 -11.0739 -0.5299 -0.5299 -0.5299 -0.5299 0.5703 0.5703 0.5703 0.5703 1.2672 1.2672 1.2672 1.2672 2.8481 2.8481 2.8481 2.8481 3.1583 3.1583 3.1583 3.1583 3.2299 3.2299 3.2299 3.2299 3.5898 3.5898 3.5898 3.5898 3.7817 3.7817 3.7817 3.7817 3.9427 3.9427 3.9427 3.9427 4.7040 4.7040 4.7040 4.7040 4.8302 4.8302 4.8302 4.8302 5.0756 5.0756 5.0756 5.0756 13.3417 13.3417 13.3417 13.3417 15.0906 15.0906 15.0906 15.0906 k = 0.0000 0.1524 0.1512 ( 4290 PWs) bands (ev): -13.4303 -13.4303 -13.4303 -13.4303 -12.2703 -12.2703 -12.2703 -12.2703 -11.7403 -11.7403 -11.7403 -11.7403 -11.0650 -11.0650 -11.0650 -11.0650 -0.5446 -0.5446 -0.5446 -0.5446 0.5791 0.5791 0.5791 0.5791 1.2753 1.2753 1.2753 1.2753 2.8339 2.8339 2.8339 2.8339 3.1159 3.1159 3.1159 3.1159 3.2001 3.2001 3.2001 3.2001 3.6044 3.6044 3.6044 3.6044 3.8168 3.8168 3.8168 3.8168 3.9407 3.9407 3.9407 3.9407 4.7146 4.7146 4.7146 4.7146 4.8347 4.8347 4.8347 4.8347 5.0880 5.0880 5.0880 5.0880 13.2838 13.2838 13.2838 13.2838 15.0934 15.0934 15.0934 15.0934 k = 0.0000 0.1434 0.1512 ( 4290 PWs) bands (ev): -13.4481 -13.4481 -13.4481 -13.4481 -12.2632 -12.2632 -12.2632 -12.2632 -11.7304 -11.7304 -11.7304 -11.7304 -11.0562 -11.0562 -11.0562 -11.0562 -0.5596 -0.5596 -0.5596 -0.5596 0.5863 0.5863 0.5863 0.5863 1.2884 1.2884 1.2884 1.2884 2.8204 2.8204 2.8204 2.8204 3.0701 3.0701 3.0701 3.0701 3.1702 3.1702 3.1702 3.1702 3.6181 3.6181 3.6181 3.6181 3.8536 3.8536 3.8536 3.8536 3.9389 3.9389 3.9389 3.9389 4.7241 4.7241 4.7241 4.7241 4.8392 4.8392 4.8392 4.8392 5.1005 5.1005 5.1005 5.1005 13.2278 13.2278 13.2278 13.2278 15.0952 15.0952 15.0952 15.0952 k = 0.0000 0.1345 0.1512 ( 4290 PWs) bands (ev): -13.4651 -13.4651 -13.4651 -13.4651 -12.2574 -12.2574 -12.2574 -12.2574 -11.7200 -11.7200 -11.7200 -11.7200 -11.0477 -11.0477 -11.0477 -11.0477 -0.5749 -0.5749 -0.5749 -0.5749 0.5922 0.5922 0.5922 0.5922 1.3059 1.3059 1.3059 1.3059 2.8075 2.8075 2.8075 2.8075 3.0232 3.0232 3.0232 3.0232 3.1393 3.1393 3.1393 3.1393 3.6310 3.6310 3.6310 3.6310 3.8907 3.8907 3.8907 3.8907 3.9373 3.9373 3.9373 3.9373 4.7325 4.7325 4.7325 4.7325 4.8435 4.8435 4.8435 4.8435 5.1132 5.1132 5.1132 5.1132 13.1740 13.1740 13.1740 13.1740 15.0960 15.0960 15.0960 15.0960 k = 0.0000 0.1255 0.1512 ( 4294 PWs) bands (ev): -13.4812 -13.4812 -13.4812 -13.4812 -12.2527 -12.2527 -12.2527 -12.2527 -11.7092 -11.7092 -11.7092 -11.7092 -11.0394 -11.0394 -11.0394 -11.0394 -0.5903 -0.5903 -0.5903 -0.5903 0.5973 0.5973 0.5973 0.5973 1.3272 1.3272 1.3272 1.3272 2.7953 2.7953 2.7953 2.7953 2.9766 2.9766 2.9766 2.9766 3.1073 3.1073 3.1073 3.1073 3.6430 3.6430 3.6430 3.6430 3.9270 3.9270 3.9270 3.9270 3.9363 3.9363 3.9363 3.9363 4.7399 4.7399 4.7399 4.7399 4.8477 4.8477 4.8477 4.8477 5.1259 5.1259 5.1259 5.1259 13.1226 13.1226 13.1226 13.1226 15.0959 15.0959 15.0959 15.0959 k = 0.0000 0.1165 0.1512 ( 4290 PWs) bands (ev): -13.4964 -13.4964 -13.4964 -13.4964 -12.2490 -12.2490 -12.2490 -12.2490 -11.6982 -11.6982 -11.6982 -11.6982 -11.0315 -11.0315 -11.0315 -11.0315 -0.6056 -0.6056 -0.6056 -0.6056 0.6018 0.6018 0.6018 0.6018 1.3515 1.3515 1.3515 1.3515 2.7839 2.7839 2.7839 2.7839 2.9307 2.9307 2.9307 2.9307 3.0746 3.0746 3.0746 3.0746 3.6540 3.6540 3.6540 3.6540 3.9348 3.9348 3.9348 3.9348 3.9629 3.9629 3.9629 3.9629 4.7464 4.7464 4.7464 4.7464 4.8518 4.8518 4.8518 4.8518 5.1385 5.1385 5.1385 5.1385 13.0737 13.0737 13.0737 13.0737 15.0950 15.0950 15.0950 15.0950 k = 0.0000 0.1076 0.1512 ( 4288 PWs) bands (ev): -13.5106 -13.5106 -13.5106 -13.5106 -12.2461 -12.2461 -12.2461 -12.2461 -11.6872 -11.6872 -11.6872 -11.6872 -11.0239 -11.0239 -11.0239 -11.0239 -0.6208 -0.6208 -0.6208 -0.6208 0.6060 0.6060 0.6060 0.6060 1.3782 1.3782 1.3782 1.3782 2.7731 2.7731 2.7731 2.7731 2.8863 2.8863 2.8863 2.8863 3.0415 3.0415 3.0415 3.0415 3.6641 3.6641 3.6641 3.6641 3.9341 3.9341 3.9341 3.9341 3.9964 3.9964 3.9964 3.9964 4.7522 4.7522 4.7522 4.7522 4.8557 4.8557 4.8557 4.8557 5.1509 5.1509 5.1509 5.1509 13.0276 13.0276 13.0276 13.0276 15.0934 15.0934 15.0934 15.0934 k = 0.0000 0.0986 0.1512 ( 4292 PWs) bands (ev): -13.5239 -13.5239 -13.5239 -13.5239 -12.2440 -12.2440 -12.2440 -12.2440 -11.6764 -11.6764 -11.6764 -11.6764 -11.0168 -11.0168 -11.0168 -11.0168 -0.6355 -0.6355 -0.6355 -0.6355 0.6101 0.6101 0.6101 0.6101 1.4066 1.4066 1.4066 1.4066 2.7631 2.7631 2.7631 2.7631 2.8437 2.8437 2.8437 2.8437 3.0085 3.0085 3.0085 3.0085 3.6732 3.6732 3.6732 3.6732 3.9335 3.9335 3.9335 3.9335 4.0279 4.0279 4.0279 4.0279 4.7572 4.7572 4.7572 4.7572 4.8594 4.8594 4.8594 4.8594 5.1630 5.1630 5.1630 5.1630 12.9844 12.9844 12.9844 12.9844 15.0913 15.0913 15.0913 15.0913 k = 0.0000 0.0896 0.1512 ( 4294 PWs) bands (ev): -13.5360 -13.5360 -13.5360 -13.5360 -12.2425 -12.2425 -12.2425 -12.2425 -11.6660 -11.6660 -11.6660 -11.6660 -11.0101 -11.0101 -11.0101 -11.0101 -0.6498 -0.6498 -0.6498 -0.6498 0.6142 0.6142 0.6142 0.6142 1.4359 1.4359 1.4359 1.4359 2.7535 2.7535 2.7535 2.7535 2.8035 2.8035 2.8035 2.8035 2.9761 2.9761 2.9761 2.9761 3.6814 3.6814 3.6814 3.6814 3.9333 3.9333 3.9333 3.9333 4.0570 4.0570 4.0570 4.0570 4.7617 4.7617 4.7617 4.7617 4.8628 4.8628 4.8628 4.8628 5.1746 5.1746 5.1746 5.1746 12.9444 12.9444 12.9444 12.9444 15.0887 15.0887 15.0887 15.0887 k = 0.0000 0.0807 0.1512 ( 4302 PWs) bands (ev): -13.5471 -13.5471 -13.5471 -13.5471 -12.2414 -12.2414 -12.2414 -12.2414 -11.6561 -11.6561 -11.6561 -11.6561 -11.0040 -11.0040 -11.0040 -11.0040 -0.6633 -0.6633 -0.6633 -0.6633 0.6184 0.6184 0.6184 0.6184 1.4655 1.4655 1.4655 1.4655 2.7435 2.7435 2.7435 2.7435 2.7670 2.7670 2.7670 2.7670 2.9445 2.9445 2.9445 2.9445 3.6886 3.6886 3.6886 3.6886 3.9332 3.9332 3.9332 3.9332 4.0835 4.0835 4.0835 4.0835 4.7657 4.7657 4.7657 4.7657 4.8660 4.8660 4.8660 4.8660 5.1857 5.1857 5.1857 5.1857 12.9076 12.9076 12.9076 12.9076 15.0858 15.0858 15.0858 15.0858 k = 0.0000 0.0717 0.1512 ( 4296 PWs) bands (ev): -13.5571 -13.5571 -13.5571 -13.5571 -12.2407 -12.2407 -12.2407 -12.2407 -11.6469 -11.6469 -11.6469 -11.6469 -10.9984 -10.9984 -10.9984 -10.9984 -0.6759 -0.6759 -0.6759 -0.6759 0.6225 0.6225 0.6225 0.6225 1.4947 1.4947 1.4947 1.4947 2.7242 2.7242 2.7242 2.7242 2.7434 2.7434 2.7434 2.7434 2.9143 2.9143 2.9143 2.9143 3.6949 3.6949 3.6949 3.6949 3.9334 3.9334 3.9334 3.9334 4.1073 4.1073 4.1073 4.1073 4.7692 4.7692 4.7692 4.7692 4.8689 4.8689 4.8689 4.8689 5.1960 5.1960 5.1960 5.1960 12.8742 12.8742 12.8742 12.8742 15.0828 15.0828 15.0828 15.0828 k = 0.0000 0.0628 0.1512 ( 4304 PWs) bands (ev): -13.5660 -13.5660 -13.5660 -13.5660 -12.2404 -12.2404 -12.2404 -12.2404 -11.6384 -11.6384 -11.6384 -11.6384 -10.9934 -10.9934 -10.9934 -10.9934 -0.6875 -0.6875 -0.6875 -0.6875 0.6267 0.6267 0.6267 0.6267 1.5228 1.5228 1.5228 1.5228 2.6944 2.6944 2.6944 2.6944 2.7343 2.7343 2.7343 2.7343 2.8859 2.8859 2.8859 2.8859 3.7004 3.7004 3.7004 3.7004 3.9337 3.9337 3.9337 3.9337 4.1283 4.1283 4.1283 4.1283 4.7723 4.7723 4.7723 4.7723 4.8715 4.8715 4.8715 4.8715 5.2055 5.2055 5.2055 5.2055 12.8444 12.8444 12.8444 12.8444 15.0797 15.0797 15.0797 15.0797 k = 0.0000 0.0538 0.1512 ( 4294 PWs) bands (ev): -13.5737 -13.5737 -13.5737 -13.5737 -12.2402 -12.2402 -12.2402 -12.2402 -11.6309 -11.6309 -11.6309 -11.6309 -10.9889 -10.9889 -10.9889 -10.9889 -0.6978 -0.6978 -0.6978 -0.6978 0.6306 0.6306 0.6306 0.6306 1.5491 1.5491 1.5491 1.5491 2.6660 2.6660 2.6660 2.6660 2.7280 2.7280 2.7280 2.7280 2.8598 2.8598 2.8598 2.8598 3.7050 3.7050 3.7050 3.7050 3.9340 3.9340 3.9340 3.9340 4.1464 4.1464 4.1464 4.1464 4.7751 4.7751 4.7751 4.7751 4.8738 4.8738 4.8738 4.8738 5.2140 5.2140 5.2140 5.2140 12.8183 12.8183 12.8183 12.8183 15.0768 15.0768 15.0768 15.0768 k = 0.0000 0.0448 0.1512 ( 4290 PWs) bands (ev): -13.5802 -13.5802 -13.5802 -13.5802 -12.2402 -12.2402 -12.2402 -12.2402 -11.6244 -11.6244 -11.6244 -11.6244 -10.9852 -10.9852 -10.9852 -10.9852 -0.7069 -0.7069 -0.7069 -0.7069 0.6343 0.6343 0.6343 0.6343 1.5730 1.5730 1.5730 1.5730 2.6411 2.6411 2.6411 2.6411 2.7229 2.7229 2.7229 2.7229 2.8366 2.8366 2.8366 2.8366 3.7088 3.7088 3.7088 3.7088 3.9345 3.9345 3.9345 3.9345 4.1616 4.1616 4.1616 4.1616 4.7775 4.7775 4.7775 4.7775 4.8757 4.8757 4.8757 4.8757 5.2214 5.2214 5.2214 5.2214 12.7960 12.7960 12.7960 12.7960 15.0741 15.0741 15.0741 15.0741 k = 0.0000 0.0359 0.1512 ( 4288 PWs) bands (ev): -13.5856 -13.5856 -13.5856 -13.5856 -12.2402 -12.2402 -12.2402 -12.2402 -11.6189 -11.6189 -11.6189 -11.6189 -10.9820 -10.9820 -10.9820 -10.9820 -0.7144 -0.7144 -0.7144 -0.7144 0.6376 0.6376 0.6376 0.6376 1.5937 1.5937 1.5937 1.5937 2.6201 2.6201 2.6201 2.6201 2.7188 2.7188 2.7188 2.7188 2.8167 2.8167 2.8167 2.8167 3.7118 3.7118 3.7118 3.7118 3.9349 3.9349 3.9349 3.9349 4.1740 4.1740 4.1740 4.1740 4.7794 4.7794 4.7794 4.7794 4.8774 4.8774 4.8774 4.8774 5.2276 5.2276 5.2276 5.2276 12.7776 12.7776 12.7776 12.7776 15.0717 15.0717 15.0717 15.0717 k = 0.0000 0.0269 0.1512 ( 4282 PWs) bands (ev): -13.5898 -13.5898 -13.5898 -13.5898 -12.2403 -12.2403 -12.2403 -12.2403 -11.6146 -11.6146 -11.6146 -11.6146 -10.9796 -10.9796 -10.9796 -10.9796 -0.7204 -0.7204 -0.7204 -0.7204 0.6403 0.6403 0.6403 0.6403 1.6107 1.6107 1.6107 1.6107 2.6034 2.6034 2.6034 2.6034 2.7156 2.7156 2.7156 2.7156 2.8006 2.8006 2.8006 2.8006 3.7142 3.7142 3.7142 3.7142 3.9353 3.9353 3.9353 3.9353 4.1836 4.1836 4.1836 4.1836 4.7810 4.7810 4.7810 4.7810 4.8787 4.8787 4.8787 4.8787 5.2325 5.2325 5.2325 5.2325 12.7632 12.7632 12.7632 12.7632 15.0697 15.0697 15.0697 15.0697 k = 0.0000 0.0179 0.1512 ( 4270 PWs) bands (ev): -13.5928 -13.5928 -13.5928 -13.5928 -12.2404 -12.2404 -12.2404 -12.2404 -11.6115 -11.6115 -11.6115 -11.6115 -10.9778 -10.9778 -10.9778 -10.9778 -0.7247 -0.7247 -0.7247 -0.7247 0.6423 0.6423 0.6423 0.6423 1.6233 1.6233 1.6233 1.6233 2.5912 2.5912 2.5912 2.5912 2.7133 2.7133 2.7133 2.7133 2.7888 2.7888 2.7888 2.7888 3.7158 3.7158 3.7158 3.7158 3.9356 3.9356 3.9356 3.9356 4.1904 4.1904 4.1904 4.1904 4.7821 4.7821 4.7821 4.7821 4.8796 4.8796 4.8796 4.8796 5.2361 5.2361 5.2361 5.2361 12.7529 12.7529 12.7529 12.7529 15.0683 15.0683 15.0683 15.0683 k = 0.0000 0.0090 0.1512 ( 4270 PWs) bands (ev): -13.5946 -13.5946 -13.5946 -13.5946 -12.2405 -12.2405 -12.2405 -12.2405 -11.6096 -11.6096 -11.6096 -11.6096 -10.9767 -10.9767 -10.9767 -10.9767 -0.7273 -0.7273 -0.7273 -0.7273 0.6435 0.6435 0.6435 0.6435 1.6310 1.6310 1.6310 1.6310 2.5838 2.5838 2.5838 2.5838 2.7119 2.7119 2.7119 2.7119 2.7815 2.7815 2.7815 2.7815 3.7168 3.7168 3.7168 3.7168 3.9357 3.9357 3.9357 3.9357 4.1945 4.1945 4.1945 4.1945 4.7828 4.7828 4.7828 4.7828 4.8801 4.8801 4.8801 4.8801 5.2383 5.2383 5.2383 5.2383 12.7466 12.7466 12.7466 12.7466 15.0674 15.0674 15.0674 15.0674 k = 0.0000 0.0000 0.1512 ( 4274 PWs) bands (ev): -13.5952 -13.5952 -13.5952 -13.5952 -12.2405 -12.2405 -12.2405 -12.2405 -11.6090 -11.6090 -11.6090 -11.6090 -10.9764 -10.9764 -10.9764 -10.9764 -0.7282 -0.7282 -0.7282 -0.7282 0.6440 0.6440 0.6440 0.6440 1.6336 1.6336 1.6336 1.6336 2.5813 2.5813 2.5813 2.5813 2.7115 2.7115 2.7115 2.7115 2.7791 2.7791 2.7791 2.7791 3.7171 3.7171 3.7171 3.7171 3.9358 3.9358 3.9358 3.9358 4.1959 4.1959 4.1959 4.1959 4.7831 4.7831 4.7831 4.7831 4.8803 4.8803 4.8803 4.8803 5.2390 5.2390 5.2390 5.2390 12.7446 12.7446 12.7446 12.7446 15.0671 15.0671 15.0671 15.0671 k = 0.0000 0.3227-0.0000 ( 4318 PWs) bands (ev): -13.1267 -13.1267 -13.1267 -13.1267 -12.4582 -12.4582 -12.4582 -12.4582 -11.8675 -11.8675 -11.8675 -11.8675 -11.1500 -11.1500 -11.1500 -11.1500 -0.5487 -0.5487 -0.5487 -0.5487 0.7171 0.7171 0.7171 0.7171 1.4484 1.4484 1.4484 1.4484 2.7051 2.7051 2.7051 2.7051 3.0928 3.0928 3.0928 3.0928 3.3542 3.3542 3.3542 3.3542 3.6340 3.6340 3.6340 3.6340 3.9030 3.9030 3.9030 3.9030 3.9457 3.9457 3.9457 3.9457 4.7358 4.7358 4.7358 4.7358 4.7852 4.7852 4.7852 4.7852 4.8210 4.8210 4.8210 4.8210 13.9757 13.9757 13.9757 13.9757 15.1491 15.1491 15.1491 15.1491 k = 0.0000 0.3227 0.0089 ( 4310 PWs) bands (ev): -13.1265 -13.1265 -13.1265 -13.1265 -12.4588 -12.4588 -12.4588 -12.4588 -11.8668 -11.8668 -11.8668 -11.8668 -11.1503 -11.1503 -11.1503 -11.1503 -0.5475 -0.5475 -0.5475 -0.5475 0.7133 0.7133 0.7133 0.7133 1.4509 1.4509 1.4509 1.4509 2.7057 2.7057 2.7057 2.7057 3.0930 3.0930 3.0930 3.0930 3.3538 3.3538 3.3538 3.3538 3.6348 3.6348 3.6348 3.6348 3.9029 3.9029 3.9029 3.9029 3.9459 3.9459 3.9459 3.9459 4.7315 4.7315 4.7315 4.7315 4.7852 4.7852 4.7852 4.7852 4.8239 4.8239 4.8239 4.8239 13.9778 13.9778 13.9778 13.9778 15.1471 15.1471 15.1471 15.1471 k = 0.0000 0.3227 0.0178 ( 4298 PWs) bands (ev): -13.1262 -13.1262 -13.1262 -13.1262 -12.4603 -12.4603 -12.4603 -12.4603 -11.8647 -11.8647 -11.8647 -11.8647 -11.1512 -11.1512 -11.1512 -11.1512 -0.5441 -0.5441 -0.5441 -0.5441 0.7023 0.7023 0.7023 0.7023 1.4580 1.4580 1.4580 1.4580 2.7073 2.7073 2.7073 2.7073 3.0936 3.0936 3.0936 3.0936 3.3526 3.3526 3.3526 3.3526 3.6373 3.6373 3.6373 3.6373 3.9028 3.9028 3.9028 3.9028 3.9468 3.9468 3.9468 3.9468 4.7202 4.7202 4.7202 4.7202 4.7852 4.7852 4.7852 4.7852 4.8313 4.8313 4.8313 4.8313 13.9838 13.9838 13.9838 13.9838 15.1410 15.1410 15.1410 15.1410 k = 0.0000 0.3227 0.0267 ( 4302 PWs) bands (ev): -13.1256 -13.1256 -13.1256 -13.1256 -12.4628 -12.4628 -12.4628 -12.4628 -11.8614 -11.8614 -11.8614 -11.8614 -11.1526 -11.1526 -11.1526 -11.1526 -0.5385 -0.5385 -0.5385 -0.5385 0.6847 0.6847 0.6847 0.6847 1.4691 1.4691 1.4691 1.4691 2.7100 2.7100 2.7100 2.7100 3.0947 3.0947 3.0947 3.0947 3.3506 3.3506 3.3506 3.3506 3.6415 3.6415 3.6415 3.6415 3.9024 3.9024 3.9024 3.9024 3.9481 3.9481 3.9481 3.9481 4.7044 4.7044 4.7044 4.7044 4.7849 4.7849 4.7849 4.7849 4.8409 4.8409 4.8409 4.8409 13.9939 13.9939 13.9939 13.9939 15.1308 15.1308 15.1308 15.1308 k = 0.0000 0.3227 0.0356 ( 4302 PWs) bands (ev): -13.1249 -13.1249 -13.1249 -13.1249 -12.4662 -12.4662 -12.4662 -12.4662 -11.8569 -11.8569 -11.8569 -11.8569 -11.1546 -11.1546 -11.1546 -11.1546 -0.5308 -0.5308 -0.5308 -0.5308 0.6614 0.6614 0.6614 0.6614 1.4834 1.4834 1.4834 1.4834 2.7136 2.7136 2.7136 2.7136 3.0961 3.0961 3.0961 3.0961 3.3479 3.3479 3.3479 3.3479 3.6474 3.6474 3.6474 3.6474 3.9019 3.9019 3.9019 3.9019 3.9499 3.9499 3.9499 3.9499 4.6857 4.6857 4.6857 4.6857 4.7844 4.7844 4.7844 4.7844 4.8511 4.8511 4.8511 4.8511 14.0078 14.0078 14.0078 14.0078 15.1164 15.1164 15.1164 15.1164 k = 0.0000 0.3227 0.0445 ( 4308 PWs) bands (ev): -13.1240 -13.1240 -13.1240 -13.1240 -12.4702 -12.4702 -12.4702 -12.4702 -11.8514 -11.8514 -11.8514 -11.8514 -11.1571 -11.1571 -11.1571 -11.1571 -0.5212 -0.5212 -0.5212 -0.5212 0.6336 0.6336 0.6336 0.6336 1.4999 1.4999 1.4999 1.4999 2.7180 2.7180 2.7180 2.7180 3.0979 3.0979 3.0979 3.0979 3.3446 3.3446 3.3446 3.3446 3.6548 3.6548 3.6548 3.6548 3.9012 3.9012 3.9012 3.9012 3.9520 3.9520 3.9520 3.9520 4.6652 4.6652 4.6652 4.6652 4.7838 4.7838 4.7838 4.7838 4.8611 4.8611 4.8611 4.8611 14.0254 14.0254 14.0254 14.0254 15.0979 15.0979 15.0979 15.0979 k = 0.0000 0.3227 0.0534 ( 4300 PWs) bands (ev): -13.1229 -13.1229 -13.1229 -13.1229 -12.4749 -12.4749 -12.4749 -12.4749 -11.8451 -11.8451 -11.8451 -11.8451 -11.1599 -11.1599 -11.1599 -11.1599 -0.5096 -0.5096 -0.5096 -0.5096 0.6024 0.6024 0.6024 0.6024 1.5177 1.5177 1.5177 1.5177 2.7231 2.7231 2.7231 2.7231 3.1000 3.1000 3.1000 3.1000 3.3407 3.3407 3.3407 3.3407 3.6638 3.6638 3.6638 3.6638 3.9002 3.9002 3.9002 3.9002 3.9545 3.9545 3.9545 3.9545 4.6434 4.6434 4.6434 4.6434 4.7830 4.7830 4.7830 4.7830 4.8706 4.8706 4.8706 4.8706 14.0466 14.0466 14.0466 14.0466 15.0754 15.0754 15.0754 15.0754 k = 0.0000 0.3227 0.0623 ( 4306 PWs) bands (ev): -13.1217 -13.1217 -13.1217 -13.1217 -12.4799 -12.4799 -12.4799 -12.4799 -11.8382 -11.8382 -11.8382 -11.8382 -11.1631 -11.1631 -11.1631 -11.1631 -0.4965 -0.4965 -0.4965 -0.4965 0.5690 0.5690 0.5690 0.5690 1.5360 1.5360 1.5360 1.5360 2.7287 2.7287 2.7287 2.7287 3.1024 3.1024 3.1024 3.1024 3.3364 3.3364 3.3364 3.3364 3.6743 3.6743 3.6743 3.6743 3.8989 3.8989 3.8989 3.8989 3.9573 3.9573 3.9573 3.9573 4.6210 4.6210 4.6210 4.6210 4.7822 4.7822 4.7822 4.7822 4.8792 4.8792 4.8792 4.8792 14.0709 14.0709 14.0709 14.0709 15.0491 15.0491 15.0491 15.0491 k = 0.0000 0.3227 0.0712 ( 4324 PWs) bands (ev): -13.1204 -13.1204 -13.1204 -13.1204 -12.4851 -12.4851 -12.4851 -12.4851 -11.8310 -11.8310 -11.8310 -11.8310 -11.1664 -11.1664 -11.1664 -11.1664 -0.4821 -0.4821 -0.4821 -0.4821 0.5342 0.5342 0.5342 0.5342 1.5540 1.5540 1.5540 1.5540 2.7346 2.7346 2.7346 2.7346 3.1051 3.1051 3.1051 3.1051 3.3318 3.3318 3.3318 3.3318 3.6861 3.6861 3.6861 3.6861 3.8971 3.8971 3.8971 3.8971 3.9601 3.9601 3.9601 3.9601 4.5983 4.5983 4.5983 4.5983 4.7812 4.7812 4.7812 4.7812 4.8870 4.8870 4.8870 4.8870 14.0981 14.0981 14.0981 14.0981 15.0194 15.0194 15.0194 15.0194 k = 0.0000 0.3227 0.0801 ( 4332 PWs) bands (ev): -13.1191 -13.1191 -13.1191 -13.1191 -12.4903 -12.4903 -12.4903 -12.4903 -11.8237 -11.8237 -11.8237 -11.8237 -11.1699 -11.1699 -11.1699 -11.1699 -0.4667 -0.4667 -0.4667 -0.4667 0.4993 0.4993 0.4993 0.4993 1.5712 1.5712 1.5712 1.5712 2.7406 2.7406 2.7406 2.7406 3.1078 3.1078 3.1078 3.1078 3.3271 3.3271 3.3271 3.3271 3.6990 3.6990 3.6990 3.6990 3.8949 3.8949 3.8949 3.8949 3.9630 3.9630 3.9630 3.9630 4.5757 4.5757 4.5757 4.5757 4.7803 4.7803 4.7803 4.7803 4.8940 4.8940 4.8940 4.8940 14.1278 14.1278 14.1278 14.1278 14.9868 14.9868 14.9868 14.9868 k = 0.0000 0.3227 0.0890 ( 4332 PWs) bands (ev): -13.1178 -13.1178 -13.1178 -13.1178 -12.4954 -12.4954 -12.4954 -12.4954 -11.8165 -11.8165 -11.8165 -11.8165 -11.1734 -11.1734 -11.1734 -11.1734 -0.4507 -0.4507 -0.4507 -0.4507 0.4650 0.4650 0.4650 0.4650 1.5872 1.5872 1.5872 1.5872 2.7465 2.7465 2.7465 2.7465 3.1106 3.1106 3.1106 3.1106 3.3223 3.3223 3.3223 3.3223 3.7128 3.7128 3.7128 3.7128 3.8922 3.8922 3.8922 3.8922 3.9658 3.9658 3.9658 3.9658 4.5538 4.5538 4.5538 4.5538 4.7793 4.7793 4.7793 4.7793 4.9000 4.9000 4.9000 4.9000 14.1594 14.1594 14.1594 14.1594 14.9520 14.9520 14.9520 14.9520 k = 0.0000 0.3227 0.0979 ( 4324 PWs) bands (ev): -13.1166 -13.1166 -13.1166 -13.1166 -12.5002 -12.5002 -12.5002 -12.5002 -11.8097 -11.8097 -11.8097 -11.8097 -11.1768 -11.1768 -11.1768 -11.1768 -0.4347 -0.4347 -0.4347 -0.4347 0.4324 0.4324 0.4324 0.4324 1.6015 1.6015 1.6015 1.6015 2.7521 2.7521 2.7521 2.7521 3.1134 3.1134 3.1134 3.1134 3.3177 3.3177 3.3177 3.3177 3.7273 3.7273 3.7273 3.7273 3.8889 3.8889 3.8889 3.8889 3.9685 3.9685 3.9685 3.9685 4.5332 4.5332 4.5332 4.5332 4.7784 4.7784 4.7784 4.7784 4.9052 4.9052 4.9052 4.9052 14.1922 14.1922 14.1922 14.1922 14.9160 14.9160 14.9160 14.9160 k = 0.0000 0.3227 0.1067 ( 4326 PWs) bands (ev): -13.1154 -13.1154 -13.1154 -13.1154 -12.5045 -12.5045 -12.5045 -12.5045 -11.8036 -11.8036 -11.8036 -11.8036 -11.1799 -11.1799 -11.1799 -11.1799 -0.4192 -0.4192 -0.4192 -0.4192 0.4024 0.4024 0.4024 0.4024 1.6140 1.6140 1.6140 1.6140 2.7572 2.7572 2.7572 2.7572 3.1160 3.1160 3.1160 3.1160 3.3135 3.3135 3.3135 3.3135 3.7418 3.7418 3.7418 3.7418 3.8849 3.8849 3.8849 3.8849 3.9709 3.9709 3.9709 3.9709 4.5143 4.5143 4.5143 4.5143 4.7776 4.7776 4.7776 4.7776 4.9096 4.9096 4.9096 4.9096 14.2252 14.2252 14.2252 14.2252 14.8798 14.8798 14.8798 14.8798 k = 0.0000 0.3227 0.1156 ( 4318 PWs) bands (ev): -13.1144 -13.1144 -13.1144 -13.1144 -12.5082 -12.5082 -12.5082 -12.5082 -11.7982 -11.7982 -11.7982 -11.7982 -11.1826 -11.1826 -11.1826 -11.1826 -0.4050 -0.4050 -0.4050 -0.4050 0.3759 0.3759 0.3759 0.3759 1.6244 1.6244 1.6244 1.6244 2.7617 2.7617 2.7617 2.7617 3.1184 3.1184 3.1184 3.1184 3.3097 3.3097 3.3097 3.3097 3.7561 3.7561 3.7561 3.7561 3.8803 3.8803 3.8803 3.8803 3.9730 3.9730 3.9730 3.9730 4.4977 4.4977 4.4977 4.4977 4.7769 4.7769 4.7769 4.7769 4.9131 4.9131 4.9131 4.9131 14.2572 14.2572 14.2572 14.2572 14.8449 14.8449 14.8449 14.8449 k = 0.0000 0.3227 0.1245 ( 4322 PWs) bands (ev): -13.1136 -13.1136 -13.1136 -13.1136 -12.5112 -12.5112 -12.5112 -12.5112 -11.7938 -11.7938 -11.7938 -11.7938 -11.1849 -11.1849 -11.1849 -11.1849 -0.3929 -0.3929 -0.3929 -0.3929 0.3540 0.3540 0.3540 0.3540 1.6326 1.6326 1.6326 1.6326 2.7653 2.7653 2.7653 2.7653 3.1204 3.1204 3.1204 3.1204 3.3065 3.3065 3.3065 3.3065 3.7692 3.7692 3.7692 3.7692 3.8753 3.8753 3.8753 3.8753 3.9747 3.9747 3.9747 3.9747 4.4841 4.4841 4.4841 4.4841 4.7763 4.7763 4.7763 4.7763 4.9158 4.9158 4.9158 4.9158 14.2865 14.2865 14.2865 14.2865 14.8132 14.8132 14.8132 14.8132 k = 0.0000 0.3227 0.1334 ( 4326 PWs) bands (ev): -13.1130 -13.1130 -13.1130 -13.1130 -12.5134 -12.5134 -12.5134 -12.5134 -11.7906 -11.7906 -11.7906 -11.7906 -11.1866 -11.1866 -11.1866 -11.1866 -0.3835 -0.3835 -0.3835 -0.3835 0.3375 0.3375 0.3375 0.3375 1.6385 1.6385 1.6385 1.6385 2.7679 2.7679 2.7679 2.7679 3.1219 3.1219 3.1219 3.1219 3.3042 3.3042 3.3042 3.3042 3.7803 3.7803 3.7803 3.7803 3.8704 3.8704 3.8704 3.8704 3.9760 3.9760 3.9760 3.9760 4.4739 4.4739 4.4739 4.4739 4.7759 4.7759 4.7759 4.7759 4.9177 4.9177 4.9177 4.9177 14.3105 14.3105 14.3105 14.3105 14.7873 14.7873 14.7873 14.7873 k = 0.0000 0.3227 0.1423 ( 4330 PWs) bands (ev): -13.1127 -13.1127 -13.1127 -13.1127 -12.5148 -12.5148 -12.5148 -12.5148 -11.7886 -11.7886 -11.7886 -11.7886 -11.1876 -11.1876 -11.1876 -11.1876 -0.3775 -0.3775 -0.3775 -0.3775 0.3273 0.3273 0.3273 0.3273 1.6421 1.6421 1.6421 1.6421 2.7696 2.7696 2.7696 2.7696 3.1229 3.1229 3.1229 3.1229 3.3027 3.3027 3.3027 3.3027 3.7881 3.7881 3.7881 3.7881 3.8666 3.8666 3.8666 3.8666 3.9767 3.9767 3.9767 3.9767 4.4676 4.4676 4.4676 4.4676 4.7756 4.7756 4.7756 4.7756 4.9188 4.9188 4.9188 4.9188 14.3267 14.3267 14.3267 14.3267 14.7700 14.7700 14.7700 14.7700 k = 0.0000 0.3227 0.1512 ( 4332 PWs) bands (ev): -13.1125 -13.1125 -13.1125 -13.1125 -12.5152 -12.5152 -12.5152 -12.5152 -11.7879 -11.7879 -11.7879 -11.7879 -11.1880 -11.1880 -11.1880 -11.1880 -0.3755 -0.3755 -0.3755 -0.3755 0.3238 0.3238 0.3238 0.3238 1.6433 1.6433 1.6433 1.6433 2.7701 2.7701 2.7701 2.7701 3.1232 3.1232 3.1232 3.1232 3.3022 3.3022 3.3022 3.3022 3.7909 3.7909 3.7909 3.7909 3.8651 3.8651 3.8651 3.8651 3.9770 3.9770 3.9770 3.9770 4.4654 4.4654 4.4654 4.4654 4.7755 4.7755 4.7755 4.7755 4.9192 4.9192 4.9192 4.9192 14.3325 14.3325 14.3325 14.3325 14.7639 14.7639 14.7639 14.7639 k = 0.5000-0.0000 0.1512 ( 4316 PWs) bands (ev): -12.1115 -12.1115 -12.1115 -12.1115 -12.1106 -12.1106 -12.1106 -12.1106 -11.1339 -11.1339 -11.1339 -11.1339 -11.1338 -11.1338 -11.1338 -11.1338 -0.3121 -0.3121 -0.3121 -0.3121 -0.3096 -0.3096 -0.3096 -0.3096 0.9489 0.9489 0.9489 0.9489 0.9522 0.9522 0.9522 0.9522 1.8142 1.8142 1.8142 1.8142 1.8238 1.8238 1.8238 1.8238 3.2487 3.2487 3.2487 3.2487 3.2520 3.2520 3.2520 3.2520 3.9092 3.9092 3.9092 3.9092 3.9145 3.9145 3.9145 3.9145 4.6212 4.6212 4.6212 4.6212 4.6235 4.6235 4.6235 4.6235 16.0695 16.0695 16.0695 16.0695 16.0696 16.0696 16.0696 16.0696 k = 0.5000-0.0000 0.1423 ( 4312 PWs) bands (ev): -12.1145 -12.1145 -12.1145 -12.1145 -12.1076 -12.1076 -12.1076 -12.1076 -11.1370 -11.1370 -11.1370 -11.1370 -11.1308 -11.1308 -11.1308 -11.1308 -0.3413 -0.3413 -0.3413 -0.3413 -0.2792 -0.2792 -0.2792 -0.2792 0.9284 0.9284 0.9284 0.9284 0.9728 0.9728 0.9728 0.9728 1.7781 1.7781 1.7781 1.7781 1.8584 1.8584 1.8584 1.8584 3.2479 3.2479 3.2479 3.2479 3.2533 3.2533 3.2533 3.2533 3.8846 3.8846 3.8846 3.8846 3.9386 3.9386 3.9386 3.9386 4.6021 4.6021 4.6021 4.6021 4.6426 4.6426 4.6426 4.6426 16.0166 16.0166 16.0166 16.0166 16.1221 16.1221 16.1221 16.1221 k = 0.5000-0.0000 0.1334 ( 4312 PWs) bands (ev): -12.1178 -12.1178 -12.1178 -12.1178 -12.1042 -12.1042 -12.1042 -12.1042 -11.1401 -11.1401 -11.1401 -11.1401 -11.1277 -11.1277 -11.1277 -11.1277 -0.3703 -0.3703 -0.3703 -0.3703 -0.2464 -0.2464 -0.2464 -0.2464 0.9069 0.9069 0.9069 0.9069 0.9951 0.9951 0.9951 0.9951 1.7366 1.7366 1.7366 1.7366 1.8957 1.8957 1.8957 1.8957 3.2467 3.2467 3.2467 3.2467 3.2559 3.2559 3.2559 3.2559 3.8574 3.8574 3.8574 3.8574 3.9646 3.9646 3.9646 3.9646 4.5821 4.5821 4.5821 4.5821 4.6626 4.6626 4.6626 4.6626 15.9637 15.9637 15.9637 15.9637 16.1738 16.1738 16.1738 16.1738 k = 0.5000-0.0000 0.1245 ( 4312 PWs) bands (ev): -12.1211 -12.1211 -12.1211 -12.1211 -12.1008 -12.1008 -12.1008 -12.1008 -11.1432 -11.1432 -11.1432 -11.1432 -11.1248 -11.1248 -11.1248 -11.1248 -0.3978 -0.3978 -0.3978 -0.3978 -0.2126 -0.2126 -0.2126 -0.2126 0.8860 0.8860 0.8860 0.8860 1.0172 1.0172 1.0172 1.0172 1.6942 1.6942 1.6942 1.6942 1.9312 1.9312 1.9312 1.9312 3.2460 3.2460 3.2460 3.2460 3.2589 3.2589 3.2589 3.2589 3.8302 3.8302 3.8302 3.8302 3.9898 3.9898 3.9898 3.9898 4.5624 4.5624 4.5624 4.5624 4.6823 4.6823 4.6823 4.6823 15.9115 15.9115 15.9115 15.9115 16.2240 16.2240 16.2240 16.2240 k = 0.5000-0.0000 0.1156 ( 4306 PWs) bands (ev): -12.1242 -12.1242 -12.1242 -12.1242 -12.0975 -12.0975 -12.0975 -12.0975 -11.1462 -11.1462 -11.1462 -11.1462 -11.1219 -11.1219 -11.1219 -11.1219 -0.4238 -0.4238 -0.4238 -0.4238 -0.1781 -0.1781 -0.1781 -0.1781 0.8659 0.8659 0.8659 0.8659 1.0387 1.0387 1.0387 1.0387 1.6515 1.6515 1.6515 1.6515 1.9647 1.9647 1.9647 1.9647 3.2457 3.2457 3.2457 3.2457 3.2622 3.2622 3.2622 3.2622 3.8034 3.8034 3.8034 3.8034 4.0139 4.0139 4.0139 4.0139 4.5431 4.5431 4.5431 4.5431 4.7015 4.7015 4.7015 4.7015 15.8604 15.8604 15.8604 15.8604 16.2724 16.2724 16.2724 16.2724 k = 0.5000-0.0000 0.1067 ( 4312 PWs) bands (ev): -12.1273 -12.1273 -12.1273 -12.1273 -12.0943 -12.0943 -12.0943 -12.0943 -11.1491 -11.1491 -11.1491 -11.1491 -11.1191 -11.1191 -11.1191 -11.1191 -0.4480 -0.4480 -0.4480 -0.4480 -0.1430 -0.1430 -0.1430 -0.1430 0.8468 0.8468 0.8468 0.8468 1.0594 1.0594 1.0594 1.0594 1.6088 1.6088 1.6088 1.6088 1.9959 1.9959 1.9959 1.9959 3.2460 3.2460 3.2460 3.2460 3.2656 3.2656 3.2656 3.2656 3.7772 3.7772 3.7772 3.7772 4.0369 4.0369 4.0369 4.0369 4.5244 4.5244 4.5244 4.5244 4.7201 4.7201 4.7201 4.7201 15.8109 15.8109 15.8109 15.8109 16.3184 16.3184 16.3184 16.3184 k = 0.5000-0.0000 0.0979 ( 4300 PWs) bands (ev): -12.1301 -12.1301 -12.1301 -12.1301 -12.0912 -12.0912 -12.0912 -12.0912 -11.1520 -11.1520 -11.1520 -11.1520 -11.1165 -11.1165 -11.1165 -11.1165 -0.4706 -0.4706 -0.4706 -0.4706 -0.1077 -0.1077 -0.1077 -0.1077 0.8287 0.8287 0.8287 0.8287 1.0788 1.0788 1.0788 1.0788 1.5669 1.5669 1.5669 1.5669 2.0247 2.0247 2.0247 2.0247 3.2467 3.2467 3.2467 3.2467 3.2691 3.2691 3.2691 3.2691 3.7519 3.7519 3.7519 3.7519 4.0585 4.0585 4.0585 4.0585 4.5066 4.5066 4.5066 4.5066 4.7379 4.7379 4.7379 4.7379 15.7635 15.7635 15.7635 15.7635 16.3617 16.3617 16.3617 16.3617 k = 0.5000-0.0000 0.0890 ( 4312 PWs) bands (ev): -12.1328 -12.1328 -12.1328 -12.1328 -12.0883 -12.0883 -12.0883 -12.0883 -11.1547 -11.1547 -11.1547 -11.1547 -11.1141 -11.1141 -11.1141 -11.1141 -0.4913 -0.4913 -0.4913 -0.4913 -0.0724 -0.0724 -0.0724 -0.0724 0.8119 0.8119 0.8119 0.8119 1.0966 1.0966 1.0966 1.0966 1.5263 1.5263 1.5263 1.5263 2.0511 2.0511 2.0511 2.0511 3.2479 3.2479 3.2479 3.2479 3.2724 3.2724 3.2724 3.2724 3.7279 3.7279 3.7279 3.7279 4.0786 4.0786 4.0786 4.0786 4.4896 4.4896 4.4896 4.4896 4.7547 4.7547 4.7547 4.7547 15.7187 15.7187 15.7187 15.7187 16.4020 16.4020 16.4020 16.4020 k = 0.5000-0.0000 0.0801 ( 4328 PWs) bands (ev): -12.1354 -12.1354 -12.1354 -12.1354 -12.0855 -12.0855 -12.0855 -12.0855 -11.1572 -11.1572 -11.1572 -11.1572 -11.1118 -11.1118 -11.1118 -11.1118 -0.5102 -0.5102 -0.5102 -0.5102 -0.0375 -0.0375 -0.0375 -0.0375 0.7963 0.7963 0.7963 0.7963 1.1120 1.1120 1.1120 1.1120 1.4878 1.4878 1.4878 1.4878 2.0750 2.0750 2.0750 2.0750 3.2494 3.2494 3.2494 3.2494 3.2754 3.2754 3.2754 3.2754 3.7054 3.7054 3.7054 3.7054 4.0970 4.0970 4.0970 4.0970 4.4737 4.4737 4.4737 4.4737 4.7704 4.7704 4.7704 4.7704 15.6769 15.6769 15.6769 15.6769 16.4389 16.4389 16.4389 16.4389 k = 0.5000-0.0000 0.0712 ( 4328 PWs) bands (ev): -12.1377 -12.1377 -12.1377 -12.1377 -12.0830 -12.0830 -12.0830 -12.0830 -11.1595 -11.1595 -11.1595 -11.1595 -11.1097 -11.1097 -11.1097 -11.1097 -0.5273 -0.5273 -0.5273 -0.5273 -0.0036 -0.0036 -0.0036 -0.0036 0.7822 0.7822 0.7822 0.7822 1.1245 1.1245 1.1245 1.1245 1.4525 1.4525 1.4525 1.4525 2.0963 2.0963 2.0963 2.0963 3.2512 3.2512 3.2512 3.2512 3.2781 3.2781 3.2781 3.2781 3.6847 3.6847 3.6847 3.6847 4.1138 4.1138 4.1138 4.1138 4.4589 4.4589 4.4589 4.4589 4.7850 4.7850 4.7850 4.7850 15.6384 15.6384 15.6384 15.6384 16.4451 16.4451 16.4451 16.4451 k = 0.5000-0.0000 0.0623 ( 4328 PWs) bands (ev): -12.1397 -12.1397 -12.1397 -12.1397 -12.0806 -12.0806 -12.0806 -12.0806 -11.1617 -11.1617 -11.1617 -11.1617 -11.1079 -11.1079 -11.1079 -11.1079 -0.5424 -0.5424 -0.5424 -0.5424 0.0290 0.0290 0.0290 0.0290 0.7695 0.7695 0.7695 0.7695 1.1334 1.1334 1.1334 1.1334 1.4214 1.4214 1.4214 1.4214 2.1150 2.1150 2.1150 2.1150 3.2531 3.2531 3.2531 3.2531 3.2805 3.2805 3.2805 3.2805 3.6661 3.6661 3.6661 3.6661 4.1289 4.1289 4.1289 4.1289 4.4456 4.4456 4.4456 4.4456 4.7981 4.7981 4.7981 4.7981 15.6036 15.6036 15.6036 15.6036 16.4176 16.4176 16.4176 16.4176 k = 0.5000-0.0000 0.0534 ( 4332 PWs) bands (ev): -12.1415 -12.1415 -12.1415 -12.1415 -12.0786 -12.0786 -12.0786 -12.0786 -11.1636 -11.1636 -11.1636 -11.1636 -11.1062 -11.1062 -11.1062 -11.1062 -0.5555 -0.5555 -0.5555 -0.5555 0.0595 0.0595 0.0595 0.0595 0.7584 0.7584 0.7584 0.7584 1.1381 1.1381 1.1381 1.1381 1.3955 1.3955 1.3955 1.3955 2.1312 2.1312 2.1312 2.1312 3.2551 3.2551 3.2551 3.2551 3.2823 3.2823 3.2823 3.2823 3.6496 3.6496 3.6496 3.6496 4.1420 4.1420 4.1420 4.1420 4.4337 4.4337 4.4337 4.4337 4.8098 4.8098 4.8098 4.8098 15.5728 15.5728 15.5728 15.5728 16.3933 16.3933 16.3933 16.3933 k = 0.5000-0.0000 0.0445 ( 4336 PWs) bands (ev): -12.1431 -12.1431 -12.1431 -12.1431 -12.0768 -12.0768 -12.0768 -12.0768 -11.1652 -11.1652 -11.1652 -11.1652 -11.1048 -11.1048 -11.1048 -11.1048 -0.5667 -0.5667 -0.5667 -0.5667 0.0874 0.0874 0.0874 0.0874 0.7489 0.7489 0.7489 0.7489 1.1384 1.1384 1.1384 1.1384 1.3755 1.3755 1.3755 1.3755 2.1448 2.1448 2.1448 2.1448 3.2570 3.2570 3.2570 3.2570 3.2837 3.2837 3.2837 3.2837 3.6356 3.6356 3.6356 3.6356 4.1532 4.1532 4.1532 4.1532 4.4234 4.4234 4.4234 4.4234 4.8198 4.8198 4.8198 4.8198 15.5463 15.5463 15.5463 15.5463 16.3725 16.3725 16.3725 16.3725 k = 0.5000-0.0000 0.0356 ( 4336 PWs) bands (ev): -12.1444 -12.1444 -12.1444 -12.1444 -12.0753 -12.0753 -12.0753 -12.0753 -11.1665 -11.1665 -11.1665 -11.1665 -11.1036 -11.1036 -11.1036 -11.1036 -0.5758 -0.5758 -0.5758 -0.5758 0.1117 0.1117 0.1117 0.1117 0.7410 0.7410 0.7410 0.7410 1.1351 1.1351 1.1351 1.1351 1.3615 1.3615 1.3615 1.3615 2.1559 2.1559 2.1559 2.1559 3.2587 3.2587 3.2587 3.2587 3.2848 3.2848 3.2848 3.2848 3.6241 3.6241 3.6241 3.6241 4.1625 4.1625 4.1625 4.1625 4.4148 4.4148 4.4148 4.4148 4.8282 4.8282 4.8282 4.8282 15.5243 15.5243 15.5243 15.5243 16.3553 16.3553 16.3553 16.3553 k = 0.5000-0.0000 0.0267 ( 4340 PWs) bands (ev): -12.1454 -12.1454 -12.1454 -12.1454 -12.0741 -12.0741 -12.0741 -12.0741 -11.1676 -11.1676 -11.1676 -11.1676 -11.1027 -11.1027 -11.1027 -11.1027 -0.5830 -0.5830 -0.5830 -0.5830 0.1318 0.1318 0.1318 0.1318 0.7349 0.7349 0.7349 0.7349 1.1295 1.1295 1.1295 1.1295 1.3526 1.3526 1.3526 1.3526 2.1645 2.1645 2.1645 2.1645 3.2601 3.2601 3.2601 3.2601 3.2854 3.2854 3.2854 3.2854 3.6151 3.6151 3.6151 3.6151 4.1697 4.1697 4.1697 4.1697 4.4080 4.4080 4.4080 4.4080 4.8348 4.8348 4.8348 4.8348 15.5070 15.5070 15.5070 15.5070 16.3418 16.3418 16.3418 16.3418 k = 0.5000-0.0000 0.0178 ( 4336 PWs) bands (ev): -12.1461 -12.1461 -12.1461 -12.1461 -12.0733 -12.0733 -12.0733 -12.0733 -11.1684 -11.1684 -11.1684 -11.1684 -11.1021 -11.1021 -11.1021 -11.1021 -0.5881 -0.5881 -0.5881 -0.5881 0.1468 0.1468 0.1468 0.1468 0.7305 0.7305 0.7305 0.7305 1.1236 1.1236 1.1236 1.1236 1.3474 1.3474 1.3474 1.3474 2.1706 2.1706 2.1706 2.1706 3.2612 3.2612 3.2612 3.2612 3.2858 3.2858 3.2858 3.2858 3.6088 3.6088 3.6088 3.6088 4.1749 4.1749 4.1749 4.1749 4.4031 4.4031 4.4031 4.4031 4.8395 4.8395 4.8395 4.8395 15.4945 15.4945 15.4945 15.4945 16.3322 16.3322 16.3322 16.3322 k = 0.5000-0.0000 0.0089 ( 4332 PWs) bands (ev): -12.1466 -12.1466 -12.1466 -12.1466 -12.0728 -12.0728 -12.0728 -12.0728 -11.1689 -11.1689 -11.1689 -11.1689 -11.1017 -11.1017 -11.1017 -11.1017 -0.5912 -0.5912 -0.5912 -0.5912 0.1561 0.1561 0.1561 0.1561 0.7278 0.7278 0.7278 0.7278 1.1193 1.1193 1.1193 1.1193 1.3449 1.3449 1.3449 1.3449 2.1743 2.1743 2.1743 2.1743 3.2619 3.2619 3.2619 3.2619 3.2860 3.2860 3.2860 3.2860 3.6049 3.6049 3.6049 3.6049 4.1780 4.1780 4.1780 4.1780 4.4002 4.4002 4.4002 4.4002 4.8424 4.8424 4.8424 4.8424 15.4870 15.4870 15.4870 15.4870 16.3263 16.3263 16.3263 16.3263 k = 0.5000-0.0000-0.0000 ( 4320 PWs) bands (ev): -12.1467 -12.1467 -12.1467 -12.1467 -12.0726 -12.0726 -12.0726 -12.0726 -11.1690 -11.1690 -11.1690 -11.1690 -11.1015 -11.1015 -11.1015 -11.1015 -0.5922 -0.5922 -0.5922 -0.5922 0.1592 0.1592 0.1592 0.1592 0.7270 0.7270 0.7270 0.7270 1.1177 1.1177 1.1177 1.1177 1.3442 1.3442 1.3442 1.3442 2.1755 2.1755 2.1755 2.1755 3.2621 3.2621 3.2621 3.2621 3.2861 3.2861 3.2861 3.2861 3.6037 3.6037 3.6037 3.6037 4.1791 4.1791 4.1791 4.1791 4.3992 4.3992 4.3992 4.3992 4.8434 4.8434 4.8434 4.8434 15.4845 15.4845 15.4845 15.4845 16.3244 16.3244 16.3244 16.3244 k = 0.5000 0.3227-0.0000 ( 4312 PWs) bands (ev): -11.9450 -11.9450 -11.9450 -11.9450 -11.9017 -11.9017 -11.9017 -11.9017 -11.3564 -11.3564 -11.3564 -11.3564 -11.2998 -11.2998 -11.2998 -11.2998 -0.8316 -0.8316 -0.8316 -0.8316 -0.3021 -0.3021 -0.3021 -0.3021 0.3882 0.3882 0.3882 0.3882 1.0116 1.0116 1.0116 1.0116 1.8205 1.8205 1.8205 1.8205 1.9843 1.9843 1.9843 1.9843 3.6394 3.6394 3.6394 3.6394 3.8135 3.8135 3.8135 3.8135 3.8622 3.8622 3.8622 3.8622 4.2909 4.2909 4.2909 4.2909 4.4540 4.4540 4.4540 4.4540 4.8345 4.8345 4.8345 4.8345 15.5675 15.5675 15.5675 15.5675 15.7163 15.7163 15.7163 15.7163 k = 0.5000 0.3227 0.0089 ( 4312 PWs) bands (ev): -11.9449 -11.9449 -11.9449 -11.9449 -11.9018 -11.9018 -11.9018 -11.9018 -11.3562 -11.3562 -11.3562 -11.3562 -11.2999 -11.2999 -11.2999 -11.2999 -0.8306 -0.8306 -0.8306 -0.8306 -0.3030 -0.3030 -0.3030 -0.3030 0.3879 0.3879 0.3879 0.3879 1.0083 1.0083 1.0083 1.0083 1.8231 1.8231 1.8231 1.8231 1.9875 1.9875 1.9875 1.9875 3.6357 3.6357 3.6357 3.6357 3.8114 3.8114 3.8114 3.8114 3.8652 3.8652 3.8652 3.8652 4.2879 4.2879 4.2879 4.2879 4.4576 4.4576 4.4576 4.4576 4.8341 4.8341 4.8341 4.8341 15.5693 15.5693 15.5693 15.5693 15.7176 15.7176 15.7176 15.7176 k = 0.5000 0.3227 0.0178 ( 4328 PWs) bands (ev): -11.9446 -11.9446 -11.9446 -11.9446 -11.9021 -11.9021 -11.9021 -11.9021 -11.3558 -11.3558 -11.3558 -11.3558 -11.3003 -11.3003 -11.3003 -11.3003 -0.8275 -0.8275 -0.8275 -0.8275 -0.3058 -0.3058 -0.3058 -0.3058 0.3871 0.3871 0.3871 0.3871 0.9985 0.9985 0.9985 0.9985 1.8311 1.8311 1.8311 1.8311 1.9970 1.9970 1.9970 1.9970 3.6253 3.6253 3.6253 3.6253 3.8053 3.8053 3.8053 3.8053 3.8737 3.8737 3.8737 3.8737 4.2797 4.2797 4.2797 4.2797 4.4674 4.4674 4.4674 4.4674 4.8330 4.8330 4.8330 4.8330 15.5748 15.5748 15.5748 15.5748 15.7212 15.7212 15.7212 15.7212 k = 0.5000 0.3227 0.0267 ( 4328 PWs) bands (ev): -11.9442 -11.9442 -11.9442 -11.9442 -11.9026 -11.9026 -11.9026 -11.9026 -11.3552 -11.3552 -11.3552 -11.3552 -11.3008 -11.3008 -11.3008 -11.3008 -0.8223 -0.8223 -0.8223 -0.8223 -0.3105 -0.3105 -0.3105 -0.3105 0.3861 0.3861 0.3861 0.3861 0.9827 0.9827 0.9827 0.9827 1.8441 1.8441 1.8441 1.8441 2.0120 2.0120 2.0120 2.0120 3.6095 3.6095 3.6095 3.6095 3.7952 3.7952 3.7952 3.7952 3.8861 3.8861 3.8861 3.8861 4.2681 4.2681 4.2681 4.2681 4.4819 4.4819 4.4819 4.4819 4.8312 4.8312 4.8312 4.8312 15.5838 15.5838 15.5838 15.5838 15.7271 15.7271 15.7271 15.7271 k = 0.5000 0.3227 0.0356 ( 4328 PWs) bands (ev): -11.9436 -11.9436 -11.9436 -11.9436 -11.9033 -11.9033 -11.9033 -11.9033 -11.3543 -11.3543 -11.3543 -11.3543 -11.3016 -11.3016 -11.3016 -11.3016 -0.8151 -0.8151 -0.8151 -0.8151 -0.3171 -0.3171 -0.3171 -0.3171 0.3851 0.3851 0.3851 0.3851 0.9616 0.9616 0.9616 0.9616 1.8618 1.8618 1.8618 1.8618 2.0319 2.0319 2.0319 2.0319 3.5901 3.5901 3.5901 3.5901 3.7814 3.7814 3.7814 3.7814 3.9011 3.9011 3.9011 3.9011 4.2546 4.2546 4.2546 4.2546 4.4992 4.4992 4.4992 4.4992 4.8287 4.8287 4.8287 4.8287 15.5961 15.5961 15.5961 15.5961 15.7352 15.7352 15.7352 15.7352 k = 0.5000 0.3227 0.0445 ( 4328 PWs) bands (ev): -11.9429 -11.9429 -11.9429 -11.9429 -11.9042 -11.9042 -11.9042 -11.9042 -11.3532 -11.3532 -11.3532 -11.3532 -11.3026 -11.3026 -11.3026 -11.3026 -0.8059 -0.8059 -0.8059 -0.8059 -0.3259 -0.3259 -0.3259 -0.3259 0.3847 0.3847 0.3847 0.3847 0.9362 0.9362 0.9362 0.9362 1.8837 1.8837 1.8837 1.8837 2.0554 2.0554 2.0554 2.0554 3.5684 3.5684 3.5684 3.5684 3.7639 3.7639 3.7639 3.7639 3.9176 3.9176 3.9176 3.9176 4.2405 4.2405 4.2405 4.2405 4.5181 4.5181 4.5181 4.5181 4.8255 4.8255 4.8255 4.8255 15.6117 15.6117 15.6117 15.6117 15.7452 15.7452 15.7452 15.7452 k = 0.5000 0.3227 0.0534 ( 4332 PWs) bands (ev): -11.9420 -11.9420 -11.9420 -11.9420 -11.9053 -11.9053 -11.9053 -11.9053 -11.3519 -11.3519 -11.3519 -11.3519 -11.3038 -11.3038 -11.3038 -11.3038 -0.7948 -0.7948 -0.7948 -0.7948 -0.3367 -0.3367 -0.3367 -0.3367 0.3853 0.3853 0.3853 0.3853 0.9073 0.9073 0.9073 0.9073 1.9092 1.9092 1.9092 1.9092 2.0814 2.0814 2.0814 2.0814 3.5457 3.5457 3.5457 3.5457 3.7432 3.7432 3.7432 3.7432 3.9346 3.9346 3.9346 3.9346 4.2264 4.2264 4.2264 4.2264 4.5378 4.5378 4.5378 4.5378 4.8215 4.8215 4.8215 4.8215 15.6300 15.6300 15.6300 15.6300 15.7571 15.7571 15.7571 15.7571 k = 0.5000 0.3227 0.0623 ( 4320 PWs) bands (ev): -11.9409 -11.9409 -11.9409 -11.9409 -11.9065 -11.9065 -11.9065 -11.9065 -11.3503 -11.3503 -11.3503 -11.3503 -11.3052 -11.3052 -11.3052 -11.3052 -0.7818 -0.7818 -0.7818 -0.7818 -0.3498 -0.3498 -0.3498 -0.3498 0.3874 0.3874 0.3874 0.3874 0.8757 0.8757 0.8757 0.8757 1.9378 1.9378 1.9378 1.9378 2.1087 2.1087 2.1087 2.1087 3.5228 3.5228 3.5228 3.5228 3.7195 3.7195 3.7195 3.7195 3.9519 3.9519 3.9519 3.9519 4.2128 4.2128 4.2128 4.2128 4.5578 4.5578 4.5578 4.5578 4.8168 4.8168 4.8168 4.8168 15.6509 15.6509 15.6509 15.6509 15.7703 15.7703 15.7703 15.7703 k = 0.5000 0.3227 0.0712 ( 4324 PWs) bands (ev): -11.9397 -11.9397 -11.9397 -11.9397 -11.9078 -11.9078 -11.9078 -11.9078 -11.3486 -11.3486 -11.3486 -11.3486 -11.3068 -11.3068 -11.3068 -11.3068 -0.7669 -0.7669 -0.7669 -0.7669 -0.3650 -0.3650 -0.3650 -0.3650 0.3913 0.3913 0.3913 0.3913 0.8422 0.8422 0.8422 0.8422 1.9687 1.9687 1.9687 1.9687 2.1362 2.1362 2.1362 2.1362 3.5007 3.5007 3.5007 3.5007 3.6934 3.6934 3.6934 3.6934 3.9689 3.9689 3.9689 3.9689 4.1997 4.1997 4.1997 4.1997 4.5776 4.5776 4.5776 4.5776 4.8113 4.8113 4.8113 4.8113 15.6739 15.6739 15.6739 15.6739 15.7845 15.7845 15.7845 15.7845 k = 0.5000 0.3227 0.0801 ( 4320 PWs) bands (ev): -11.9384 -11.9384 -11.9384 -11.9384 -11.9093 -11.9093 -11.9093 -11.9093 -11.3466 -11.3466 -11.3466 -11.3466 -11.3086 -11.3086 -11.3086 -11.3086 -0.7504 -0.7504 -0.7504 -0.7504 -0.3823 -0.3823 -0.3823 -0.3823 0.3975 0.3975 0.3975 0.3975 0.8074 0.8074 0.8074 0.8074 2.0012 2.0012 2.0012 2.0012 2.1626 2.1626 2.1626 2.1626 3.4801 3.4801 3.4801 3.4801 3.6654 3.6654 3.6654 3.6654 3.9855 3.9855 3.9855 3.9855 4.1872 4.1872 4.1872 4.1872 4.5971 4.5971 4.5971 4.5971 4.8051 4.8051 4.8051 4.8051 15.6983 15.6983 15.6983 15.6983 15.7993 15.7993 15.7993 15.7993 k = 0.5000 0.3227 0.0890 ( 4324 PWs) bands (ev): -11.9369 -11.9369 -11.9369 -11.9369 -11.9109 -11.9109 -11.9109 -11.9109 -11.3445 -11.3445 -11.3445 -11.3445 -11.3105 -11.3105 -11.3105 -11.3105 -0.7322 -0.7322 -0.7322 -0.7322 -0.4015 -0.4015 -0.4015 -0.4015 0.4062 0.4062 0.4062 0.4062 0.7721 0.7721 0.7721 0.7721 2.0346 2.0346 2.0346 2.0346 2.1869 2.1869 2.1869 2.1869 3.4619 3.4619 3.4619 3.4619 3.6360 3.6360 3.6360 3.6360 4.0015 4.0015 4.0015 4.0015 4.1753 4.1753 4.1753 4.1753 4.6161 4.6161 4.6161 4.6161 4.7982 4.7982 4.7982 4.7982 15.7236 15.7236 15.7236 15.7236 15.8141 15.8141 15.8141 15.8141 k = 0.5000 0.3227 0.0979 ( 4332 PWs) bands (ev): -11.9354 -11.9354 -11.9354 -11.9354 -11.9127 -11.9127 -11.9127 -11.9127 -11.3423 -11.3423 -11.3423 -11.3423 -11.3126 -11.3126 -11.3126 -11.3126 -0.7124 -0.7124 -0.7124 -0.7124 -0.4226 -0.4226 -0.4226 -0.4226 0.4176 0.4176 0.4176 0.4176 0.7365 0.7365 0.7365 0.7365 2.0681 2.0681 2.0681 2.0681 2.2080 2.2080 2.2080 2.2080 3.4469 3.4469 3.4469 3.4469 3.6060 3.6060 3.6060 3.6060 4.0169 4.0169 4.0169 4.0169 4.1638 4.1638 4.1638 4.1638 4.6344 4.6344 4.6344 4.6344 4.7905 4.7905 4.7905 4.7905 15.7490 15.7490 15.7490 15.7490 15.8282 15.8282 15.8282 15.8282 k = 0.5000 0.3227 0.1067 ( 4332 PWs) bands (ev): -11.9337 -11.9337 -11.9337 -11.9337 -11.9145 -11.9145 -11.9145 -11.9145 -11.3400 -11.3400 -11.3400 -11.3400 -11.3148 -11.3148 -11.3148 -11.3148 -0.6913 -0.6913 -0.6913 -0.6913 -0.4451 -0.4451 -0.4451 -0.4451 0.4317 0.4317 0.4317 0.4317 0.7013 0.7013 0.7013 0.7013 2.1009 2.1009 2.1009 2.1009 2.2249 2.2249 2.2249 2.2249 3.4357 3.4357 3.4357 3.4357 3.5760 3.5760 3.5760 3.5760 4.0317 4.0317 4.0317 4.0317 4.1526 4.1526 4.1526 4.1526 4.6520 4.6520 4.6520 4.6520 4.7820 4.7820 4.7820 4.7820 15.7738 15.7738 15.7738 15.7738 15.8410 15.8410 15.8410 15.8410 k = 0.5000 0.3227 0.1156 ( 4336 PWs) bands (ev): -11.9320 -11.9320 -11.9320 -11.9320 -11.9163 -11.9163 -11.9163 -11.9163 -11.3375 -11.3375 -11.3375 -11.3375 -11.3171 -11.3171 -11.3171 -11.3171 -0.6689 -0.6689 -0.6689 -0.6689 -0.4689 -0.4689 -0.4689 -0.4689 0.4486 0.4486 0.4486 0.4486 0.6668 0.6668 0.6668 0.6668 2.1322 2.1322 2.1322 2.1322 2.2369 2.2369 2.2369 2.2369 3.4290 3.4290 3.4290 3.4290 3.5468 3.5468 3.5468 3.5468 4.0459 4.0459 4.0459 4.0459 4.1416 4.1416 4.1416 4.1416 4.6687 4.6687 4.6687 4.6687 4.7727 4.7727 4.7727 4.7727 15.7971 15.7971 15.7971 15.7971 15.8517 15.8517 15.8517 15.8517 k = 0.5000 0.3227 0.1245 ( 4340 PWs) bands (ev): -11.9301 -11.9301 -11.9301 -11.9301 -11.9183 -11.9183 -11.9183 -11.9183 -11.3350 -11.3350 -11.3350 -11.3350 -11.3196 -11.3196 -11.3196 -11.3196 -0.6455 -0.6455 -0.6455 -0.6455 -0.4936 -0.4936 -0.4936 -0.4936 0.4681 0.4681 0.4681 0.4681 0.6332 0.6332 0.6332 0.6332 2.1611 2.1611 2.1611 2.1611 2.2432 2.2432 2.2432 2.2432 3.4273 3.4273 3.4273 3.4273 3.5192 3.5192 3.5192 3.5192 4.0594 4.0594 4.0594 4.0594 4.1306 4.1306 4.1306 4.1306 4.6847 4.6847 4.6847 4.6847 4.7627 4.7627 4.7627 4.7627 15.8181 15.8181 15.8181 15.8181 15.8595 15.8595 15.8595 15.8595 k = 0.5000 0.3227 0.1334 ( 4356 PWs) bands (ev): -11.9282 -11.9282 -11.9282 -11.9282 -11.9202 -11.9202 -11.9202 -11.9202 -11.3324 -11.3324 -11.3324 -11.3324 -11.3221 -11.3221 -11.3221 -11.3221 -0.6211 -0.6211 -0.6211 -0.6211 -0.5190 -0.5190 -0.5190 -0.5190 0.4902 0.4902 0.4902 0.4902 0.6010 0.6010 0.6010 0.6010 2.1867 2.1867 2.1867 2.1867 2.2437 2.2437 2.2437 2.2437 3.4308 3.4308 3.4308 3.4308 3.4939 3.4939 3.4939 3.4939 4.0723 4.0723 4.0723 4.0723 4.1195 4.1195 4.1195 4.1195 4.6998 4.6998 4.6998 4.6998 4.7518 4.7518 4.7518 4.7518 15.8357 15.8357 15.8357 15.8357 15.8636 15.8636 15.8636 15.8636 k = 0.5000 0.3227 0.1423 ( 4360 PWs) bands (ev): -11.9263 -11.9263 -11.9263 -11.9263 -11.9222 -11.9222 -11.9222 -11.9222 -11.3298 -11.3298 -11.3298 -11.3298 -11.3246 -11.3246 -11.3246 -11.3246 -0.5960 -0.5960 -0.5960 -0.5960 -0.5447 -0.5447 -0.5447 -0.5447 0.5148 0.5148 0.5148 0.5148 0.5704 0.5704 0.5704 0.5704 2.2080 2.2080 2.2080 2.2080 2.2385 2.2385 2.2385 2.2385 3.4395 3.4395 3.4395 3.4395 3.4718 3.4718 3.4718 3.4718 4.0847 4.0847 4.0847 4.0847 4.1083 4.1083 4.1083 4.1083 4.7139 4.7139 4.7139 4.7139 4.7401 4.7401 4.7401 4.7401 15.8494 15.8494 15.8494 15.8494 15.8636 15.8636 15.8636 15.8636 k = 0.5000 0.3227 0.1512 ( 4352 PWs) bands (ev): -11.9249 -11.9249 -11.9249 -11.9249 -11.9237 -11.9237 -11.9237 -11.9237 -11.3273 -11.3273 -11.3273 -11.3273 -11.3272 -11.3272 -11.3272 -11.3272 -0.5709 -0.5709 -0.5709 -0.5709 -0.5700 -0.5700 -0.5700 -0.5700 0.5411 0.5411 0.5411 0.5411 0.5420 0.5420 0.5420 0.5420 2.2206 2.2206 2.2206 2.2206 2.2313 2.2313 2.2313 2.2313 3.4513 3.4513 3.4513 3.4513 3.4555 3.4555 3.4555 3.4555 4.0959 4.0959 4.0959 4.0959 4.0975 4.0975 4.0975 4.0975 4.7257 4.7257 4.7257 4.7257 4.7293 4.7293 4.7293 4.7293 15.8575 15.8575 15.8575 15.8575 15.8602 15.8602 15.8602 15.8602 Writing output data file AlO2.save init_run : 0.18s CPU 0.33s WALL ( 1 calls) electrons : 374.70s CPU 380.19s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 374.68s CPU 380.18s 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 : 0.06s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.14s WALL ( 448 calls) cegterg : 347.89s CPU 352.37s WALL ( 779 calls) Called by sum_band: Called by *egterg: h_psi : 160.71s CPU 163.60s WALL ( 11770 calls) s_psi : 18.87s CPU 18.82s WALL ( 11770 calls) g_psi : 0.45s CPU 0.49s WALL ( 10543 calls) cdiaghg : 147.98s CPU 149.62s WALL ( 10991 calls) cegterg:over : 15.82s CPU 16.09s WALL ( 10543 calls) cegterg:upda : 13.66s CPU 13.74s WALL ( 10543 calls) cegterg:last : 6.23s CPU 6.35s WALL ( 1675 calls) cdiaghg:chol : 8.44s CPU 8.64s WALL ( 10991 calls) cdiaghg:inve : 6.22s CPU 6.33s WALL ( 10991 calls) cdiaghg:para : 10.83s CPU 10.88s WALL ( 21982 calls) Called by h_psi: h_psi:vloc : 121.28s CPU 123.97s WALL ( 11770 calls) h_psi:vnl : 38.98s CPU 39.10s WALL ( 11770 calls) add_vuspsi : 20.46s CPU 20.44s WALL ( 11770 calls) General routines calbec : 18.48s CPU 18.63s WALL ( 11770 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 113.47s CPU 116.08s WALL ( 1602948 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.29s CPU 0.40s WALL ( 896 calls) Parallel routines fft_scatter : 43.61s CPU 44.76s WALL ( 1602971 calls) PWSCF : 6m42.10s CPU 7m14.52s WALL This run was terminated on: 19:41:13 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=