Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:14:39 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: ./TiS3.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 42 42 12 2655 2655 402 Max 43 43 13 2664 2664 408 Sum 1537 1537 439 95771 95771 14571 bravais-lattice index = 14 lattice parameter (alat) = 6.4262 a.u. unit-cell volume = 990.6042 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.426202 celldm(2)= 1.457978 celldm(3)= 2.581309 celldm(4)= 0.127411 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 1.457978 0.000000 ) a(3) = ( 0.000000 0.328887 2.560272 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.685881 -0.088107 ) b(3) = ( 0.000000 0.000000 0.390584 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 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 1151 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 PseudoPot. # 2 for Ti read from file: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 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 atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Ti 12.00 47.86700 Ti( 1.00) 4 Sym. Ops., with inversion, found ( 2 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 [1,0,0] cryst. s( 2) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 2) = ( 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 = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 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 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [1,0,0] -C2 -2 180 deg rotation - cart. axis [1,0,0] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [1,0,0] -s_h -4 inv. 180 deg rotation - cart. axis [1,0,0] E Cartesian axes number of k points= 290 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034483 k( 2) = ( 0.0000000 0.0000000 0.0102785), wk = 0.0034483 k( 3) = ( 0.0000000 0.0000000 0.0205570), wk = 0.0034483 k( 4) = ( 0.0000000 0.0000000 0.0308355), wk = 0.0034483 k( 5) = ( 0.0000000 0.0000000 0.0411141), wk = 0.0034483 k( 6) = ( 0.0000000 0.0000000 0.0513926), wk = 0.0034483 k( 7) = ( 0.0000000 0.0000000 0.0616711), wk = 0.0034483 k( 8) = ( 0.0000000 0.0000000 0.0719496), wk = 0.0034483 k( 9) = ( 0.0000000 0.0000000 0.0822281), wk = 0.0034483 k( 10) = ( 0.0000000 0.0000000 0.0925066), wk = 0.0034483 k( 11) = ( 0.0000000 0.0000000 0.1027851), wk = 0.0034483 k( 12) = ( 0.0000000 0.0000000 0.1130637), wk = 0.0034483 k( 13) = ( 0.0000000 0.0000000 0.1233422), wk = 0.0034483 k( 14) = ( 0.0000000 0.0000000 0.1336207), wk = 0.0034483 k( 15) = ( 0.0000000 0.0000000 0.1438992), wk = 0.0034483 k( 16) = ( 0.0000000 0.0000000 0.1541777), wk = 0.0034483 k( 17) = ( 0.0000000 0.0000000 0.1644562), wk = 0.0034483 k( 18) = ( 0.0000000 0.0000000 0.1747348), wk = 0.0034483 k( 19) = ( 0.0000000 0.0000000 0.1850133), wk = 0.0034483 k( 20) = ( 0.0000000 0.0000000 0.1952918), wk = 0.0034483 k( 21) = ( 0.0000000 0.0000000 0.1952918), wk = 0.0034483 k( 22) = ( 0.0000000 0.0107838 0.1952918), wk = 0.0034483 k( 23) = ( 0.0000000 0.0215675 0.1952918), wk = 0.0034483 k( 24) = ( 0.0000000 0.0323513 0.1952918), wk = 0.0034483 k( 25) = ( 0.0000000 0.0431351 0.1952918), wk = 0.0034483 k( 26) = ( 0.0000000 0.0539188 0.1952918), wk = 0.0034483 k( 27) = ( 0.0000000 0.0647026 0.1952918), wk = 0.0034483 k( 28) = ( 0.0000000 0.0754864 0.1952918), wk = 0.0034483 k( 29) = ( 0.0000000 0.0862701 0.1952918), wk = 0.0034483 k( 30) = ( 0.0000000 0.0970539 0.1952918), wk = 0.0034483 k( 31) = ( 0.0000000 0.1078377 0.1952918), wk = 0.0034483 k( 32) = ( 0.0000000 0.1186214 0.1952918), wk = 0.0034483 k( 33) = ( 0.0000000 0.1294052 0.1952918), wk = 0.0034483 k( 34) = ( 0.0000000 0.1401889 0.1952918), wk = 0.0034483 k( 35) = ( 0.0000000 0.1509727 0.1952918), wk = 0.0034483 k( 36) = ( 0.0000000 0.1617565 0.1952918), wk = 0.0034483 k( 37) = ( 0.0000000 0.1725402 0.1952918), wk = 0.0034483 k( 38) = ( 0.0000000 0.1833240 0.1952918), wk = 0.0034483 k( 39) = ( 0.0000000 0.1941078 0.1952918), wk = 0.0034483 k( 40) = ( 0.0000000 0.2048915 0.1952918), wk = 0.0034483 k( 41) = ( 0.0000000 0.2156753 0.1952918), wk = 0.0034483 k( 42) = ( 0.0000000 0.2264591 0.1952918), wk = 0.0034483 k( 43) = ( 0.0000000 0.2372428 0.1952918), wk = 0.0034483 k( 44) = ( 0.0000000 0.2480266 0.1952918), wk = 0.0034483 k( 45) = ( 0.0000000 0.2588104 0.1952918), wk = 0.0034483 k( 46) = ( 0.0000000 0.2695941 0.1952918), wk = 0.0034483 k( 47) = ( 0.0000000 0.2803779 0.1952918), wk = 0.0034483 k( 48) = ( 0.0000000 0.2911617 0.1952918), wk = 0.0034483 k( 49) = ( 0.0000000 0.3019454 0.1952918), wk = 0.0034483 k( 50) = ( 0.0000000 0.3127292 0.1952918), wk = 0.0034483 k( 51) = ( 0.0000000 0.3235130 0.1952918), wk = 0.0034483 k( 52) = ( 0.0000000 0.3235130 0.1952918), wk = 0.0034483 k( 53) = ( 0.0000000 0.3273985 0.1864811), wk = 0.0034483 k( 54) = ( 0.0000000 0.3312841 0.1776704), wk = 0.0034483 k( 55) = ( 0.0000000 0.3351696 0.1688597), wk = 0.0034483 k( 56) = ( 0.0000000 0.3390552 0.1600491), wk = 0.0034483 k( 57) = ( 0.0000000 0.3429407 0.1512384), wk = 0.0034483 k( 58) = ( 0.0000000 0.3429407 0.1512384), wk = 0.0034483 k( 59) = ( 0.0106383 0.3429407 0.1512384), wk = 0.0034483 k( 60) = ( 0.0212766 0.3429407 0.1512384), wk = 0.0034483 k( 61) = ( 0.0319149 0.3429407 0.1512384), wk = 0.0034483 k( 62) = ( 0.0425532 0.3429407 0.1512384), wk = 0.0034483 k( 63) = ( 0.0531915 0.3429407 0.1512384), wk = 0.0034483 k( 64) = ( 0.0638298 0.3429407 0.1512384), wk = 0.0034483 k( 65) = ( 0.0744681 0.3429407 0.1512384), wk = 0.0034483 k( 66) = ( 0.0851064 0.3429407 0.1512384), wk = 0.0034483 k( 67) = ( 0.0957447 0.3429407 0.1512384), wk = 0.0034483 k( 68) = ( 0.1063830 0.3429407 0.1512384), wk = 0.0034483 k( 69) = ( 0.1170213 0.3429407 0.1512384), wk = 0.0034483 k( 70) = ( 0.1276596 0.3429407 0.1512384), wk = 0.0034483 k( 71) = ( 0.1382979 0.3429407 0.1512384), wk = 0.0034483 k( 72) = ( 0.1489362 0.3429407 0.1512384), wk = 0.0034483 k( 73) = ( 0.1595745 0.3429407 0.1512384), wk = 0.0034483 k( 74) = ( 0.1702128 0.3429407 0.1512384), wk = 0.0034483 k( 75) = ( 0.1808511 0.3429407 0.1512384), wk = 0.0034483 k( 76) = ( 0.1914894 0.3429407 0.1512384), wk = 0.0034483 k( 77) = ( 0.2021277 0.3429407 0.1512384), wk = 0.0034483 k( 78) = ( 0.2127660 0.3429407 0.1512384), wk = 0.0034483 k( 79) = ( 0.2234043 0.3429407 0.1512384), wk = 0.0034483 k( 80) = ( 0.2340425 0.3429407 0.1512384), wk = 0.0034483 k( 81) = ( 0.2446809 0.3429407 0.1512384), wk = 0.0034483 k( 82) = ( 0.2553191 0.3429407 0.1512384), wk = 0.0034483 k( 83) = ( 0.2659574 0.3429407 0.1512384), wk = 0.0034483 k( 84) = ( 0.2765957 0.3429407 0.1512384), wk = 0.0034483 k( 85) = ( 0.2872340 0.3429407 0.1512384), wk = 0.0034483 k( 86) = ( 0.2978723 0.3429407 0.1512384), wk = 0.0034483 k( 87) = ( 0.3085106 0.3429407 0.1512384), wk = 0.0034483 k( 88) = ( 0.3191489 0.3429407 0.1512384), wk = 0.0034483 k( 89) = ( 0.3297872 0.3429407 0.1512384), wk = 0.0034483 k( 90) = ( 0.3404255 0.3429407 0.1512384), wk = 0.0034483 k( 91) = ( 0.3510638 0.3429407 0.1512384), wk = 0.0034483 k( 92) = ( 0.3617021 0.3429407 0.1512384), wk = 0.0034483 k( 93) = ( 0.3723404 0.3429407 0.1512384), wk = 0.0034483 k( 94) = ( 0.3829787 0.3429407 0.1512384), wk = 0.0034483 k( 95) = ( 0.3936170 0.3429407 0.1512384), wk = 0.0034483 k( 96) = ( 0.4042553 0.3429407 0.1512384), wk = 0.0034483 k( 97) = ( 0.4148936 0.3429407 0.1512384), wk = 0.0034483 k( 98) = ( 0.4255319 0.3429407 0.1512384), wk = 0.0034483 k( 99) = ( 0.4361702 0.3429407 0.1512384), wk = 0.0034483 k( 100) = ( 0.4468085 0.3429407 0.1512384), wk = 0.0034483 k( 101) = ( 0.4574468 0.3429407 0.1512384), wk = 0.0034483 k( 102) = ( 0.4680851 0.3429407 0.1512384), wk = 0.0034483 k( 103) = ( 0.4787234 0.3429407 0.1512384), wk = 0.0034483 k( 104) = ( 0.4893617 0.3429407 0.1512384), wk = 0.0034483 k( 105) = ( 0.5000000 0.3429407 0.1512384), wk = 0.0034483 k( 106) = ( 0.5000000 0.3429407 0.1512384), wk = 0.0034483 k( 107) = ( 0.5000000 0.3468262 0.1424277), wk = 0.0034483 k( 108) = ( 0.5000000 0.3507118 0.1336170), wk = 0.0034483 k( 109) = ( 0.5000000 0.3545973 0.1248063), wk = 0.0034483 k( 110) = ( 0.5000000 0.3584829 0.1159957), wk = 0.0034483 k( 111) = ( 0.5000000 0.3623684 0.1071850), wk = 0.0034483 k( 112) = ( 0.5000000 0.3623684 0.1071850), wk = 0.0034483 k( 113) = ( 0.5000000 0.3610733 0.0971024), wk = 0.0034483 k( 114) = ( 0.5000000 0.3597781 0.0870199), wk = 0.0034483 k( 115) = ( 0.5000000 0.3584829 0.0769373), wk = 0.0034483 k( 116) = ( 0.5000000 0.3571877 0.0668548), wk = 0.0034483 k( 117) = ( 0.5000000 0.3558925 0.0567722), wk = 0.0034483 k( 118) = ( 0.5000000 0.3545973 0.0466896), wk = 0.0034483 k( 119) = ( 0.5000000 0.3533022 0.0366071), wk = 0.0034483 k( 120) = ( 0.5000000 0.3520070 0.0265245), wk = 0.0034483 k( 121) = ( 0.5000000 0.3507118 0.0164420), wk = 0.0034483 k( 122) = ( 0.5000000 0.3494166 0.0063594), wk = 0.0034483 k( 123) = ( 0.5000000 0.3481214 -0.0037232), wk = 0.0034483 k( 124) = ( 0.5000000 0.3468262 -0.0138057), wk = 0.0034483 k( 125) = ( 0.5000000 0.3455311 -0.0238883), wk = 0.0034483 k( 126) = ( 0.5000000 0.3442359 -0.0339708), wk = 0.0034483 k( 127) = ( 0.5000000 0.3429407 -0.0440534), wk = 0.0034483 k( 128) = ( 0.5000000 0.3429407 -0.0440534), wk = 0.0034483 k( 129) = ( 0.4893617 0.3429407 -0.0440534), wk = 0.0034483 k( 130) = ( 0.4787234 0.3429407 -0.0440534), wk = 0.0034483 k( 131) = ( 0.4680851 0.3429407 -0.0440534), wk = 0.0034483 k( 132) = ( 0.4574468 0.3429407 -0.0440534), wk = 0.0034483 k( 133) = ( 0.4468085 0.3429407 -0.0440534), wk = 0.0034483 k( 134) = ( 0.4361702 0.3429407 -0.0440534), wk = 0.0034483 k( 135) = ( 0.4255319 0.3429407 -0.0440534), wk = 0.0034483 k( 136) = ( 0.4148936 0.3429407 -0.0440534), wk = 0.0034483 k( 137) = ( 0.4042553 0.3429407 -0.0440534), wk = 0.0034483 k( 138) = ( 0.3936170 0.3429407 -0.0440534), wk = 0.0034483 k( 139) = ( 0.3829787 0.3429407 -0.0440534), wk = 0.0034483 k( 140) = ( 0.3723404 0.3429407 -0.0440534), wk = 0.0034483 k( 141) = ( 0.3617021 0.3429407 -0.0440534), wk = 0.0034483 k( 142) = ( 0.3510638 0.3429407 -0.0440534), wk = 0.0034483 k( 143) = ( 0.3404255 0.3429407 -0.0440534), wk = 0.0034483 k( 144) = ( 0.3297872 0.3429407 -0.0440534), wk = 0.0034483 k( 145) = ( 0.3191489 0.3429407 -0.0440534), wk = 0.0034483 k( 146) = ( 0.3085106 0.3429407 -0.0440534), wk = 0.0034483 k( 147) = ( 0.2978723 0.3429407 -0.0440534), wk = 0.0034483 k( 148) = ( 0.2872340 0.3429407 -0.0440534), wk = 0.0034483 k( 149) = ( 0.2765957 0.3429407 -0.0440534), wk = 0.0034483 k( 150) = ( 0.2659574 0.3429407 -0.0440534), wk = 0.0034483 k( 151) = ( 0.2553191 0.3429407 -0.0440534), wk = 0.0034483 k( 152) = ( 0.2446809 0.3429407 -0.0440534), wk = 0.0034483 k( 153) = ( 0.2340425 0.3429407 -0.0440534), wk = 0.0034483 k( 154) = ( 0.2234043 0.3429407 -0.0440534), wk = 0.0034483 k( 155) = ( 0.2127660 0.3429407 -0.0440534), wk = 0.0034483 k( 156) = ( 0.2021277 0.3429407 -0.0440534), wk = 0.0034483 k( 157) = ( 0.1914894 0.3429407 -0.0440534), wk = 0.0034483 k( 158) = ( 0.1808511 0.3429407 -0.0440534), wk = 0.0034483 k( 159) = ( 0.1702128 0.3429407 -0.0440534), wk = 0.0034483 k( 160) = ( 0.1595745 0.3429407 -0.0440534), wk = 0.0034483 k( 161) = ( 0.1489362 0.3429407 -0.0440534), wk = 0.0034483 k( 162) = ( 0.1382979 0.3429407 -0.0440534), wk = 0.0034483 k( 163) = ( 0.1276596 0.3429407 -0.0440534), wk = 0.0034483 k( 164) = ( 0.1170213 0.3429407 -0.0440534), wk = 0.0034483 k( 165) = ( 0.1063830 0.3429407 -0.0440534), wk = 0.0034483 k( 166) = ( 0.0957447 0.3429407 -0.0440534), wk = 0.0034483 k( 167) = ( 0.0851064 0.3429407 -0.0440534), wk = 0.0034483 k( 168) = ( 0.0744681 0.3429407 -0.0440534), wk = 0.0034483 k( 169) = ( 0.0638298 0.3429407 -0.0440534), wk = 0.0034483 k( 170) = ( 0.0531915 0.3429407 -0.0440534), wk = 0.0034483 k( 171) = ( 0.0425532 0.3429407 -0.0440534), wk = 0.0034483 k( 172) = ( 0.0319149 0.3429407 -0.0440534), wk = 0.0034483 k( 173) = ( 0.0212766 0.3429407 -0.0440534), wk = 0.0034483 k( 174) = ( 0.0106383 0.3429407 -0.0440534), wk = 0.0034483 k( 175) = ( 0.0000000 0.3429407 -0.0440534), wk = 0.0034483 k( 176) = ( 0.0000000 0.3429407 -0.0440534), wk = 0.0034483 k( 177) = ( 0.0000000 0.3442359 -0.0339708), wk = 0.0034483 k( 178) = ( 0.0000000 0.3455311 -0.0238883), wk = 0.0034483 k( 179) = ( 0.0000000 0.3468262 -0.0138057), wk = 0.0034483 k( 180) = ( 0.0000000 0.3481214 -0.0037232), wk = 0.0034483 k( 181) = ( 0.0000000 0.3494166 0.0063594), wk = 0.0034483 k( 182) = ( 0.0000000 0.3507118 0.0164420), wk = 0.0034483 k( 183) = ( 0.0000000 0.3520070 0.0265245), wk = 0.0034483 k( 184) = ( 0.0000000 0.3533022 0.0366071), wk = 0.0034483 k( 185) = ( 0.0000000 0.3545973 0.0466896), wk = 0.0034483 k( 186) = ( 0.0000000 0.3558925 0.0567722), wk = 0.0034483 k( 187) = ( 0.0000000 0.3571877 0.0668548), wk = 0.0034483 k( 188) = ( 0.0000000 0.3584829 0.0769373), wk = 0.0034483 k( 189) = ( 0.0000000 0.3597781 0.0870199), wk = 0.0034483 k( 190) = ( 0.0000000 0.3610733 0.0971024), wk = 0.0034483 k( 191) = ( 0.0000000 0.3623684 0.1071850), wk = 0.0034483 k( 192) = ( 0.5000000 0.3235130 0.1952918), wk = 0.0034483 k( 193) = ( 0.5000000 0.3127292 0.1952918), wk = 0.0034483 k( 194) = ( 0.5000000 0.3019454 0.1952918), wk = 0.0034483 k( 195) = ( 0.5000000 0.2911617 0.1952918), wk = 0.0034483 k( 196) = ( 0.5000000 0.2803779 0.1952918), wk = 0.0034483 k( 197) = ( 0.5000000 0.2695941 0.1952918), wk = 0.0034483 k( 198) = ( 0.5000000 0.2588104 0.1952918), wk = 0.0034483 k( 199) = ( 0.5000000 0.2480266 0.1952918), wk = 0.0034483 k( 200) = ( 0.5000000 0.2372428 0.1952918), wk = 0.0034483 k( 201) = ( 0.5000000 0.2264591 0.1952918), wk = 0.0034483 k( 202) = ( 0.5000000 0.2156753 0.1952918), wk = 0.0034483 k( 203) = ( 0.5000000 0.2048915 0.1952918), wk = 0.0034483 k( 204) = ( 0.5000000 0.1941078 0.1952918), wk = 0.0034483 k( 205) = ( 0.5000000 0.1833240 0.1952918), wk = 0.0034483 k( 206) = ( 0.5000000 0.1725402 0.1952918), wk = 0.0034483 k( 207) = ( 0.5000000 0.1617565 0.1952918), wk = 0.0034483 k( 208) = ( 0.5000000 0.1509727 0.1952918), wk = 0.0034483 k( 209) = ( 0.5000000 0.1401889 0.1952918), wk = 0.0034483 k( 210) = ( 0.5000000 0.1294052 0.1952918), wk = 0.0034483 k( 211) = ( 0.5000000 0.1186214 0.1952918), wk = 0.0034483 k( 212) = ( 0.5000000 0.1078377 0.1952918), wk = 0.0034483 k( 213) = ( 0.5000000 0.0970539 0.1952918), wk = 0.0034483 k( 214) = ( 0.5000000 0.0862701 0.1952918), wk = 0.0034483 k( 215) = ( 0.5000000 0.0754864 0.1952918), wk = 0.0034483 k( 216) = ( 0.5000000 0.0647026 0.1952918), wk = 0.0034483 k( 217) = ( 0.5000000 0.0539188 0.1952918), wk = 0.0034483 k( 218) = ( 0.5000000 0.0431351 0.1952918), wk = 0.0034483 k( 219) = ( 0.5000000 0.0323513 0.1952918), wk = 0.0034483 k( 220) = ( 0.5000000 0.0215675 0.1952918), wk = 0.0034483 k( 221) = ( 0.5000000 0.0107838 0.1952918), wk = 0.0034483 k( 222) = ( 0.5000000 -0.0000000 0.1952918), wk = 0.0034483 k( 223) = ( 0.5000000 -0.0000000 0.1952918), wk = 0.0034483 k( 224) = ( 0.5000000 -0.0000000 0.1850133), wk = 0.0034483 k( 225) = ( 0.5000000 -0.0000000 0.1747348), wk = 0.0034483 k( 226) = ( 0.5000000 -0.0000000 0.1644562), wk = 0.0034483 k( 227) = ( 0.5000000 -0.0000000 0.1541777), wk = 0.0034483 k( 228) = ( 0.5000000 -0.0000000 0.1438992), wk = 0.0034483 k( 229) = ( 0.5000000 -0.0000000 0.1336207), wk = 0.0034483 k( 230) = ( 0.5000000 -0.0000000 0.1233422), wk = 0.0034483 k( 231) = ( 0.5000000 -0.0000000 0.1130637), wk = 0.0034483 k( 232) = ( 0.5000000 -0.0000000 0.1027851), wk = 0.0034483 k( 233) = ( 0.5000000 -0.0000000 0.0925066), wk = 0.0034483 k( 234) = ( 0.5000000 -0.0000000 0.0822281), wk = 0.0034483 k( 235) = ( 0.5000000 -0.0000000 0.0719496), wk = 0.0034483 k( 236) = ( 0.5000000 -0.0000000 0.0616711), wk = 0.0034483 k( 237) = ( 0.5000000 -0.0000000 0.0513926), wk = 0.0034483 k( 238) = ( 0.5000000 -0.0000000 0.0411141), wk = 0.0034483 k( 239) = ( 0.5000000 -0.0000000 0.0308355), wk = 0.0034483 k( 240) = ( 0.5000000 -0.0000000 0.0205570), wk = 0.0034483 k( 241) = ( 0.5000000 -0.0000000 0.0102785), wk = 0.0034483 k( 242) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0034483 k( 243) = ( 0.0000000 0.0000000 0.1952918), wk = 0.0034483 k( 244) = ( 0.0106383 -0.0000000 0.1952918), wk = 0.0034483 k( 245) = ( 0.0212766 -0.0000000 0.1952918), wk = 0.0034483 k( 246) = ( 0.0319149 -0.0000000 0.1952918), wk = 0.0034483 k( 247) = ( 0.0425532 -0.0000000 0.1952918), wk = 0.0034483 k( 248) = ( 0.0531915 -0.0000000 0.1952918), wk = 0.0034483 k( 249) = ( 0.0638298 -0.0000000 0.1952918), wk = 0.0034483 k( 250) = ( 0.0744681 -0.0000000 0.1952918), wk = 0.0034483 k( 251) = ( 0.0851064 -0.0000000 0.1952918), wk = 0.0034483 k( 252) = ( 0.0957447 -0.0000000 0.1952918), wk = 0.0034483 k( 253) = ( 0.1063830 -0.0000000 0.1952918), wk = 0.0034483 k( 254) = ( 0.1170213 -0.0000000 0.1952918), wk = 0.0034483 k( 255) = ( 0.1276596 -0.0000000 0.1952918), wk = 0.0034483 k( 256) = ( 0.1382979 -0.0000000 0.1952918), wk = 0.0034483 k( 257) = ( 0.1489362 -0.0000000 0.1952918), wk = 0.0034483 k( 258) = ( 0.1595745 -0.0000000 0.1952918), wk = 0.0034483 k( 259) = ( 0.1702128 -0.0000000 0.1952918), wk = 0.0034483 k( 260) = ( 0.1808511 -0.0000000 0.1952918), wk = 0.0034483 k( 261) = ( 0.1914894 -0.0000000 0.1952918), wk = 0.0034483 k( 262) = ( 0.2021277 -0.0000000 0.1952918), wk = 0.0034483 k( 263) = ( 0.2127660 -0.0000000 0.1952918), wk = 0.0034483 k( 264) = ( 0.2234043 -0.0000000 0.1952918), wk = 0.0034483 k( 265) = ( 0.2340425 -0.0000000 0.1952918), wk = 0.0034483 k( 266) = ( 0.2446809 -0.0000000 0.1952918), wk = 0.0034483 k( 267) = ( 0.2553191 -0.0000000 0.1952918), wk = 0.0034483 k( 268) = ( 0.2659574 -0.0000000 0.1952918), wk = 0.0034483 k( 269) = ( 0.2765957 -0.0000000 0.1952918), wk = 0.0034483 k( 270) = ( 0.2872340 -0.0000000 0.1952918), wk = 0.0034483 k( 271) = ( 0.2978723 -0.0000000 0.1952918), wk = 0.0034483 k( 272) = ( 0.3085106 -0.0000000 0.1952918), wk = 0.0034483 k( 273) = ( 0.3191489 -0.0000000 0.1952918), wk = 0.0034483 k( 274) = ( 0.3297872 -0.0000000 0.1952918), wk = 0.0034483 k( 275) = ( 0.3404255 -0.0000000 0.1952918), wk = 0.0034483 k( 276) = ( 0.3510638 -0.0000000 0.1952918), wk = 0.0034483 k( 277) = ( 0.3617021 -0.0000000 0.1952918), wk = 0.0034483 k( 278) = ( 0.3723404 -0.0000000 0.1952918), wk = 0.0034483 k( 279) = ( 0.3829787 -0.0000000 0.1952918), wk = 0.0034483 k( 280) = ( 0.3936170 -0.0000000 0.1952918), wk = 0.0034483 k( 281) = ( 0.4042553 -0.0000000 0.1952918), wk = 0.0034483 k( 282) = ( 0.4148936 -0.0000000 0.1952918), wk = 0.0034483 k( 283) = ( 0.4255319 -0.0000000 0.1952918), wk = 0.0034483 k( 284) = ( 0.4361702 -0.0000000 0.1952918), wk = 0.0034483 k( 285) = ( 0.4468085 -0.0000000 0.1952918), wk = 0.0034483 k( 286) = ( 0.4574468 -0.0000000 0.1952918), wk = 0.0034483 k( 287) = ( 0.4680851 -0.0000000 0.1952918), wk = 0.0034483 k( 288) = ( 0.4787234 -0.0000000 0.1952918), wk = 0.0034483 k( 289) = ( 0.4893617 -0.0000000 0.1952918), wk = 0.0034483 k( 290) = ( 0.5000000 -0.0000000 0.1952918), wk = 0.0034483 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034483 k( 2) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0034483 k( 3) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0034483 k( 4) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0034483 k( 5) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0034483 k( 6) = ( 0.0000000 0.0000000 0.1315789), wk = 0.0034483 k( 7) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0034483 k( 8) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0034483 k( 9) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0034483 k( 10) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0034483 k( 11) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0034483 k( 12) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0034483 k( 13) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0034483 k( 14) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0034483 k( 15) = ( 0.0000000 0.0000000 0.3684210), wk = 0.0034483 k( 16) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0034483 k( 17) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0034483 k( 18) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0034483 k( 19) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0034483 k( 20) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034483 k( 21) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034483 k( 22) = ( 0.0000000 0.0157225 0.5035466), wk = 0.0034483 k( 23) = ( 0.0000000 0.0314450 0.5070933), wk = 0.0034483 k( 24) = ( 0.0000000 0.0471675 0.5106399), wk = 0.0034483 k( 25) = ( 0.0000000 0.0628900 0.5141866), wk = 0.0034483 k( 26) = ( 0.0000000 0.0786125 0.5177332), wk = 0.0034483 k( 27) = ( 0.0000000 0.0943350 0.5212798), wk = 0.0034483 k( 28) = ( 0.0000000 0.1100574 0.5248265), wk = 0.0034483 k( 29) = ( 0.0000000 0.1257799 0.5283731), wk = 0.0034483 k( 30) = ( 0.0000000 0.1415024 0.5319197), wk = 0.0034483 k( 31) = ( 0.0000000 0.1572249 0.5354664), wk = 0.0034483 k( 32) = ( 0.0000000 0.1729474 0.5390130), wk = 0.0034483 k( 33) = ( 0.0000000 0.1886699 0.5425596), wk = 0.0034483 k( 34) = ( 0.0000000 0.2043924 0.5461063), wk = 0.0034483 k( 35) = ( 0.0000000 0.2201149 0.5496529), wk = 0.0034483 k( 36) = ( 0.0000000 0.2358374 0.5531996), wk = 0.0034483 k( 37) = ( 0.0000000 0.2515599 0.5567462), wk = 0.0034483 k( 38) = ( 0.0000000 0.2672824 0.5602928), wk = 0.0034483 k( 39) = ( 0.0000000 0.2830049 0.5638395), wk = 0.0034483 k( 40) = ( 0.0000000 0.2987274 0.5673861), wk = 0.0034483 k( 41) = ( 0.0000000 0.3144498 0.5709327), wk = 0.0034483 k( 42) = ( 0.0000000 0.3301723 0.5744794), wk = 0.0034483 k( 43) = ( 0.0000000 0.3458948 0.5780260), wk = 0.0034483 k( 44) = ( 0.0000000 0.3616173 0.5815727), wk = 0.0034483 k( 45) = ( 0.0000000 0.3773398 0.5851193), wk = 0.0034483 k( 46) = ( 0.0000000 0.3930623 0.5886659), wk = 0.0034483 k( 47) = ( 0.0000000 0.4087848 0.5922126), wk = 0.0034483 k( 48) = ( 0.0000000 0.4245073 0.5957592), wk = 0.0034483 k( 49) = ( 0.0000000 0.4402298 0.5993058), wk = 0.0034483 k( 50) = ( 0.0000000 0.4559523 0.6028525), wk = 0.0034483 k( 51) = ( 0.0000000 0.4716748 0.6063991), wk = 0.0034483 k( 52) = ( 0.0000000 0.4716748 0.6063991), wk = 0.0034483 k( 53) = ( 0.0000000 0.4773398 0.5851193), wk = 0.0034483 k( 54) = ( 0.0000000 0.4830049 0.5638395), wk = 0.0034483 k( 55) = ( 0.0000000 0.4886699 0.5425596), wk = 0.0034483 k( 56) = ( 0.0000000 0.4943350 0.5212798), wk = 0.0034483 k( 57) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0034483 k( 58) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0034483 k( 59) = ( 0.0106383 0.5000000 0.5000000), wk = 0.0034483 k( 60) = ( 0.0212766 0.5000000 0.5000000), wk = 0.0034483 k( 61) = ( 0.0319149 0.5000000 0.5000000), wk = 0.0034483 k( 62) = ( 0.0425532 0.5000000 0.5000000), wk = 0.0034483 k( 63) = ( 0.0531915 0.5000000 0.5000000), wk = 0.0034483 k( 64) = ( 0.0638298 0.5000000 0.5000000), wk = 0.0034483 k( 65) = ( 0.0744681 0.5000000 0.5000000), wk = 0.0034483 k( 66) = ( 0.0851064 0.5000000 0.5000000), wk = 0.0034483 k( 67) = ( 0.0957447 0.5000000 0.5000000), wk = 0.0034483 k( 68) = ( 0.1063830 0.5000000 0.5000000), wk = 0.0034483 k( 69) = ( 0.1170213 0.5000000 0.5000000), wk = 0.0034483 k( 70) = ( 0.1276596 0.5000000 0.5000000), wk = 0.0034483 k( 71) = ( 0.1382979 0.5000000 0.5000000), wk = 0.0034483 k( 72) = ( 0.1489362 0.5000000 0.5000000), wk = 0.0034483 k( 73) = ( 0.1595745 0.5000000 0.5000000), wk = 0.0034483 k( 74) = ( 0.1702128 0.5000000 0.5000000), wk = 0.0034483 k( 75) = ( 0.1808511 0.5000000 0.5000000), wk = 0.0034483 k( 76) = ( 0.1914894 0.5000000 0.5000000), wk = 0.0034483 k( 77) = ( 0.2021277 0.5000000 0.5000000), wk = 0.0034483 k( 78) = ( 0.2127660 0.5000000 0.5000000), wk = 0.0034483 k( 79) = ( 0.2234043 0.5000000 0.5000000), wk = 0.0034483 k( 80) = ( 0.2340425 0.5000000 0.5000000), wk = 0.0034483 k( 81) = ( 0.2446809 0.5000000 0.5000000), wk = 0.0034483 k( 82) = ( 0.2553191 0.5000000 0.5000000), wk = 0.0034483 k( 83) = ( 0.2659574 0.5000000 0.5000000), wk = 0.0034483 k( 84) = ( 0.2765957 0.5000000 0.5000000), wk = 0.0034483 k( 85) = ( 0.2872340 0.5000000 0.5000000), wk = 0.0034483 k( 86) = ( 0.2978723 0.5000000 0.5000000), wk = 0.0034483 k( 87) = ( 0.3085106 0.5000000 0.5000000), wk = 0.0034483 k( 88) = ( 0.3191489 0.5000000 0.5000000), wk = 0.0034483 k( 89) = ( 0.3297872 0.5000000 0.5000000), wk = 0.0034483 k( 90) = ( 0.3404255 0.5000000 0.5000000), wk = 0.0034483 k( 91) = ( 0.3510638 0.5000000 0.5000000), wk = 0.0034483 k( 92) = ( 0.3617021 0.5000000 0.5000000), wk = 0.0034483 k( 93) = ( 0.3723404 0.5000000 0.5000000), wk = 0.0034483 k( 94) = ( 0.3829787 0.5000000 0.5000000), wk = 0.0034483 k( 95) = ( 0.3936170 0.5000000 0.5000000), wk = 0.0034483 k( 96) = ( 0.4042553 0.5000000 0.5000000), wk = 0.0034483 k( 97) = ( 0.4148936 0.5000000 0.5000000), wk = 0.0034483 k( 98) = ( 0.4255319 0.5000000 0.5000000), wk = 0.0034483 k( 99) = ( 0.4361702 0.5000000 0.5000000), wk = 0.0034483 k( 100) = ( 0.4468085 0.5000000 0.5000000), wk = 0.0034483 k( 101) = ( 0.4574468 0.5000000 0.5000000), wk = 0.0034483 k( 102) = ( 0.4680851 0.5000000 0.5000000), wk = 0.0034483 k( 103) = ( 0.4787234 0.5000000 0.5000000), wk = 0.0034483 k( 104) = ( 0.4893617 0.5000000 0.5000000), wk = 0.0034483 k( 105) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034483 k( 106) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0034483 k( 107) = ( 0.5000000 0.5056650 0.4787202), wk = 0.0034483 k( 108) = ( 0.5000000 0.5113301 0.4574403), wk = 0.0034483 k( 109) = ( 0.5000000 0.5169951 0.4361605), wk = 0.0034483 k( 110) = ( 0.5000000 0.5226602 0.4148807), wk = 0.0034483 k( 111) = ( 0.5000000 0.5283252 0.3936009), wk = 0.0034483 k( 112) = ( 0.5000000 0.5283252 0.3936009), wk = 0.0034483 k( 113) = ( 0.5000000 0.5264369 0.3673608), wk = 0.0034483 k( 114) = ( 0.5000000 0.5245485 0.3411207), wk = 0.0034483 k( 115) = ( 0.5000000 0.5226602 0.3148807), wk = 0.0034483 k( 116) = ( 0.5000000 0.5207718 0.2886406), wk = 0.0034483 k( 117) = ( 0.5000000 0.5188835 0.2624006), wk = 0.0034483 k( 118) = ( 0.5000000 0.5169951 0.2361605), wk = 0.0034483 k( 119) = ( 0.5000000 0.5151068 0.2099205), wk = 0.0034483 k( 120) = ( 0.5000000 0.5132184 0.1836804), wk = 0.0034483 k( 121) = ( 0.5000000 0.5113301 0.1574404), wk = 0.0034483 k( 122) = ( 0.5000000 0.5094417 0.1312003), wk = 0.0034483 k( 123) = ( 0.5000000 0.5075534 0.1049602), wk = 0.0034483 k( 124) = ( 0.5000000 0.5056650 0.0787202), wk = 0.0034483 k( 125) = ( 0.5000000 0.5037767 0.0524801), wk = 0.0034483 k( 126) = ( 0.5000000 0.5018883 0.0262401), wk = 0.0034483 k( 127) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0034483 k( 128) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0034483 k( 129) = ( 0.4893617 0.5000000 0.0000000), wk = 0.0034483 k( 130) = ( 0.4787234 0.5000000 0.0000000), wk = 0.0034483 k( 131) = ( 0.4680851 0.5000000 0.0000000), wk = 0.0034483 k( 132) = ( 0.4574468 0.5000000 0.0000000), wk = 0.0034483 k( 133) = ( 0.4468085 0.5000000 -0.0000000), wk = 0.0034483 k( 134) = ( 0.4361702 0.5000000 -0.0000000), wk = 0.0034483 k( 135) = ( 0.4255319 0.5000000 0.0000000), wk = 0.0034483 k( 136) = ( 0.4148936 0.5000000 0.0000000), wk = 0.0034483 k( 137) = ( 0.4042553 0.5000000 0.0000000), wk = 0.0034483 k( 138) = ( 0.3936170 0.5000000 -0.0000000), wk = 0.0034483 k( 139) = ( 0.3829787 0.5000000 -0.0000000), wk = 0.0034483 k( 140) = ( 0.3723404 0.5000000 -0.0000000), wk = 0.0034483 k( 141) = ( 0.3617021 0.5000000 -0.0000000), wk = 0.0034483 k( 142) = ( 0.3510638 0.5000000 0.0000000), wk = 0.0034483 k( 143) = ( 0.3404255 0.5000000 -0.0000000), wk = 0.0034483 k( 144) = ( 0.3297872 0.5000000 -0.0000000), wk = 0.0034483 k( 145) = ( 0.3191489 0.5000000 -0.0000000), wk = 0.0034483 k( 146) = ( 0.3085106 0.5000000 -0.0000000), wk = 0.0034483 k( 147) = ( 0.2978723 0.5000000 -0.0000000), wk = 0.0034483 k( 148) = ( 0.2872340 0.5000000 -0.0000000), wk = 0.0034483 k( 149) = ( 0.2765957 0.5000000 0.0000000), wk = 0.0034483 k( 150) = ( 0.2659574 0.5000000 0.0000000), wk = 0.0034483 k( 151) = ( 0.2553191 0.5000000 0.0000000), wk = 0.0034483 k( 152) = ( 0.2446809 0.5000000 0.0000000), wk = 0.0034483 k( 153) = ( 0.2340425 0.5000000 0.0000000), wk = 0.0034483 k( 154) = ( 0.2234043 0.5000000 0.0000000), wk = 0.0034483 k( 155) = ( 0.2127660 0.5000000 0.0000000), wk = 0.0034483 k( 156) = ( 0.2021277 0.5000000 0.0000000), wk = 0.0034483 k( 157) = ( 0.1914894 0.5000000 0.0000000), wk = 0.0034483 k( 158) = ( 0.1808511 0.5000000 0.0000000), wk = 0.0034483 k( 159) = ( 0.1702128 0.5000000 0.0000000), wk = 0.0034483 k( 160) = ( 0.1595745 0.5000000 0.0000000), wk = 0.0034483 k( 161) = ( 0.1489362 0.5000000 0.0000000), wk = 0.0034483 k( 162) = ( 0.1382979 0.5000000 0.0000000), wk = 0.0034483 k( 163) = ( 0.1276596 0.5000000 0.0000000), wk = 0.0034483 k( 164) = ( 0.1170213 0.5000000 0.0000000), wk = 0.0034483 k( 165) = ( 0.1063830 0.5000000 0.0000000), wk = 0.0034483 k( 166) = ( 0.0957447 0.5000000 0.0000000), wk = 0.0034483 k( 167) = ( 0.0851064 0.5000000 0.0000000), wk = 0.0034483 k( 168) = ( 0.0744681 0.5000000 0.0000000), wk = 0.0034483 k( 169) = ( 0.0638298 0.5000000 0.0000000), wk = 0.0034483 k( 170) = ( 0.0531915 0.5000000 0.0000000), wk = 0.0034483 k( 171) = ( 0.0425532 0.5000000 0.0000000), wk = 0.0034483 k( 172) = ( 0.0319149 0.5000000 0.0000000), wk = 0.0034483 k( 173) = ( 0.0212766 0.5000000 0.0000000), wk = 0.0034483 k( 174) = ( 0.0106383 0.5000000 0.0000000), wk = 0.0034483 k( 175) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0034483 k( 176) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0034483 k( 177) = ( 0.0000000 0.5018883 0.0262401), wk = 0.0034483 k( 178) = ( 0.0000000 0.5037767 0.0524801), wk = 0.0034483 k( 179) = ( 0.0000000 0.5056650 0.0787202), wk = 0.0034483 k( 180) = ( 0.0000000 0.5075534 0.1049602), wk = 0.0034483 k( 181) = ( 0.0000000 0.5094417 0.1312003), wk = 0.0034483 k( 182) = ( 0.0000000 0.5113301 0.1574404), wk = 0.0034483 k( 183) = ( 0.0000000 0.5132184 0.1836804), wk = 0.0034483 k( 184) = ( 0.0000000 0.5151068 0.2099205), wk = 0.0034483 k( 185) = ( 0.0000000 0.5169951 0.2361605), wk = 0.0034483 k( 186) = ( 0.0000000 0.5188835 0.2624006), wk = 0.0034483 k( 187) = ( 0.0000000 0.5207718 0.2886406), wk = 0.0034483 k( 188) = ( 0.0000000 0.5226602 0.3148807), wk = 0.0034483 k( 189) = ( 0.0000000 0.5245485 0.3411207), wk = 0.0034483 k( 190) = ( 0.0000000 0.5264369 0.3673608), wk = 0.0034483 k( 191) = ( 0.0000000 0.5283252 0.3936009), wk = 0.0034483 k( 192) = ( 0.5000000 0.4716748 0.6063991), wk = 0.0034483 k( 193) = ( 0.5000000 0.4559523 0.6028525), wk = 0.0034483 k( 194) = ( 0.5000000 0.4402298 0.5993059), wk = 0.0034483 k( 195) = ( 0.5000000 0.4245073 0.5957592), wk = 0.0034483 k( 196) = ( 0.5000000 0.4087848 0.5922126), wk = 0.0034483 k( 197) = ( 0.5000000 0.3930623 0.5886659), wk = 0.0034483 k( 198) = ( 0.5000000 0.3773398 0.5851193), wk = 0.0034483 k( 199) = ( 0.5000000 0.3616173 0.5815727), wk = 0.0034483 k( 200) = ( 0.5000000 0.3458948 0.5780260), wk = 0.0034483 k( 201) = ( 0.5000000 0.3301723 0.5744794), wk = 0.0034483 k( 202) = ( 0.5000000 0.3144498 0.5709327), wk = 0.0034483 k( 203) = ( 0.5000000 0.2987274 0.5673861), wk = 0.0034483 k( 204) = ( 0.5000000 0.2830049 0.5638395), wk = 0.0034483 k( 205) = ( 0.5000000 0.2672824 0.5602928), wk = 0.0034483 k( 206) = ( 0.5000000 0.2515599 0.5567462), wk = 0.0034483 k( 207) = ( 0.5000000 0.2358374 0.5531996), wk = 0.0034483 k( 208) = ( 0.5000000 0.2201149 0.5496529), wk = 0.0034483 k( 209) = ( 0.5000000 0.2043924 0.5461063), wk = 0.0034483 k( 210) = ( 0.5000000 0.1886699 0.5425596), wk = 0.0034483 k( 211) = ( 0.5000000 0.1729474 0.5390130), wk = 0.0034483 k( 212) = ( 0.5000000 0.1572249 0.5354664), wk = 0.0034483 k( 213) = ( 0.5000000 0.1415024 0.5319197), wk = 0.0034483 k( 214) = ( 0.5000000 0.1257799 0.5283731), wk = 0.0034483 k( 215) = ( 0.5000000 0.1100574 0.5248265), wk = 0.0034483 k( 216) = ( 0.5000000 0.0943350 0.5212798), wk = 0.0034483 k( 217) = ( 0.5000000 0.0786125 0.5177332), wk = 0.0034483 k( 218) = ( 0.5000000 0.0628900 0.5141865), wk = 0.0034483 k( 219) = ( 0.5000000 0.0471675 0.5106399), wk = 0.0034483 k( 220) = ( 0.5000000 0.0314450 0.5070933), wk = 0.0034483 k( 221) = ( 0.5000000 0.0157225 0.5035466), wk = 0.0034483 k( 222) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0034483 k( 223) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0034483 k( 224) = ( 0.5000000 0.0000000 0.4736842), wk = 0.0034483 k( 225) = ( 0.5000000 0.0000000 0.4473684), wk = 0.0034483 k( 226) = ( 0.5000000 0.0000000 0.4210526), wk = 0.0034483 k( 227) = ( 0.5000000 0.0000000 0.3947368), wk = 0.0034483 k( 228) = ( 0.5000000 0.0000000 0.3684211), wk = 0.0034483 k( 229) = ( 0.5000000 0.0000000 0.3421053), wk = 0.0034483 k( 230) = ( 0.5000000 0.0000000 0.3157895), wk = 0.0034483 k( 231) = ( 0.5000000 0.0000000 0.2894737), wk = 0.0034483 k( 232) = ( 0.5000000 0.0000000 0.2631579), wk = 0.0034483 k( 233) = ( 0.5000000 0.0000000 0.2368421), wk = 0.0034483 k( 234) = ( 0.5000000 0.0000000 0.2105263), wk = 0.0034483 k( 235) = ( 0.5000000 0.0000000 0.1842105), wk = 0.0034483 k( 236) = ( 0.5000000 0.0000000 0.1578947), wk = 0.0034483 k( 237) = ( 0.5000000 0.0000000 0.1315790), wk = 0.0034483 k( 238) = ( 0.5000000 0.0000000 0.1052632), wk = 0.0034483 k( 239) = ( 0.5000000 0.0000000 0.0789474), wk = 0.0034483 k( 240) = ( 0.5000000 0.0000000 0.0526316), wk = 0.0034483 k( 241) = ( 0.5000000 0.0000000 0.0263158), wk = 0.0034483 k( 242) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0034483 k( 243) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034483 k( 244) = ( 0.0106383 0.0000000 0.5000000), wk = 0.0034483 k( 245) = ( 0.0212766 0.0000000 0.5000000), wk = 0.0034483 k( 246) = ( 0.0319149 0.0000000 0.5000000), wk = 0.0034483 k( 247) = ( 0.0425532 0.0000000 0.5000000), wk = 0.0034483 k( 248) = ( 0.0531915 0.0000000 0.5000000), wk = 0.0034483 k( 249) = ( 0.0638298 0.0000000 0.5000000), wk = 0.0034483 k( 250) = ( 0.0744681 0.0000000 0.5000000), wk = 0.0034483 k( 251) = ( 0.0851064 0.0000000 0.5000000), wk = 0.0034483 k( 252) = ( 0.0957447 0.0000000 0.5000000), wk = 0.0034483 k( 253) = ( 0.1063830 0.0000000 0.5000000), wk = 0.0034483 k( 254) = ( 0.1170213 0.0000000 0.5000000), wk = 0.0034483 k( 255) = ( 0.1276596 0.0000000 0.5000000), wk = 0.0034483 k( 256) = ( 0.1382979 0.0000000 0.5000000), wk = 0.0034483 k( 257) = ( 0.1489362 0.0000000 0.5000000), wk = 0.0034483 k( 258) = ( 0.1595745 0.0000000 0.5000000), wk = 0.0034483 k( 259) = ( 0.1702128 0.0000000 0.5000000), wk = 0.0034483 k( 260) = ( 0.1808511 0.0000000 0.5000000), wk = 0.0034483 k( 261) = ( 0.1914894 0.0000000 0.5000000), wk = 0.0034483 k( 262) = ( 0.2021277 0.0000000 0.5000000), wk = 0.0034483 k( 263) = ( 0.2127660 0.0000000 0.5000000), wk = 0.0034483 k( 264) = ( 0.2234043 0.0000000 0.5000000), wk = 0.0034483 k( 265) = ( 0.2340425 0.0000000 0.5000000), wk = 0.0034483 k( 266) = ( 0.2446809 0.0000000 0.5000000), wk = 0.0034483 k( 267) = ( 0.2553191 0.0000000 0.5000000), wk = 0.0034483 k( 268) = ( 0.2659574 0.0000000 0.5000000), wk = 0.0034483 k( 269) = ( 0.2765957 0.0000000 0.5000000), wk = 0.0034483 k( 270) = ( 0.2872340 0.0000000 0.5000000), wk = 0.0034483 k( 271) = ( 0.2978723 0.0000000 0.5000000), wk = 0.0034483 k( 272) = ( 0.3085106 0.0000000 0.5000000), wk = 0.0034483 k( 273) = ( 0.3191489 0.0000000 0.5000000), wk = 0.0034483 k( 274) = ( 0.3297872 0.0000000 0.5000000), wk = 0.0034483 k( 275) = ( 0.3404255 0.0000000 0.5000000), wk = 0.0034483 k( 276) = ( 0.3510638 0.0000000 0.5000000), wk = 0.0034483 k( 277) = ( 0.3617021 0.0000000 0.5000000), wk = 0.0034483 k( 278) = ( 0.3723404 0.0000000 0.5000000), wk = 0.0034483 k( 279) = ( 0.3829787 0.0000000 0.5000000), wk = 0.0034483 k( 280) = ( 0.3936170 0.0000000 0.5000000), wk = 0.0034483 k( 281) = ( 0.4042553 0.0000000 0.5000000), wk = 0.0034483 k( 282) = ( 0.4148936 0.0000000 0.5000000), wk = 0.0034483 k( 283) = ( 0.4255319 0.0000000 0.5000000), wk = 0.0034483 k( 284) = ( 0.4361702 0.0000000 0.5000000), wk = 0.0034483 k( 285) = ( 0.4468085 0.0000000 0.5000000), wk = 0.0034483 k( 286) = ( 0.4574468 0.0000000 0.5000000), wk = 0.0034483 k( 287) = ( 0.4680851 0.0000000 0.5000000), wk = 0.0034483 k( 288) = ( 0.4787234 0.0000000 0.5000000), wk = 0.0034483 k( 289) = ( 0.4893617 0.0000000 0.5000000), wk = 0.0034483 k( 290) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0034483 Dense grid: 95771 G-vectors FFT dimensions: ( 40, 54, 96) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.79 Mb ( 718, 72) NL pseudopotentials 1.49 Mb ( 359, 272) Each V/rho on FFT grid 0.10 Mb ( 6480) Each G-vector array 0.02 Mb ( 2656) G-vector shells 0.02 Mb ( 2565) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.16 Mb ( 718, 288) Each subspace H/S matrix 0.08 Mb ( 72, 72) Each matrix 0.60 Mb ( 272, 2, 72) The potential is recalculated from file : ./TiS3.save/charge-density.dat Starting wfc are 48 randomized atomic wfcs + 24 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.0 secs Computing kpt #: 2 total cpu time spent up to now is 6.3 secs Computing kpt #: 3 total cpu time spent up to now is 8.6 secs Computing kpt #: 4 total cpu time spent up to now is 11.0 secs Computing kpt #: 5 total cpu time spent up to now is 13.2 secs Computing kpt #: 6 total cpu time spent up to now is 15.6 secs Computing kpt #: 7 total cpu time spent up to now is 17.9 secs Computing kpt #: 8 total cpu time spent up to now is 20.2 secs Computing kpt #: 9 total cpu time spent up to now is 22.5 secs Computing kpt #: 10 total cpu time spent up to now is 24.8 secs Computing kpt #: 11 total cpu time spent up to now is 27.0 secs Computing kpt #: 12 total cpu time spent up to now is 29.3 secs Computing kpt #: 13 total cpu time spent up to now is 31.5 secs Computing kpt #: 14 total cpu time spent up to now is 33.8 secs Computing kpt #: 15 total cpu time spent up to now is 36.0 secs Computing kpt #: 16 total cpu time spent up to now is 38.3 secs Computing kpt #: 17 total cpu time spent up to now is 40.5 secs Computing kpt #: 18 total cpu time spent up to now is 42.7 secs Computing kpt #: 19 total cpu time spent up to now is 45.1 secs Computing kpt #: 20 total cpu time spent up to now is 47.3 secs Computing kpt #: 21 total cpu time spent up to now is 49.6 secs Computing kpt #: 22 total cpu time spent up to now is 51.9 secs Computing kpt #: 23 total cpu time spent up to now is 54.2 secs Computing kpt #: 24 total cpu time spent up to now is 56.5 secs Computing kpt #: 25 total cpu time spent up to now is 58.7 secs Computing kpt #: 26 total cpu time spent up to now is 60.9 secs Computing kpt #: 27 total cpu time spent up to now is 63.1 secs Computing kpt #: 28 total cpu time spent up to now is 65.4 secs Computing kpt #: 29 total cpu time spent up to now is 67.6 secs Computing kpt #: 30 total cpu time spent up to now is 69.8 secs Computing kpt #: 31 total cpu time spent up to now is 72.0 secs Computing kpt #: 32 total cpu time spent up to now is 74.3 secs Computing kpt #: 33 total cpu time spent up to now is 76.5 secs Computing kpt #: 34 total cpu time spent up to now is 78.7 secs Computing kpt #: 35 total cpu time spent up to now is 81.0 secs Computing kpt #: 36 total cpu time spent up to now is 83.2 secs Computing kpt #: 37 total cpu time spent up to now is 85.6 secs Computing kpt #: 38 total cpu time spent up to now is 88.0 secs Computing kpt #: 39 total cpu time spent up to now is 90.4 secs Computing kpt #: 40 total cpu time spent up to now is 92.8 secs Computing kpt #: 41 total cpu time spent up to now is 95.1 secs Computing kpt #: 42 total cpu time spent up to now is 97.5 secs Computing kpt #: 43 total cpu time spent up to now is 99.8 secs Computing kpt #: 44 total cpu time spent up to now is 102.1 secs Computing kpt #: 45 total cpu time spent up to now is 104.5 secs Computing kpt #: 46 total cpu time spent up to now is 107.0 secs Computing kpt #: 47 total cpu time spent up to now is 109.4 secs Computing kpt #: 48 total cpu time spent up to now is 111.7 secs Computing kpt #: 49 total cpu time spent up to now is 114.1 secs Computing kpt #: 50 total cpu time spent up to now is 116.4 secs Computing kpt #: 51 total cpu time spent up to now is 118.7 secs Computing kpt #: 52 total cpu time spent up to now is 121.0 secs Computing kpt #: 53 total cpu time spent up to now is 123.3 secs Computing kpt #: 54 total cpu time spent up to now is 125.7 secs Computing kpt #: 55 total cpu time spent up to now is 127.9 secs Computing kpt #: 56 total cpu time spent up to now is 130.3 secs Computing kpt #: 57 total cpu time spent up to now is 132.6 secs Computing kpt #: 58 total cpu time spent up to now is 134.9 secs Computing kpt #: 59 total cpu time spent up to now is 137.2 secs Computing kpt #: 60 total cpu time spent up to now is 140.1 secs Computing kpt #: 61 total cpu time spent up to now is 142.4 secs Computing kpt #: 62 total cpu time spent up to now is 144.8 secs Computing kpt #: 63 total cpu time spent up to now is 147.1 secs Computing kpt #: 64 total cpu time spent up to now is 149.4 secs Computing kpt #: 65 total cpu time spent up to now is 151.7 secs Computing kpt #: 66 total cpu time spent up to now is 154.0 secs Computing kpt #: 67 total cpu time spent up to now is 156.4 secs Computing kpt #: 68 total cpu time spent up to now is 158.7 secs Computing kpt #: 69 total cpu time spent up to now is 161.0 secs Computing kpt #: 70 total cpu time spent up to now is 163.3 secs Computing kpt #: 71 total cpu time spent up to now is 165.7 secs Computing kpt #: 72 total cpu time spent up to now is 168.0 secs Computing kpt #: 73 total cpu time spent up to now is 170.3 secs Computing kpt #: 74 total cpu time spent up to now is 172.6 secs Computing kpt #: 75 total cpu time spent up to now is 174.9 secs Computing kpt #: 76 total cpu time spent up to now is 177.2 secs Computing kpt #: 77 total cpu time spent up to now is 179.6 secs Computing kpt #: 78 total cpu time spent up to now is 181.9 secs Computing kpt #: 79 total cpu time spent up to now is 184.2 secs Computing kpt #: 80 total cpu time spent up to now is 186.5 secs Computing kpt #: 81 total cpu time spent up to now is 188.9 secs Computing kpt #: 82 total cpu time spent up to now is 191.2 secs Computing kpt #: 83 total cpu time spent up to now is 193.5 secs Computing kpt #: 84 total cpu time spent up to now is 195.9 secs Computing kpt #: 85 total cpu time spent up to now is 198.2 secs Computing kpt #: 86 total cpu time spent up to now is 200.6 secs Computing kpt #: 87 total cpu time spent up to now is 203.0 secs Computing kpt #: 88 total cpu time spent up to now is 205.3 secs Computing kpt #: 89 total cpu time spent up to now is 207.7 secs Computing kpt #: 90 total cpu time spent up to now is 210.1 secs Computing kpt #: 91 total cpu time spent up to now is 212.5 secs Computing kpt #: 92 total cpu time spent up to now is 214.8 secs Computing kpt #: 93 total cpu time spent up to now is 217.2 secs Computing kpt #: 94 total cpu time spent up to now is 219.6 secs Computing kpt #: 95 total cpu time spent up to now is 222.0 secs Computing kpt #: 96 total cpu time spent up to now is 224.5 secs Computing kpt #: 97 total cpu time spent up to now is 226.9 secs Computing kpt #: 98 total cpu time spent up to now is 229.2 secs Computing kpt #: 99 total cpu time spent up to now is 231.6 secs Computing kpt #: 100 total cpu time spent up to now is 233.9 secs Computing kpt #: 101 total cpu time spent up to now is 236.2 secs Computing kpt #: 102 total cpu time spent up to now is 238.5 secs Computing kpt #: 103 total cpu time spent up to now is 240.8 secs Computing kpt #: 104 total cpu time spent up to now is 243.0 secs Computing kpt #: 105 total cpu time spent up to now is 245.3 secs Computing kpt #: 106 total cpu time spent up to now is 247.5 secs Computing kpt #: 107 total cpu time spent up to now is 249.8 secs Computing kpt #: 108 total cpu time spent up to now is 252.0 secs Computing kpt #: 109 total cpu time spent up to now is 254.2 secs Computing kpt #: 110 total cpu time spent up to now is 256.5 secs Computing kpt #: 111 total cpu time spent up to now is 258.8 secs Computing kpt #: 112 total cpu time spent up to now is 261.1 secs Computing kpt #: 113 total cpu time spent up to now is 263.4 secs Computing kpt #: 114 total cpu time spent up to now is 265.7 secs Computing kpt #: 115 total cpu time spent up to now is 268.0 secs Computing kpt #: 116 total cpu time spent up to now is 270.3 secs Computing kpt #: 117 total cpu time spent up to now is 272.6 secs Computing kpt #: 118 total cpu time spent up to now is 274.9 secs Computing kpt #: 119 total cpu time spent up to now is 277.2 secs Computing kpt #: 120 total cpu time spent up to now is 279.6 secs Computing kpt #: 121 total cpu time spent up to now is 281.9 secs Computing kpt #: 122 total cpu time spent up to now is 284.2 secs Computing kpt #: 123 total cpu time spent up to now is 286.5 secs Computing kpt #: 124 total cpu time spent up to now is 288.8 secs Computing kpt #: 125 total cpu time spent up to now is 291.2 secs Computing kpt #: 126 total cpu time spent up to now is 293.5 secs Computing kpt #: 127 total cpu time spent up to now is 295.8 secs Computing kpt #: 128 total cpu time spent up to now is 298.1 secs Computing kpt #: 129 total cpu time spent up to now is 300.5 secs Computing kpt #: 130 total cpu time spent up to now is 302.8 secs Computing kpt #: 131 total cpu time spent up to now is 305.1 secs Computing kpt #: 132 total cpu time spent up to now is 307.5 secs Computing kpt #: 133 total cpu time spent up to now is 309.8 secs Computing kpt #: 134 total cpu time spent up to now is 312.2 secs Computing kpt #: 135 total cpu time spent up to now is 314.6 secs Computing kpt #: 136 total cpu time spent up to now is 317.0 secs Computing kpt #: 137 total cpu time spent up to now is 319.4 secs Computing kpt #: 138 total cpu time spent up to now is 321.8 secs Computing kpt #: 139 total cpu time spent up to now is 324.2 secs Computing kpt #: 140 total cpu time spent up to now is 326.6 secs Computing kpt #: 141 total cpu time spent up to now is 328.9 secs Computing kpt #: 142 total cpu time spent up to now is 331.4 secs Computing kpt #: 143 total cpu time spent up to now is 333.8 secs Computing kpt #: 144 total cpu time spent up to now is 336.1 secs Computing kpt #: 145 total cpu time spent up to now is 338.5 secs Computing kpt #: 146 total cpu time spent up to now is 340.9 secs Computing kpt #: 147 total cpu time spent up to now is 343.3 secs Computing kpt #: 148 total cpu time spent up to now is 345.7 secs Computing kpt #: 149 total cpu time spent up to now is 348.1 secs Computing kpt #: 150 total cpu time spent up to now is 350.4 secs Computing kpt #: 151 total cpu time spent up to now is 352.7 secs Computing kpt #: 152 total cpu time spent up to now is 355.1 secs Computing kpt #: 153 total cpu time spent up to now is 357.4 secs Computing kpt #: 154 total cpu time spent up to now is 359.8 secs Computing kpt #: 155 total cpu time spent up to now is 362.1 secs Computing kpt #: 156 total cpu time spent up to now is 364.4 secs Computing kpt #: 157 total cpu time spent up to now is 366.8 secs Computing kpt #: 158 total cpu time spent up to now is 369.1 secs Computing kpt #: 159 total cpu time spent up to now is 371.5 secs Computing kpt #: 160 total cpu time spent up to now is 373.8 secs Computing kpt #: 161 total cpu time spent up to now is 376.1 secs Computing kpt #: 162 total cpu time spent up to now is 378.4 secs Computing kpt #: 163 total cpu time spent up to now is 380.7 secs Computing kpt #: 164 total cpu time spent up to now is 383.0 secs Computing kpt #: 165 total cpu time spent up to now is 385.3 secs Computing kpt #: 166 total cpu time spent up to now is 387.6 secs Computing kpt #: 167 total cpu time spent up to now is 389.9 secs Computing kpt #: 168 total cpu time spent up to now is 392.2 secs Computing kpt #: 169 total cpu time spent up to now is 394.6 secs Computing kpt #: 170 total cpu time spent up to now is 396.9 secs Computing kpt #: 171 total cpu time spent up to now is 399.2 secs Computing kpt #: 172 total cpu time spent up to now is 401.6 secs Computing kpt #: 173 total cpu time spent up to now is 403.9 secs Computing kpt #: 174 total cpu time spent up to now is 406.2 secs Computing kpt #: 175 total cpu time spent up to now is 408.5 secs Computing kpt #: 176 total cpu time spent up to now is 410.8 secs Computing kpt #: 177 total cpu time spent up to now is 413.2 secs Computing kpt #: 178 total cpu time spent up to now is 415.5 secs Computing kpt #: 179 total cpu time spent up to now is 417.8 secs Computing kpt #: 180 total cpu time spent up to now is 420.1 secs Computing kpt #: 181 total cpu time spent up to now is 422.4 secs Computing kpt #: 182 total cpu time spent up to now is 424.7 secs Computing kpt #: 183 total cpu time spent up to now is 427.1 secs Computing kpt #: 184 total cpu time spent up to now is 429.4 secs Computing kpt #: 185 total cpu time spent up to now is 431.7 secs Computing kpt #: 186 total cpu time spent up to now is 434.0 secs Computing kpt #: 187 total cpu time spent up to now is 436.3 secs Computing kpt #: 188 total cpu time spent up to now is 438.9 secs Computing kpt #: 189 total cpu time spent up to now is 441.4 secs Computing kpt #: 190 total cpu time spent up to now is 443.7 secs Computing kpt #: 191 total cpu time spent up to now is 446.0 secs Computing kpt #: 192 total cpu time spent up to now is 448.3 secs Computing kpt #: 193 total cpu time spent up to now is 450.6 secs Computing kpt #: 194 total cpu time spent up to now is 452.9 secs Computing kpt #: 195 total cpu time spent up to now is 455.3 secs Computing kpt #: 196 total cpu time spent up to now is 457.6 secs Computing kpt #: 197 total cpu time spent up to now is 459.9 secs Computing kpt #: 198 total cpu time spent up to now is 462.3 secs Computing kpt #: 199 total cpu time spent up to now is 464.6 secs Computing kpt #: 200 total cpu time spent up to now is 466.9 secs Computing kpt #: 201 total cpu time spent up to now is 469.2 secs Computing kpt #: 202 total cpu time spent up to now is 471.5 secs Computing kpt #: 203 total cpu time spent up to now is 473.7 secs Computing kpt #: 204 total cpu time spent up to now is 475.9 secs Computing kpt #: 205 total cpu time spent up to now is 478.1 secs Computing kpt #: 206 total cpu time spent up to now is 480.2 secs Computing kpt #: 207 total cpu time spent up to now is 482.4 secs Computing kpt #: 208 total cpu time spent up to now is 484.5 secs Computing kpt #: 209 total cpu time spent up to now is 486.6 secs Computing kpt #: 210 total cpu time spent up to now is 488.6 secs Computing kpt #: 211 total cpu time spent up to now is 490.6 secs Computing kpt #: 212 total cpu time spent up to now is 492.7 secs Computing kpt #: 213 total cpu time spent up to now is 494.8 secs Computing kpt #: 214 total cpu time spent up to now is 496.8 secs Computing kpt #: 215 total cpu time spent up to now is 498.9 secs Computing kpt #: 216 total cpu time spent up to now is 501.0 secs Computing kpt #: 217 total cpu time spent up to now is 503.1 secs Computing kpt #: 218 total cpu time spent up to now is 505.2 secs Computing kpt #: 219 total cpu time spent up to now is 507.3 secs Computing kpt #: 220 total cpu time spent up to now is 509.4 secs Computing kpt #: 221 total cpu time spent up to now is 511.4 secs Computing kpt #: 222 total cpu time spent up to now is 513.5 secs Computing kpt #: 223 total cpu time spent up to now is 515.6 secs Computing kpt #: 224 total cpu time spent up to now is 517.7 secs Computing kpt #: 225 total cpu time spent up to now is 519.8 secs Computing kpt #: 226 total cpu time spent up to now is 521.8 secs Computing kpt #: 227 total cpu time spent up to now is 523.9 secs Computing kpt #: 228 total cpu time spent up to now is 526.0 secs Computing kpt #: 229 total cpu time spent up to now is 528.1 secs Computing kpt #: 230 total cpu time spent up to now is 530.2 secs Computing kpt #: 231 total cpu time spent up to now is 532.3 secs Computing kpt #: 232 total cpu time spent up to now is 534.5 secs Computing kpt #: 233 total cpu time spent up to now is 536.6 secs Computing kpt #: 234 total cpu time spent up to now is 538.8 secs Computing kpt #: 235 total cpu time spent up to now is 540.9 secs Computing kpt #: 236 total cpu time spent up to now is 543.0 secs Computing kpt #: 237 total cpu time spent up to now is 545.1 secs Computing kpt #: 238 total cpu time spent up to now is 547.2 secs Computing kpt #: 239 total cpu time spent up to now is 549.3 secs Computing kpt #: 240 total cpu time spent up to now is 551.4 secs Computing kpt #: 241 total cpu time spent up to now is 553.5 secs Computing kpt #: 242 total cpu time spent up to now is 555.7 secs Computing kpt #: 243 total cpu time spent up to now is 557.9 secs Computing kpt #: 244 total cpu time spent up to now is 560.2 secs Computing kpt #: 245 total cpu time spent up to now is 562.6 secs Computing kpt #: 246 total cpu time spent up to now is 564.8 secs Computing kpt #: 247 total cpu time spent up to now is 567.1 secs Computing kpt #: 248 total cpu time spent up to now is 569.4 secs Computing kpt #: 249 total cpu time spent up to now is 571.8 secs Computing kpt #: 250 total cpu time spent up to now is 574.1 secs Computing kpt #: 251 total cpu time spent up to now is 576.4 secs Computing kpt #: 252 total cpu time spent up to now is 578.7 secs Computing kpt #: 253 total cpu time spent up to now is 581.0 secs Computing kpt #: 254 total cpu time spent up to now is 583.3 secs Computing kpt #: 255 total cpu time spent up to now is 585.6 secs Computing kpt #: 256 total cpu time spent up to now is 587.9 secs Computing kpt #: 257 total cpu time spent up to now is 590.2 secs Computing kpt #: 258 total cpu time spent up to now is 592.5 secs Computing kpt #: 259 total cpu time spent up to now is 594.8 secs Computing kpt #: 260 total cpu time spent up to now is 597.1 secs Computing kpt #: 261 total cpu time spent up to now is 599.3 secs Computing kpt #: 262 total cpu time spent up to now is 601.6 secs Computing kpt #: 263 total cpu time spent up to now is 603.9 secs Computing kpt #: 264 total cpu time spent up to now is 606.5 secs Computing kpt #: 265 total cpu time spent up to now is 609.1 secs Computing kpt #: 266 total cpu time spent up to now is 611.6 secs Computing kpt #: 267 total cpu time spent up to now is 614.3 secs Computing kpt #: 268 total cpu time spent up to now is 616.9 secs Computing kpt #: 269 total cpu time spent up to now is 619.5 secs Computing kpt #: 270 total cpu time spent up to now is 622.2 secs Computing kpt #: 271 total cpu time spent up to now is 624.8 secs Computing kpt #: 272 total cpu time spent up to now is 627.4 secs Computing kpt #: 273 total cpu time spent up to now is 629.9 secs Computing kpt #: 274 total cpu time spent up to now is 632.4 secs Computing kpt #: 275 total cpu time spent up to now is 634.8 secs Computing kpt #: 276 total cpu time spent up to now is 637.2 secs Computing kpt #: 277 total cpu time spent up to now is 639.5 secs Computing kpt #: 278 total cpu time spent up to now is 642.1 secs Computing kpt #: 279 total cpu time spent up to now is 644.4 secs Computing kpt #: 280 total cpu time spent up to now is 646.9 secs Computing kpt #: 281 total cpu time spent up to now is 649.3 secs Computing kpt #: 282 total cpu time spent up to now is 651.6 secs Computing kpt #: 283 total cpu time spent up to now is 653.9 secs Computing kpt #: 284 total cpu time spent up to now is 656.1 secs Computing kpt #: 285 total cpu time spent up to now is 658.3 secs Computing kpt #: 286 total cpu time spent up to now is 660.4 secs Computing kpt #: 287 total cpu time spent up to now is 662.5 secs Computing kpt #: 288 total cpu time spent up to now is 664.6 secs Computing kpt #: 289 total cpu time spent up to now is 666.7 secs Computing kpt #: 290 total cpu time spent up to now is 668.8 secs ethr = 1.67E-08, avg # of iterations = 33.1 total cpu time spent up to now is 668.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 11967 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7820 -7.7820 -7.4648 -7.4648 -5.2031 -5.2031 -3.5765 -3.5765 -2.5226 -2.5226 -2.0428 -2.0428 1.5871 1.5871 1.6852 1.6852 2.9427 2.9427 2.9558 2.9558 3.3681 3.3681 4.4664 4.4664 4.5958 4.5958 5.0504 5.0504 5.9054 5.9054 6.5270 6.5270 7.3356 7.3356 7.3866 7.3866 7.4397 7.4397 7.7003 7.7003 8.2181 8.2181 8.4804 8.4804 8.7077 8.7077 8.8375 8.8375 10.1246 10.1246 10.4051 10.4051 10.5865 10.5865 10.7035 10.7035 k = 0.0000 0.0000 0.0103 ( 11965 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7816 -7.7816 -7.4653 -7.4653 -5.2028 -5.2028 -3.5766 -3.5766 -2.5218 -2.5218 -2.0436 -2.0436 1.5867 1.5867 1.6868 1.6868 2.9011 2.9011 2.9869 2.9869 3.3792 3.3792 4.4663 4.4663 4.5958 4.5958 5.0514 5.0514 5.9057 5.9057 6.5252 6.5252 7.3118 7.3118 7.3896 7.3896 7.4599 7.4599 7.7010 7.7010 8.2164 8.2164 8.4793 8.4793 8.7048 8.7048 8.8408 8.8408 10.1242 10.1242 10.4060 10.4060 10.5868 10.5868 10.7034 10.7034 k = 0.0000 0.0000 0.0206 ( 11965 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7803 -7.7803 -7.4670 -7.4670 -5.2022 -5.2022 -3.5769 -3.5769 -2.5194 -2.5194 -2.0460 -2.0460 1.5855 1.5855 1.6913 1.6913 2.8455 2.8455 3.0131 3.0131 3.4104 3.4104 4.4660 4.4660 4.5959 4.5959 5.0544 5.0544 5.9065 5.9065 6.5199 6.5199 7.2672 7.2672 7.3905 7.3905 7.5018 7.5018 7.7029 7.7029 8.2114 8.2114 8.4762 8.4762 8.6968 8.6968 8.8498 8.8498 10.1229 10.1229 10.4089 10.4089 10.5875 10.5875 10.7029 10.7029 k = 0.0000 0.0000 0.0308 ( 11959 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7782 -7.7782 -7.4698 -7.4698 -5.2011 -5.2011 -3.5775 -3.5775 -2.5153 -2.5153 -2.0499 -2.0499 1.5841 1.5841 1.6983 1.6983 2.7845 2.7845 3.0306 3.0306 3.4570 3.4570 4.4656 4.4656 4.5960 4.5960 5.0594 5.0594 5.9078 5.9078 6.5111 6.5111 7.2180 7.2180 7.3893 7.3893 7.5489 7.5489 7.7062 7.7062 8.2034 8.2034 8.4710 8.4710 8.6855 8.6855 8.8627 8.8627 10.1209 10.1209 10.4135 10.4135 10.5886 10.5886 10.7020 10.7020 k = 0.0000 0.0000 0.0411 ( 11965 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7752 -7.7752 -7.4736 -7.4736 -5.1997 -5.1997 -3.5782 -3.5782 -2.5096 -2.5096 -2.0554 -2.0554 1.5829 1.5829 1.7073 1.7073 2.7206 2.7206 3.0420 3.0420 3.5136 3.5136 4.4650 4.4650 4.5962 4.5962 5.0666 5.0666 5.9095 5.9095 6.4990 6.4990 7.1676 7.1676 7.3871 7.3871 7.5964 7.5964 7.7109 7.7109 8.1930 8.1930 8.4639 8.4639 8.6722 8.6722 8.8780 8.8780 10.1180 10.1180 10.4199 10.4199 10.5901 10.5901 10.7009 10.7009 k = 0.0000 0.0000 0.0514 ( 11974 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7715 -7.7715 -7.4785 -7.4785 -5.1979 -5.1979 -3.5791 -3.5791 -2.5025 -2.5025 -2.0625 -2.0625 1.5824 1.5824 1.7177 1.7177 2.6554 2.6554 3.0495 3.0495 3.5758 3.5758 4.4643 4.4643 4.5964 4.5964 5.0761 5.0761 5.9117 5.9117 6.4840 6.4840 7.1169 7.1169 7.3842 7.3842 7.6422 7.6422 7.7174 7.7174 8.1809 8.1809 8.4552 8.4552 8.6578 8.6578 8.8944 8.8944 10.1145 10.1145 10.4279 10.4279 10.5919 10.5919 10.6994 10.6994 k = 0.0000 0.0000 0.0617 ( 11975 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7670 -7.7670 -7.4843 -7.4843 -5.1958 -5.1958 -3.5802 -3.5802 -2.4938 -2.4938 -2.0709 -2.0709 1.5829 1.5829 1.7290 1.7290 2.5904 2.5904 3.0546 3.0546 3.6407 3.6407 4.4635 4.4635 4.5966 4.5966 5.0881 5.0881 5.9142 5.9142 6.4661 6.4661 7.0663 7.0663 7.3808 7.3808 7.6833 7.6833 7.7276 7.7276 8.1681 8.1681 8.4450 8.4450 8.6428 8.6428 8.9113 8.9113 10.1105 10.1105 10.4372 10.4372 10.5939 10.5939 10.6975 10.6975 k = 0.0000 0.0000 0.0719 ( 11983 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7617 -7.7617 -7.4910 -7.4910 -5.1935 -5.1935 -3.5814 -3.5814 -2.4838 -2.4838 -2.0807 -2.0807 1.5847 1.5847 1.7408 1.7408 2.5264 2.5264 3.0582 3.0582 3.7060 3.7060 4.4626 4.4626 4.5969 4.5969 5.1026 5.1026 5.9171 5.9171 6.4459 6.4459 7.0160 7.0160 7.3772 7.3772 7.7114 7.7114 7.7487 7.7487 8.1558 8.1558 8.4337 8.4337 8.6274 8.6274 8.9281 8.9281 10.1059 10.1059 10.4478 10.4478 10.5961 10.5961 10.6953 10.6953 k = 0.0000 0.0000 0.0822 ( 11977 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7558 -7.7558 -7.4985 -7.4985 -5.1910 -5.1910 -3.5827 -3.5827 -2.4724 -2.4724 -2.0919 -2.0919 1.5879 1.5879 1.7528 1.7528 2.4641 2.4641 3.0608 3.0608 3.7701 3.7701 4.4616 4.4616 4.5972 4.5972 5.1199 5.1199 5.9201 5.9201 6.4237 6.4237 6.9661 6.9661 7.3733 7.3733 7.7251 7.7251 7.7809 7.7809 8.1454 8.1454 8.4215 8.4215 8.6116 8.6116 8.9444 8.9444 10.1011 10.1011 10.4594 10.4594 10.5984 10.5984 10.6928 10.6928 k = 0.0000 0.0000 0.0925 ( 11966 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.7492 -7.7492 -7.5067 -7.5067 -5.1884 -5.1884 -3.5840 -3.5840 -2.4599 -2.4599 -2.1042 -2.1042 1.5928 1.5928 1.7646 1.7646 2.4041 2.4041 3.0627 3.0627 3.8316 3.8316 4.4606 4.4606 4.5975 4.5975 5.1399 5.1399 5.9233 5.9233 6.4001 6.4001 6.9169 6.9169 7.3694 7.3694 7.7344 7.7344 7.8127 7.8127 8.1383 8.1383 8.4088 8.4088 8.5954 8.5954 8.9600 8.9600 10.0960 10.0960 10.4717 10.4717 10.6007 10.6007 10.6899 10.6899 k = 0.0000 0.0000 0.1028 ( 11974 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.7421 -7.7421 -7.5154 -7.5154 -5.1858 -5.1858 -3.5853 -3.5853 -2.4463 -2.4463 -2.1176 -2.1176 1.5993 1.5993 1.7758 1.7758 2.3468 2.3468 3.0642 3.0642 3.8897 3.8897 4.4596 4.4596 4.5979 4.5979 5.1627 5.1627 5.9265 5.9265 6.3754 6.3754 6.8687 6.8687 7.3655 7.3655 7.7426 7.7426 7.8396 7.8396 8.1364 8.1364 8.3958 8.3958 8.5789 8.5789 8.9747 8.9747 10.0908 10.0908 10.4846 10.4846 10.6030 10.6030 10.6867 10.6867 k = 0.0000 0.0000 0.1131 ( 11966 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.7345 -7.7345 -7.5247 -7.5247 -5.1832 -5.1832 -3.5866 -3.5866 -2.4317 -2.4317 -2.1320 -2.1320 1.6075 1.6075 1.7862 1.7862 2.2927 2.2927 3.0654 3.0654 3.9432 3.9432 4.4585 4.4585 4.5982 4.5982 5.1879 5.1879 5.9298 5.9298 6.3502 6.3502 6.8218 6.8218 7.3618 7.3618 7.7504 7.7504 7.8596 7.8596 8.1407 8.1407 8.3829 8.3829 8.5619 8.5619 8.9883 8.9883 10.0856 10.0856 10.4977 10.4977 10.6051 10.6051 10.6830 10.6830 k = 0.0000 0.0000 0.1233 ( 11961 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.7265 -7.7265 -7.5342 -7.5342 -5.1808 -5.1808 -3.5879 -3.5879 -2.4163 -2.4163 -2.1472 -2.1472 1.6172 1.6172 1.7954 1.7954 2.2424 2.2424 3.0663 3.0663 3.9916 3.9916 4.4576 4.4576 4.5985 4.5985 5.2151 5.2151 5.9329 5.9329 6.3251 6.3251 6.7770 6.7770 7.3583 7.3583 7.7577 7.7577 7.8726 7.8726 8.1515 8.1515 8.3705 8.3705 8.5445 8.5445 9.0007 9.0007 10.0807 10.0807 10.5108 10.5108 10.6071 10.6071 10.6790 10.6790 k = 0.0000 0.0000 0.1336 ( 11963 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.7184 -7.7184 -7.5437 -7.5437 -5.1785 -5.1785 -3.5890 -3.5890 -2.4002 -2.4002 -2.1631 -2.1631 1.6282 1.6282 1.8032 1.8032 2.1965 2.1965 3.0669 3.0669 4.0342 4.0342 4.4567 4.4567 4.5988 4.5988 5.2435 5.2435 5.9358 5.9358 6.3005 6.3005 6.7351 6.7351 7.3551 7.3551 7.7645 7.7645 7.8794 7.8794 8.1679 8.1679 8.3589 8.3589 8.5267 8.5267 9.0116 9.0116 10.0761 10.0761 10.5237 10.5237 10.6090 10.6090 10.6747 10.6747 k = 0.0000 0.0000 0.1439 ( 11960 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.7102 -7.7102 -7.5532 -7.5532 -5.1764 -5.1764 -3.5901 -3.5901 -2.3837 -2.3837 -2.1794 -2.1794 1.6402 1.6402 1.8092 1.8092 2.1554 2.1554 3.0674 3.0674 4.0706 4.0706 4.4559 4.4559 4.5991 4.5991 5.2720 5.2720 5.9384 5.9384 6.2771 6.2771 6.6970 6.6970 7.3522 7.3522 7.7706 7.7706 7.8818 7.8818 8.1878 8.1878 8.3483 8.3483 8.5089 8.5089 9.0211 9.0211 10.0720 10.0720 10.5358 10.5358 10.6107 10.6107 10.6702 10.6702 k = 0.0000 0.0000 0.1542 ( 11951 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.7023 -7.7023 -7.5621 -7.5621 -5.1747 -5.1747 -3.5909 -3.5909 -2.3672 -2.3672 -2.1958 -2.1958 1.6527 1.6527 1.8132 1.8132 2.1202 2.1202 3.0678 3.0678 4.1006 4.1006 4.4552 4.4552 4.5993 4.5993 5.2991 5.2991 5.9407 5.9407 6.2557 6.2557 6.6638 6.6638 7.3499 7.3499 7.7759 7.7759 7.8816 7.8816 8.2093 8.2093 8.3392 8.3392 8.4915 8.4915 9.0290 9.0290 10.0684 10.0684 10.5470 10.5470 10.6121 10.6121 10.6655 10.6655 k = 0.0000 0.0000 0.1645 ( 11956 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.6952 -7.6952 -7.5702 -7.5702 -5.1732 -5.1732 -3.5917 -3.5917 -2.3511 -2.3511 -2.2119 -2.2119 1.6648 1.6648 1.8151 1.8151 2.0916 2.0916 3.0681 3.0681 4.1239 4.1239 4.4546 4.4546 4.5995 4.5995 5.3230 5.3230 5.9426 5.9426 6.2372 6.2372 6.6366 6.6366 7.3480 7.3480 7.7803 7.7803 7.8802 7.8802 8.2301 8.2301 8.3318 8.3318 8.4751 8.4751 9.0353 9.0353 10.0655 10.0655 10.5568 10.5568 10.6134 10.6134 10.6609 10.6609 k = 0.0000 0.0000 0.1747 ( 11958 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.6893 -7.6893 -7.5767 -7.5767 -5.1722 -5.1722 -3.5922 -3.5922 -2.3363 -2.3363 -2.2266 -2.2266 1.6752 1.6752 1.8154 1.8154 2.0704 2.0704 3.0682 3.0682 4.1406 4.1406 4.4542 4.4542 4.5996 4.5996 5.3420 5.3420 5.9439 5.9439 6.2229 6.2229 6.6165 6.6165 7.3466 7.3466 7.7835 7.7835 7.8786 7.8786 8.2479 8.2479 8.3262 8.3262 8.4610 8.4610 9.0398 9.0398 10.0634 10.0634 10.5645 10.5645 10.6144 10.6144 10.6569 10.6569 k = 0.0000 0.0000 0.1850 ( 11955 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.6853 -7.6853 -7.5811 -7.5811 -5.1716 -5.1716 -3.5925 -3.5925 -2.3249 -2.3249 -2.2379 -2.2379 1.6825 1.6825 1.8149 1.8149 2.0574 2.0574 3.0683 3.0683 4.1507 4.1507 4.4539 4.4539 4.5997 4.5997 5.3542 5.3542 5.9448 5.9448 6.2136 6.2136 6.6040 6.6040 7.3457 7.3457 7.7855 7.7855 7.8774 7.8774 8.2603 8.2603 8.3228 8.3228 8.4511 8.4511 9.0425 9.0425 10.0621 10.0621 10.5695 10.5695 10.6151 10.6151 10.6541 10.6541 k = 0.0000 0.0000 0.1953 ( 11950 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.6839 -7.6839 -7.5826 -7.5826 -5.1713 -5.1713 -3.5926 -3.5926 -2.3203 -2.3203 -2.2425 -2.2425 1.6851 1.6851 1.8146 1.8146 2.0530 2.0530 3.0684 3.0684 4.1540 4.1540 4.4538 4.4538 4.5997 4.5997 5.3585 5.3585 5.9451 5.9451 6.2105 6.2105 6.5998 6.5998 7.3455 7.3455 7.7861 7.7861 7.8770 7.8770 8.2648 8.2648 8.3217 8.3217 8.4475 8.4475 9.0434 9.0434 10.0616 10.0616 10.5712 10.5712 10.6154 10.6154 10.6530 10.6530 k = 0.0000 0.0000 0.1953 ( 11950 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.6839 -7.6839 -7.5826 -7.5826 -5.1713 -5.1713 -3.5926 -3.5926 -2.3203 -2.3203 -2.2425 -2.2425 1.6851 1.6851 1.8146 1.8146 2.0530 2.0530 3.0684 3.0684 4.1540 4.1540 4.4538 4.4538 4.5997 4.5997 5.3585 5.3585 5.9451 5.9451 6.2105 6.2105 6.5998 6.5998 7.3455 7.3455 7.7861 7.7861 7.8770 7.8770 8.2648 8.2648 8.3217 8.3217 8.4475 8.4475 9.0434 9.0434 10.0616 10.0616 10.5712 10.5712 10.6154 10.6154 10.6530 10.6530 k = 0.0000 0.0108 0.1953 ( 11959 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.6833 -7.6833 -7.5821 -7.5821 -5.1708 -5.1708 -3.5942 -3.5942 -2.3262 -2.3262 -2.2429 -2.2429 1.6907 1.6907 1.8199 1.8199 2.0527 2.0527 3.0722 3.0722 4.1531 4.1531 4.4542 4.4542 4.6000 4.6000 5.3580 5.3580 5.9454 5.9454 6.2110 6.2110 6.5996 6.5996 7.3434 7.3434 7.7865 7.7865 7.8724 7.8724 8.2631 8.2631 8.3210 8.3210 8.4483 8.4483 9.0433 9.0433 10.0589 10.0589 10.5696 10.5696 10.6029 10.6029 10.6546 10.6546 k = 0.0000 0.0216 0.1953 ( 11954 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6653 -25.6653 -25.0692 -25.0692 -25.0572 -25.0572 -24.9570 -24.9570 -24.9388 -24.9388 -7.6815 -7.6815 -7.5804 -7.5804 -5.1692 -5.1692 -3.5991 -3.5991 -2.3429 -2.3429 -2.2451 -2.2451 1.7075 1.7075 1.8357 1.8357 2.0518 2.0518 3.0837 3.0837 4.1504 4.1504 4.4552 4.4552 4.6007 4.6007 5.3566 5.3566 5.9463 5.9463 6.2126 6.2126 6.5988 6.5988 7.3373 7.3373 7.7875 7.7875 7.8587 7.8587 8.2578 8.2578 8.3192 8.3192 8.4507 8.4507 9.0430 9.0430 10.0507 10.0507 10.5607 10.5607 10.5761 10.5761 10.6588 10.6588 k = 0.0000 0.0324 0.1953 ( 11944 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6653 -25.6653 -25.0692 -25.0692 -25.0573 -25.0573 -24.9570 -24.9570 -24.9389 -24.9389 -7.6784 -7.6784 -7.5777 -7.5777 -5.1664 -5.1664 -3.6072 -3.6072 -2.3682 -2.3682 -2.2508 -2.2508 1.7353 1.7353 1.8619 1.8619 2.0506 2.0506 3.1027 3.1027 4.1458 4.1458 4.4570 4.4570 4.6018 4.6018 5.3543 5.3543 5.9478 5.9478 6.2151 6.2151 6.5975 6.5975 7.3272 7.3272 7.7890 7.7890 7.8362 7.8362 8.2493 8.2493 8.3161 8.3161 8.4547 8.4547 9.0424 9.0424 10.0371 10.0371 10.5261 10.5261 10.5643 10.5643 10.6650 10.6650 k = 0.0000 0.0431 0.1953 ( 11954 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6653 -25.6653 -25.0692 -25.0692 -25.0573 -25.0573 -24.9570 -24.9570 -24.9389 -24.9389 -7.6742 -7.6742 -7.5740 -7.5740 -5.1627 -5.1627 -3.6184 -3.6184 -2.4004 -2.4004 -2.2609 -2.2609 1.7736 1.7736 1.8979 1.8979 2.0492 2.0492 3.1288 3.1288 4.1393 4.1393 4.4594 4.4594 4.6034 4.6034 5.3512 5.3512 5.9500 5.9500 6.2184 6.2184 6.5958 6.5958 7.3135 7.3135 7.7907 7.7907 7.8057 7.8057 8.2374 8.2374 8.3117 8.3117 8.4603 8.4603 9.0415 9.0415 10.0181 10.0181 10.4832 10.4832 10.5565 10.5565 10.6729 10.6729 k = 0.0000 0.0539 0.1953 ( 11965 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6653 -25.6653 -25.0691 -25.0691 -25.0573 -25.0573 -24.9570 -24.9570 -24.9389 -24.9389 -7.6688 -7.6688 -7.5692 -7.5692 -5.1579 -5.1579 -3.6326 -3.6326 -2.4384 -2.4384 -2.2760 -2.2760 1.8221 1.8221 1.9432 1.9432 2.0482 2.0482 3.1617 3.1617 4.1309 4.1309 4.4624 4.4624 4.6054 4.6054 5.3475 5.3475 5.9528 5.9528 6.2222 6.2222 6.5938 6.5938 7.2963 7.2963 7.7662 7.7662 7.7940 7.7940 8.2226 8.2226 8.3059 8.3059 8.4674 8.4674 9.0403 9.0403 9.9938 9.9938 10.4404 10.4404 10.5480 10.5480 10.6823 10.6823 k = 0.0000 0.0647 0.1953 ( 11963 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6654 -25.6654 -25.0691 -25.0691 -25.0574 -25.0574 -24.9570 -24.9570 -24.9390 -24.9390 -7.6622 -7.6622 -7.5634 -7.5634 -5.1521 -5.1521 -3.6497 -3.6497 -2.4811 -2.4811 -2.2960 -2.2960 1.8801 1.8801 1.9972 1.9972 2.0480 2.0480 3.2010 3.2010 4.1206 4.1206 4.4661 4.4661 4.6078 4.6078 5.3432 5.3432 5.9563 5.9563 6.2261 6.2261 6.5915 6.5915 7.2759 7.2759 7.7208 7.7208 7.7965 7.7965 8.2050 8.2050 8.2989 8.2989 8.4760 8.4760 9.0386 9.0386 9.9643 9.9643 10.3999 10.3999 10.5385 10.5385 10.6929 10.6929 k = 0.0000 0.0755 0.1953 ( 11960 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6779 -25.6779 -25.6654 -25.6654 -25.0690 -25.0690 -25.0574 -25.0574 -24.9570 -24.9570 -24.9391 -24.9391 -7.6546 -7.6546 -7.5567 -7.5567 -5.1454 -5.1454 -3.6695 -3.6695 -2.5277 -2.5277 -2.3207 -2.3207 1.9463 1.9463 2.0488 2.0488 2.0599 2.0599 3.2462 3.2462 4.1082 4.1082 4.4705 4.4705 4.6106 4.6106 5.3387 5.3387 5.9604 5.9604 6.2300 6.2300 6.5889 6.5889 7.2527 7.2527 7.6693 7.6693 7.7992 7.7992 8.1852 8.1852 8.2905 8.2905 8.4858 8.4858 9.0365 9.0365 9.9297 9.9297 10.3625 10.3625 10.5282 10.5282 10.7045 10.7045 k = 0.0000 0.0863 0.1953 ( 11952 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6779 -25.6779 -25.6655 -25.6655 -25.0690 -25.0690 -25.0575 -25.0575 -24.9570 -24.9570 -24.9391 -24.9391 -7.6458 -7.6458 -7.5491 -7.5491 -5.1378 -5.1378 -3.6918 -3.6918 -2.5774 -2.5774 -2.3497 -2.3497 2.0146 2.0146 2.0584 2.0584 2.1285 2.1285 3.2969 3.2969 4.0938 4.0938 4.4754 4.4754 4.6137 4.6137 5.3339 5.3339 5.9652 5.9652 6.2333 6.2333 6.5860 6.5860 7.2270 7.2270 7.6127 7.6127 7.8019 7.8019 8.1634 8.1634 8.2809 8.2809 8.4967 8.4967 9.0338 9.0338 9.8902 9.8902 10.3285 10.3285 10.5171 10.5171 10.7169 10.7169 k = 0.0000 0.0971 0.1953 ( 11966 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6779 -25.6779 -25.6656 -25.6656 -25.0689 -25.0689 -25.0575 -25.0575 -24.9570 -24.9570 -24.9392 -24.9392 -7.6361 -7.6361 -7.5407 -7.5407 -5.1294 -5.1294 -3.7165 -3.7165 -2.6295 -2.6295 -2.3825 -2.3825 2.0441 2.0441 2.1159 2.1159 2.2040 2.2040 3.3524 3.3524 4.0776 4.0776 4.4809 4.4809 4.6172 4.6172 5.3291 5.3291 5.9706 5.9706 6.2357 6.2357 6.5826 6.5826 7.1990 7.1990 7.5522 7.5522 7.8046 7.8046 8.1400 8.1400 8.2700 8.2700 8.5086 8.5086 9.0305 9.0305 9.8462 9.8462 10.2981 10.2981 10.5055 10.5055 10.7299 10.7299 k = 0.0000 0.1078 0.1953 ( 11965 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6778 -25.6778 -25.6656 -25.6656 -25.0689 -25.0689 -25.0576 -25.0576 -24.9570 -24.9570 -24.9393 -24.9393 -7.6254 -7.6254 -7.5315 -7.5315 -5.1203 -5.1203 -3.7432 -3.7432 -2.6831 -2.6831 -2.4186 -2.4186 2.0519 2.0519 2.2038 2.2038 2.2851 2.2851 3.4123 3.4123 4.0596 4.0596 4.4869 4.4869 4.6209 4.6209 5.3245 5.3245 5.9768 5.9768 6.2370 6.2370 6.5784 6.5784 7.1691 7.1691 7.4891 7.4891 7.8072 7.8072 8.1155 8.1155 8.2579 8.2579 8.5213 8.5213 9.0266 9.0266 9.7980 9.7980 10.2707 10.2707 10.4934 10.4934 10.7432 10.7432 k = 0.0000 0.1186 0.1953 ( 11964 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6778 -25.6778 -25.6657 -25.6657 -25.0688 -25.0688 -25.0577 -25.0577 -24.9570 -24.9570 -24.9394 -24.9394 -7.6138 -7.6138 -7.5217 -7.5217 -5.1106 -5.1106 -3.7717 -3.7717 -2.7378 -2.7378 -2.4575 -2.4575 2.0596 2.0596 2.3001 2.3001 2.3710 2.3710 3.4757 3.4757 4.0403 4.0403 4.4934 4.4934 4.6248 4.6248 5.3200 5.3200 5.9837 5.9837 6.2369 6.2369 6.5729 6.5729 7.1375 7.1375 7.4248 7.4248 7.8096 7.8096 8.0900 8.0900 8.2447 8.2447 8.5346 8.5346 9.0220 9.0220 9.7460 9.7460 10.2460 10.2460 10.4809 10.4809 10.7566 10.7566 k = 0.0000 0.1294 0.1953 ( 11954 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6777 -25.6777 -25.6658 -25.6658 -25.0687 -25.0687 -25.0578 -25.0578 -24.9570 -24.9570 -24.9395 -24.9395 -7.6014 -7.6014 -7.5113 -7.5113 -5.1003 -5.1003 -3.8018 -3.8018 -2.7928 -2.7928 -2.4988 -2.4988 2.0691 2.0691 2.4025 2.4025 2.4610 2.4610 3.5414 3.5414 4.0207 4.0207 4.5004 4.5004 4.6288 4.6288 5.3159 5.3159 5.9914 5.9914 6.2353 6.2353 6.5651 6.5651 7.1046 7.1046 7.3611 7.3611 7.8118 7.8118 8.0640 8.0640 8.2305 8.2305 8.5485 8.5485 9.0167 9.0167 9.6907 9.6907 10.2233 10.2233 10.4684 10.4684 10.7699 10.7699 k = 0.0000 0.1402 0.1953 ( 11958 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6777 -25.6777 -25.6659 -25.6659 -25.0686 -25.0686 -25.0579 -25.0579 -24.9570 -24.9570 -24.9396 -24.9396 -7.5882 -7.5882 -7.5004 -7.5004 -5.0896 -5.0896 -3.8332 -3.8332 -2.8475 -2.8475 -2.5419 -2.5419 2.0808 2.0808 2.5097 2.5097 2.5542 2.5542 3.6073 3.6073 4.0027 4.0027 4.5077 4.5077 4.6330 4.6330 5.3120 5.3120 5.9998 5.9998 6.2321 6.2321 6.5538 6.5538 7.0705 7.0705 7.2997 7.2997 7.8139 7.8139 8.0375 8.0375 8.2154 8.2154 8.5627 8.5627 9.0107 9.0107 9.6324 9.6324 10.2016 10.2016 10.4557 10.4557 10.7829 10.7829 k = 0.0000 0.1510 0.1953 ( 11964 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6776 -25.6776 -25.6660 -25.6660 -25.0686 -25.0686 -25.0580 -25.0580 -24.9571 -24.9571 -24.9397 -24.9397 -7.5743 -7.5743 -7.4892 -7.4892 -5.0786 -5.0786 -3.8655 -3.8655 -2.9013 -2.9013 -2.5866 -2.5866 2.0949 2.0949 2.6207 2.6207 2.6501 2.6501 3.6693 3.6693 3.9902 3.9902 4.5154 4.5154 4.6372 4.6372 5.3084 5.3084 6.0089 6.0089 6.2274 6.2274 6.5377 6.5377 7.0354 7.0354 7.2425 7.2425 7.8158 7.8158 8.0108 8.0108 8.1994 8.1994 8.5771 8.5771 9.0039 9.0039 9.5717 9.5717 10.1800 10.1800 10.4432 10.4432 10.7952 10.7952 k = 0.0000 0.1618 0.1953 ( 11956 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6776 -25.6776 -25.6661 -25.6661 -25.0685 -25.0685 -25.0581 -25.0581 -24.9571 -24.9571 -24.9399 -24.9399 -7.5599 -7.5599 -7.4777 -7.4777 -5.0673 -5.0673 -3.8985 -3.8985 -2.9538 -2.9538 -2.6322 -2.6322 2.1115 2.1115 2.7335 2.7335 2.7490 2.7490 3.7189 3.7189 3.9917 3.9917 4.5235 4.5235 4.6415 4.6415 5.3049 5.3049 6.0189 6.0189 6.2214 6.2214 6.5151 6.5151 6.9997 6.9997 7.1916 7.1916 7.8175 7.8175 7.9841 7.9841 8.1827 8.1827 8.5915 8.5915 8.9963 8.9963 9.5091 9.5091 10.1571 10.1571 10.4308 10.4308 10.8068 10.8068 k = 0.0000 0.1725 0.1953 ( 11956 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6775 -25.6775 -25.6662 -25.6662 -25.0684 -25.0684 -25.0582 -25.0582 -24.9571 -24.9571 -24.9400 -24.9400 -7.5450 -7.5450 -7.4661 -7.4661 -5.0560 -5.0560 -3.9319 -3.9319 -3.0042 -3.0042 -2.6786 -2.6786 2.1308 2.1308 2.8412 2.8412 2.8558 2.8558 3.7450 3.7450 4.0184 4.0184 4.5317 4.5317 4.6456 4.6456 5.3013 5.3013 6.0297 6.0297 6.2144 6.2144 6.4849 6.4849 6.9634 6.9634 7.1485 7.1485 7.8190 7.8190 7.9575 7.9575 8.1654 8.1654 8.6056 8.6056 8.9877 8.9877 9.4451 9.4451 10.1310 10.1310 10.4188 10.4188 10.7814 10.7814 k = 0.0000 0.1833 0.1953 ( 11940 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6775 -25.6775 -25.6663 -25.6663 -25.0683 -25.0683 -25.0583 -25.0583 -24.9571 -24.9571 -24.9401 -24.9401 -7.5297 -7.5297 -7.4545 -7.4545 -5.0447 -5.0447 -3.9654 -3.9654 -3.0523 -3.0523 -2.7253 -2.7253 2.1527 2.1527 2.9418 2.9418 2.9709 2.9709 3.7452 3.7452 4.0730 4.0730 4.5402 4.5402 4.6496 4.6496 5.2974 5.2974 6.0412 6.0412 6.2068 6.2068 6.4463 6.4463 6.9268 6.9268 7.1140 7.1140 7.8203 7.8203 7.9310 7.9310 8.1477 8.1477 8.6190 8.6190 8.9780 8.9780 9.3807 9.3807 10.0996 10.0996 10.4072 10.4072 10.7229 10.7229 k = 0.0000 0.1941 0.1953 ( 11942 PWs) bands (ev): -48.9800 -48.9800 -48.9774 -48.9774 -25.6774 -25.6774 -25.6664 -25.6664 -25.0682 -25.0682 -25.0584 -25.0584 -24.9571 -24.9571 -24.9402 -24.9402 -7.5142 -7.5142 -7.4431 -7.4431 -5.0335 -5.0335 -3.9986 -3.9986 -3.0974 -3.0974 -2.7721 -2.7721 2.1771 2.1771 3.0409 3.0409 3.0862 3.0862 3.7288 3.7288 4.1468 4.1468 4.5488 4.5488 4.6535 4.6535 5.2927 5.2927 6.0535 6.0535 6.1990 6.1990 6.3998 6.3998 6.8901 6.8901 7.0881 7.0881 7.8210 7.8210 7.9050 7.9050 8.1296 8.1296 8.6313 8.6313 8.9669 8.9669 9.3168 9.3168 10.0604 10.0604 10.3960 10.3960 10.6639 10.6639 k = 0.0000 0.2049 0.1953 ( 11955 PWs) bands (ev): -48.9800 -48.9800 -48.9774 -48.9774 -25.6774 -25.6774 -25.6665 -25.6665 -25.0681 -25.0681 -25.0585 -25.0585 -24.9571 -24.9571 -24.9403 -24.9403 -7.4986 -7.4986 -7.4320 -7.4320 -5.0227 -5.0227 -4.0314 -4.0314 -3.1392 -3.1392 -2.8186 -2.8186 2.2041 2.2041 3.1388 3.1388 3.1973 3.1973 3.7064 3.7064 4.2313 4.2313 4.5575 4.5575 4.6570 4.6570 5.2869 5.2869 6.0665 6.0665 6.1916 6.1916 6.3464 6.3464 6.8534 6.8534 7.0698 7.0698 7.8204 7.8204 7.8802 7.8802 8.1114 8.1114 8.6418 8.6418 8.9540 8.9540 9.2547 9.2547 10.0113 10.0113 10.3854 10.3854 10.6090 10.6090 k = 0.0000 0.2157 0.1953 ( 11958 PWs) bands (ev): -48.9800 -48.9800 -48.9774 -48.9774 -25.6773 -25.6773 -25.6665 -25.6665 -25.0680 -25.0680 -25.0586 -25.0586 -24.9571 -24.9571 -24.9404 -24.9404 -7.4829 -7.4829 -7.4213 -7.4213 -5.0121 -5.0121 -4.0635 -4.0635 -3.1772 -3.1772 -2.8644 -2.8644 2.2335 2.2335 3.2351 3.2351 3.2983 3.2983 3.6876 3.6876 4.3217 4.3217 4.5662 4.5662 4.6603 4.6603 5.2795 5.2795 6.0801 6.0801 6.1850 6.1850 6.2880 6.2880 6.8170 6.8170 7.0576 7.0576 7.8154 7.8154 7.8594 7.8594 8.0932 8.0932 8.6499 8.6499 8.9389 8.9389 9.1960 9.1960 9.9515 9.9515 10.3754 10.3754 10.5618 10.5618 k = 0.0000 0.2265 0.1953 ( 11954 PWs) bands (ev): -48.9800 -48.9800 -48.9774 -48.9774 -25.6773 -25.6773 -25.6666 -25.6666 -25.0679 -25.0679 -25.0587 -25.0587 -24.9571 -24.9571 -24.9405 -24.9405 -7.4674 -7.4674 -7.4113 -7.4113 -5.0020 -5.0020 -4.0946 -4.0946 -3.2112 -3.2112 -2.9095 -2.9095 2.2652 2.2652 3.3281 3.3281 3.3767 3.3767 3.6869 3.6869 4.4151 4.4151 4.5749 4.5749 4.6632 4.6632 5.2701 5.2701 6.0942 6.0942 6.1792 6.1792 6.2272 6.2272 6.7809 6.7809 7.0499 7.0499 7.8005 7.8005 7.8481 7.8481 8.0750 8.0750 8.6545 8.6545 8.9211 8.9211 9.1425 9.1425 9.8825 9.8825 10.3660 10.3660 10.5243 10.5243 k = 0.0000 0.2372 0.1953 ( 11948 PWs) bands (ev): -48.9800 -48.9800 -48.9774 -48.9774 -25.6772 -25.6772 -25.6667 -25.6667 -25.0679 -25.0679 -25.0588 -25.0588 -24.9571 -24.9571 -24.9406 -24.9406 -7.4521 -7.4521 -7.4020 -7.4020 -4.9925 -4.9925 -4.1244 -4.1244 -3.2408 -3.2408 -2.9533 -2.9533 2.2991 2.2991 3.3981 3.3981 3.4337 3.4337 3.7228 3.7228 4.5096 4.5096 4.5835 4.5835 4.6656 4.6656 5.2582 5.2582 6.1081 6.1081 6.1580 6.1580 6.1830 6.1830 6.7455 6.7455 7.0450 7.0450 7.7762 7.7762 7.8455 7.8455 8.0572 8.0572 8.6543 8.6543 8.9003 8.9003 9.0963 9.0963 9.8078 9.8078 10.3572 10.3572 10.4960 10.4960 k = 0.0000 0.2480 0.1953 ( 11942 PWs) bands (ev): -48.9800 -48.9800 -48.9774 -48.9774 -25.6772 -25.6772 -25.6668 -25.6668 -25.0678 -25.0678 -25.0589 -25.0589 -24.9572 -24.9572 -24.9407 -24.9407 -7.4372 -7.4372 -7.3936 -7.3936 -4.9835 -4.9835 -4.1528 -4.1528 -3.2658 -3.2658 -2.9958 -2.9958 2.3350 2.3350 3.3974 3.3974 3.5169 3.5169 3.7941 3.7941 4.5904 4.5904 4.6048 4.6048 4.6676 4.6676 5.2435 5.2435 6.0942 6.0942 6.1258 6.1258 6.1805 6.1805 6.7109 6.7109 7.0420 7.0420 7.7473 7.7473 7.8467 7.8467 8.0397 8.0397 8.6480 8.6480 8.8771 8.8771 9.0584 9.0584 9.7318 9.7318 10.3492 10.3492 10.4750 10.4750 k = 0.0000 0.2588 0.1953 ( 11936 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6771 -25.6771 -25.6669 -25.6669 -25.0677 -25.0677 -25.0589 -25.0589 -24.9572 -24.9572 -24.9408 -24.9408 -7.4229 -7.4229 -7.3863 -7.3863 -4.9751 -4.9751 -4.1794 -4.1794 -3.2862 -3.2862 -3.0364 -3.0364 2.3727 2.3727 3.3682 3.3682 3.6020 3.6020 3.8818 3.8818 4.5996 4.5996 4.6685 4.6685 4.6959 4.6959 5.2261 5.2261 6.0337 6.0337 6.1385 6.1385 6.1844 6.1844 6.6775 6.6775 7.0397 7.0397 7.7160 7.7160 7.8495 7.8495 8.0228 8.0228 8.6350 8.6350 8.8527 8.8527 9.0290 9.0290 9.6592 9.6592 10.3418 10.3418 10.4590 10.4590 k = 0.0000 0.2696 0.1953 ( 11942 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6771 -25.6771 -25.6669 -25.6669 -25.0676 -25.0676 -25.0590 -25.0590 -24.9572 -24.9572 -24.9409 -24.9409 -7.4093 -7.4093 -7.3802 -7.3802 -4.9673 -4.9673 -4.2041 -4.2041 -3.3018 -3.3018 -3.0750 -3.0750 2.4117 2.4117 3.3277 3.3277 3.6834 3.6834 3.9723 3.9723 4.6075 4.6075 4.6696 4.6696 4.7830 4.7830 5.2061 5.2061 5.9742 5.9742 6.1517 6.1517 6.1927 6.1927 6.6454 6.6454 7.0378 7.0378 7.6830 7.6830 7.8531 7.8531 8.0068 8.0068 8.6155 8.6155 8.8285 8.8285 9.0071 9.0071 9.5936 9.5936 10.3349 10.3349 10.4450 10.4450 k = 0.0000 0.2804 0.1953 ( 11946 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6770 -25.6770 -25.6670 -25.6670 -25.0676 -25.0676 -25.0591 -25.0591 -24.9572 -24.9572 -24.9409 -24.9409 -7.3964 -7.3964 -7.3754 -7.3754 -4.9603 -4.9603 -4.2267 -4.2267 -3.3128 -3.3128 -3.1110 -3.1110 2.4518 2.4518 3.2822 3.2822 3.7597 3.7597 4.0588 4.0588 4.6149 4.6149 4.6698 4.6698 4.8640 4.8640 5.1845 5.1845 5.9180 5.9180 6.1645 6.1645 6.2046 6.2046 6.6151 6.6151 7.0360 7.0360 7.6491 7.6491 7.8574 7.8574 7.9917 7.9917 8.5916 8.5916 8.8052 8.8052 8.9913 8.9913 9.5378 9.5378 10.3287 10.3287 10.4297 10.4297 k = 0.0000 0.2912 0.1953 ( 11948 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6770 -25.6770 -25.6671 -25.6671 -25.0675 -25.0675 -25.0591 -25.0591 -24.9572 -24.9572 -24.9410 -24.9410 -7.3845 -7.3845 -7.3721 -7.3721 -4.9538 -4.9538 -4.2468 -4.2468 -3.3196 -3.3196 -3.1439 -3.1439 2.4924 2.4924 3.2345 3.2345 3.8296 3.8296 4.1375 4.1375 4.6220 4.6220 4.6693 4.6693 4.9357 4.9357 5.1631 5.1631 5.8661 5.8661 6.1775 6.1775 6.2191 6.2191 6.5871 6.5871 7.0343 7.0343 7.6151 7.6151 7.8618 7.8618 7.9781 7.9781 8.5660 8.5660 8.7833 8.7833 8.9804 8.9804 9.4930 9.4930 10.3229 10.3229 10.4099 10.4099 k = 0.0000 0.3019 0.1953 ( 11954 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6770 -25.6770 -25.6671 -25.6671 -25.0675 -25.0675 -25.0592 -25.0592 -24.9572 -24.9572 -24.9410 -24.9410 -7.3737 -7.3737 -7.3703 -7.3703 -4.9481 -4.9481 -4.2642 -4.2642 -3.3226 -3.3226 -3.1729 -3.1729 2.5328 2.5328 3.1867 3.1867 3.8915 3.8915 4.2056 4.2056 4.6285 4.6285 4.6682 4.6682 4.9933 4.9933 5.1454 5.1454 5.8198 5.8198 6.1911 6.1911 6.2348 6.2348 6.5620 6.5620 7.0331 7.0331 7.5822 7.5822 7.8661 7.8661 7.9663 7.9663 8.5415 8.5415 8.7634 8.7634 8.9732 8.9732 9.4594 9.4594 10.3176 10.3176 10.3851 10.3851 k = 0.0000 0.3127 0.1953 ( 11956 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6770 -25.6770 -25.6671 -25.6671 -25.0674 -25.0674 -25.0592 -25.0592 -24.9572 -24.9572 -24.9411 -24.9411 -7.3700 -7.3700 -7.3639 -7.3639 -4.9432 -4.9432 -4.2787 -4.2787 -3.3232 -3.3232 -3.1968 -3.1968 2.5718 2.5718 3.1403 3.1403 3.9437 3.9437 4.2608 4.2608 4.6346 4.6346 4.6664 4.6664 5.0283 5.0283 5.1389 5.1389 5.7803 5.7803 6.2052 6.2052 6.2506 6.2506 6.5409 6.5409 7.0329 7.0329 7.5518 7.5518 7.8694 7.8694 7.9573 7.9573 8.5203 8.5203 8.7469 8.7469 8.9686 8.9686 9.4362 9.4362 10.3124 10.3124 10.3593 10.3593 k = 0.0000 0.3235 0.1953 ( 11959 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3714 -7.3714 -7.3555 -7.3555 -4.9390 -4.9390 -4.2900 -4.2900 -3.3232 -3.3232 -3.2135 -3.2135 2.6078 2.6078 3.0975 3.0975 3.9844 3.9844 4.3014 4.3014 4.6401 4.6401 4.6639 4.6639 5.0359 5.0359 5.1472 5.1472 5.7495 5.7495 6.2187 6.2187 6.2662 6.2662 6.5250 6.5250 7.0342 7.0342 7.5253 7.5253 7.8708 7.8708 7.9519 7.9519 8.5045 8.5045 8.7350 8.7350 8.9658 8.9658 9.4221 9.4221 10.3071 10.3071 10.3384 10.3384 k = 0.0000 0.3235 0.1953 ( 11959 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3714 -7.3714 -7.3555 -7.3555 -4.9390 -4.9390 -4.2900 -4.2900 -3.3232 -3.3232 -3.2135 -3.2135 2.6078 2.6078 3.0975 3.0975 3.9844 3.9844 4.3014 4.3014 4.6401 4.6401 4.6639 4.6639 5.0359 5.0359 5.1472 5.1472 5.7495 5.7495 6.2187 6.2187 6.2662 6.2662 6.5250 6.5250 7.0342 7.0342 7.5253 7.5253 7.8708 7.8708 7.9519 7.9519 8.5045 8.5045 8.7350 8.7350 8.9658 8.9658 9.4221 9.4221 10.3071 10.3071 10.3384 10.3384 k = 0.0000 0.3274 0.1865 ( 11958 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3706 -7.3706 -7.3544 -7.3544 -4.9375 -4.9375 -4.2964 -4.2964 -3.3222 -3.3222 -3.2142 -3.2142 2.6182 2.6182 3.0627 3.0627 4.0011 4.0011 4.3096 4.3096 4.6423 4.6423 4.6616 4.6616 5.0593 5.0593 5.1539 5.1539 5.7497 5.7497 6.2326 6.2326 6.2954 6.2954 6.5243 6.5243 7.0052 7.0052 7.4868 7.4868 7.8634 7.8634 7.9494 7.9494 8.5078 8.5078 8.7266 8.7266 8.9578 8.9578 9.4159 9.4159 10.3101 10.3101 10.3403 10.3403 k = 0.0000 0.3313 0.1777 ( 11950 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3703 -7.3703 -7.3532 -7.3532 -4.9363 -4.9363 -4.3016 -4.3016 -3.3213 -3.3213 -3.2148 -3.2148 2.6283 2.6283 3.0333 3.0333 4.0144 4.0144 4.3161 4.3161 4.6446 4.6446 4.6593 4.6593 5.0808 5.0808 5.1556 5.1556 5.7514 5.7514 6.2396 6.2396 6.3236 6.3236 6.5238 6.5238 6.9829 6.9829 7.4537 7.4537 7.8574 7.8574 7.9475 7.9475 8.5113 8.5113 8.7184 8.7184 8.9521 8.9521 9.4111 9.4111 10.3125 10.3125 10.3418 10.3418 k = 0.0000 0.3352 0.1689 ( 11951 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3703 -7.3703 -7.3521 -7.3521 -4.9354 -4.9354 -4.3054 -4.3054 -3.3206 -3.3206 -3.2152 -3.2152 2.6370 2.6370 3.0107 3.0107 4.0239 4.0239 4.3207 4.3207 4.6469 4.6469 4.6570 4.6570 5.1001 5.1001 5.1526 5.1526 5.7535 5.7535 6.2437 6.2437 6.3457 6.3457 6.5235 6.5235 6.9673 6.9673 7.4279 7.4279 7.8530 7.8530 7.9462 7.9462 8.5145 8.5145 8.7114 8.7114 8.9483 8.9483 9.4078 9.4078 10.3143 10.3143 10.3429 10.3429 k = 0.0000 0.3391 0.1600 ( 11943 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3704 -7.3704 -7.3514 -7.3514 -4.9348 -4.9348 -4.3077 -4.3077 -3.3201 -3.3201 -3.2154 -3.2154 2.6429 2.6429 2.9964 2.9964 4.0297 4.0297 4.3235 4.3235 4.6493 4.6493 4.6546 4.6546 5.1165 5.1165 5.1460 5.1460 5.7552 5.7552 6.2460 6.2460 6.3594 6.3594 6.5234 6.5234 6.9583 6.9583 7.4114 7.4114 7.8504 7.8504 7.9453 7.9453 8.5167 8.5167 8.7066 8.7066 8.9462 8.9462 9.4058 9.4058 10.3153 10.3153 10.3436 10.3436 k = 0.0000 0.3429 0.1512 ( 11942 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3704 -7.3704 -7.3512 -7.3512 -4.9346 -4.9346 -4.3085 -4.3085 -3.3199 -3.3199 -3.2155 -3.2155 2.6450 2.6450 2.9914 2.9914 4.0317 4.0317 4.3245 4.3245 4.6509 4.6509 4.6530 4.6530 5.1257 5.1257 5.1400 5.1400 5.7559 5.7559 6.2467 6.2467 6.3641 6.3641 6.5233 6.5233 6.9554 6.9554 7.4057 7.4057 7.8495 7.8495 7.9451 7.9451 8.5176 8.5176 8.7050 8.7050 8.9456 8.9456 9.4051 9.4051 10.3157 10.3157 10.3438 10.3438 k = 0.0000 0.3429 0.1512 ( 11942 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3704 -7.3704 -7.3512 -7.3512 -4.9346 -4.9346 -4.3085 -4.3085 -3.3199 -3.3199 -3.2155 -3.2155 2.6450 2.6450 2.9914 2.9914 4.0317 4.0317 4.3245 4.3245 4.6509 4.6509 4.6530 4.6530 5.1257 5.1257 5.1400 5.1400 5.7559 5.7559 6.2467 6.2467 6.3641 6.3641 6.5233 6.5233 6.9554 6.9554 7.4057 7.4057 7.8495 7.8495 7.9451 7.9451 8.5176 8.5176 8.7050 8.7050 8.9456 8.9456 9.4051 9.4051 10.3157 10.3157 10.3438 10.3438 k = 0.0106 0.3429 0.1512 ( 11940 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6770 -25.6770 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3699 -7.3699 -7.3507 -7.3507 -4.9338 -4.9338 -4.3080 -4.3080 -3.3195 -3.3195 -3.2152 -3.2152 2.6462 2.6462 2.9924 2.9924 4.0314 4.0314 4.3246 4.3246 4.6483 4.6483 4.6500 4.6500 5.1254 5.1254 5.1407 5.1407 5.7469 5.7469 6.2512 6.2512 6.3624 6.3624 6.5174 6.5174 6.9579 6.9579 7.4060 7.4060 7.8439 7.8439 7.9419 7.9419 8.5200 8.5200 8.7094 8.7094 8.9494 8.9494 9.4070 9.4070 10.3125 10.3125 10.3431 10.3431 k = 0.0213 0.3429 0.1512 ( 11944 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6771 -25.6771 -25.6673 -25.6673 -25.0676 -25.0676 -25.0595 -25.0595 -24.9572 -24.9572 -24.9412 -24.9412 -7.3684 -7.3684 -7.3494 -7.3494 -4.9314 -4.9314 -4.3064 -4.3064 -3.3184 -3.3184 -3.2141 -3.2141 2.6496 2.6496 2.9954 2.9954 4.0306 4.0306 4.3249 4.3249 4.6405 4.6405 4.6415 4.6415 5.1243 5.1243 5.1425 5.1425 5.7212 5.7212 6.2636 6.2636 6.3569 6.3569 6.5011 6.5011 6.9647 6.9647 7.4069 7.4069 7.8275 7.8275 7.9327 7.9327 8.5275 8.5275 8.7224 8.7224 8.9607 8.9607 9.4127 9.4127 10.3031 10.3031 10.3417 10.3417 k = 0.0319 0.3429 0.1512 ( 11946 PWs) bands (ev): -48.9799 -48.9799 -48.9773 -48.9773 -25.6772 -25.6772 -25.6674 -25.6674 -25.0679 -25.0679 -25.0597 -25.0597 -24.9572 -24.9572 -24.9412 -24.9412 -7.3660 -7.3660 -7.3472 -7.3472 -4.9275 -4.9275 -4.3038 -4.3038 -3.3166 -3.3166 -3.2124 -3.2124 2.6554 2.6554 3.0005 3.0005 4.0291 4.0291 4.3253 4.3253 4.6271 4.6271 4.6284 4.6284 5.1223 5.1223 5.1447 5.1447 5.6815 5.6815 6.2807 6.2807 6.3462 6.3462 6.4782 6.4782 6.9739 6.9739 7.4083 7.4083 7.8013 7.8013 7.9187 7.9187 8.5397 8.5397 8.7426 8.7426 8.9787 8.9787 9.4223 9.4223 10.2879 10.2879 10.3403 10.3403 k = 0.0426 0.3429 0.1512 ( 11962 PWs) bands (ev): -48.9798 -48.9798 -48.9773 -48.9773 -25.6775 -25.6775 -25.6676 -25.6676 -25.0682 -25.0682 -25.0600 -25.0600 -24.9573 -24.9573 -24.9412 -24.9412 -7.3625 -7.3625 -7.3441 -7.3441 -4.9220 -4.9220 -4.3002 -4.3002 -3.3141 -3.3141 -3.2100 -3.2100 2.6634 2.6634 3.0075 3.0075 4.0269 4.0269 4.3255 4.3255 4.6089 4.6089 4.6114 4.6114 5.1191 5.1191 5.1465 5.1465 5.6313 5.6313 6.2966 6.2966 6.3309 6.3309 6.4539 6.4539 6.9834 6.9834 7.4101 7.4101 7.7666 7.7666 7.9013 7.9013 8.5563 8.5563 8.7682 8.7682 9.0023 9.0023 9.4357 9.4357 10.2682 10.2682 10.3387 10.3387 k = 0.0532 0.3429 0.1512 ( 11962 PWs) bands (ev): -48.9797 -48.9797 -48.9772 -48.9772 -25.6777 -25.6777 -25.6679 -25.6679 -25.0687 -25.0687 -25.0604 -25.0604 -24.9573 -24.9573 -24.9413 -24.9413 -7.3581 -7.3581 -7.3401 -7.3401 -4.9149 -4.9149 -4.2955 -4.2955 -3.3108 -3.3108 -3.2070 -3.2070 2.6737 2.6737 3.0164 3.0164 4.0236 4.0236 4.3252 4.3252 4.5872 4.5872 4.5905 4.5905 5.1143 5.1143 5.1466 5.1466 5.5736 5.5736 6.2852 6.2852 6.3324 6.3324 6.4326 6.4326 6.9916 6.9916 7.4121 7.4121 7.7250 7.7250 7.8822 7.8822 8.5771 8.5771 8.7974 8.7974 9.0302 9.0302 9.4529 9.4529 10.2455 10.2455 10.3365 10.3365 k = 0.0638 0.3429 0.1512 ( 11960 PWs) bands (ev): -48.9796 -48.9796 -48.9771 -48.9771 -25.6781 -25.6781 -25.6682 -25.6682 -25.0693 -25.0693 -25.0608 -25.0608 -24.9574 -24.9574 -24.9414 -24.9414 -7.3528 -7.3528 -7.3353 -7.3353 -4.9062 -4.9062 -4.2898 -4.2898 -3.3069 -3.3069 -3.2033 -3.2033 2.6862 2.6862 3.0273 3.0273 4.0192 4.0192 4.3238 4.3238 4.5632 4.5632 4.5663 4.5663 5.1073 5.1073 5.1436 5.1436 5.5112 5.5112 6.2472 6.2472 6.3489 6.3489 6.4155 6.4155 6.9976 6.9976 7.4141 7.4141 7.6782 7.6782 7.8626 7.8626 8.6015 8.6015 8.8284 8.8284 9.0613 9.0613 9.4739 9.4739 10.2207 10.2207 10.3331 10.3331 k = 0.0745 0.3429 0.1512 ( 11962 PWs) bands (ev): -48.9795 -48.9795 -48.9771 -48.9771 -25.6785 -25.6785 -25.6686 -25.6686 -25.0700 -25.0700 -25.0614 -25.0614 -24.9574 -24.9574 -24.9415 -24.9415 -7.3465 -7.3465 -7.3296 -7.3296 -4.8961 -4.8961 -4.2831 -4.2831 -3.3023 -3.3023 -3.1989 -3.1989 2.7009 2.7009 3.0400 3.0400 4.0131 4.0131 4.3202 4.3202 4.5379 4.5379 4.5400 4.5400 5.0978 5.0978 5.1354 5.1354 5.4471 5.4471 6.2007 6.2007 6.3619 6.3619 6.4034 6.4034 7.0010 7.0010 7.4157 7.4157 7.6278 7.6278 7.8435 7.8435 8.6291 8.6291 8.8596 8.8596 9.0947 9.0947 9.4984 9.4984 10.1947 10.1947 10.3279 10.3279 k = 0.0851 0.3429 0.1512 ( 11958 PWs) bands (ev): -48.9794 -48.9794 -48.9770 -48.9770 -25.6790 -25.6790 -25.6690 -25.6690 -25.0707 -25.0707 -25.0620 -25.0620 -24.9574 -24.9574 -24.9416 -24.9416 -7.3393 -7.3393 -7.3231 -7.3231 -4.8844 -4.8844 -4.2755 -4.2755 -3.2971 -3.2971 -3.1940 -3.1940 2.7178 2.7178 3.0545 3.0545 4.0051 4.0051 4.3131 4.3131 4.5095 4.5095 4.5159 4.5159 5.0850 5.0850 5.1192 5.1192 5.3848 5.3848 6.1508 6.1508 6.3598 6.3598 6.4029 6.4029 7.0023 7.0023 7.4161 7.4161 7.5758 7.5758 7.8254 7.8254 8.6594 8.6594 8.8898 8.8898 9.1295 9.1295 9.5260 9.5260 10.1684 10.1684 10.3205 10.3205 k = 0.0957 0.3429 0.1512 ( 11962 PWs) bands (ev): -48.9793 -48.9793 -48.9768 -48.9768 -25.6795 -25.6795 -25.6695 -25.6695 -25.0716 -25.0716 -25.0627 -25.0627 -24.9575 -24.9575 -24.9417 -24.9417 -7.3313 -7.3313 -7.3159 -7.3159 -4.8712 -4.8712 -4.2668 -4.2668 -3.2912 -3.2912 -3.1885 -3.1885 2.7368 2.7368 3.0707 3.0707 3.9945 3.9945 4.3007 4.3007 4.4790 4.4790 4.4956 4.4956 5.0684 5.0684 5.0918 5.0918 5.3285 5.3285 6.1005 6.1005 6.3416 6.3416 6.4126 6.4126 7.0020 7.0020 7.4134 7.4134 7.5250 7.5250 7.8084 7.8084 8.6918 8.6918 8.9181 8.9181 9.1650 9.1650 9.5558 9.5558 10.1428 10.1428 10.3103 10.3103 k = 0.1064 0.3429 0.1512 ( 11960 PWs) bands (ev): -48.9791 -48.9791 -48.9767 -48.9767 -25.6801 -25.6801 -25.6701 -25.6701 -25.0725 -25.0725 -25.0635 -25.0635 -24.9575 -24.9575 -24.9418 -24.9418 -7.3224 -7.3224 -7.3079 -7.3079 -4.8565 -4.8565 -4.2572 -4.2572 -3.2847 -3.2847 -3.1824 -3.1824 2.7579 2.7579 3.0885 3.0885 3.9809 3.9809 4.2814 4.2814 4.4476 4.4476 4.4805 4.4805 5.0427 5.0427 5.0552 5.0552 5.2817 5.2817 6.0518 6.0518 6.3147 6.3147 6.4233 6.4233 7.0012 7.0012 7.4017 7.4017 7.4821 7.4821 7.7923 7.7923 8.7259 8.7259 8.9440 8.9440 9.2009 9.2009 9.5869 9.5869 10.1189 10.1189 10.2972 10.2972 k = 0.1170 0.3429 0.1512 ( 11964 PWs) bands (ev): -48.9790 -48.9790 -48.9766 -48.9766 -25.6807 -25.6807 -25.6707 -25.6707 -25.0735 -25.0735 -25.0644 -25.0644 -24.9575 -24.9575 -24.9420 -24.9420 -7.3128 -7.3128 -7.2991 -7.2991 -4.8404 -4.8404 -4.2466 -4.2466 -3.2777 -3.2777 -3.1758 -3.1758 2.7811 2.7811 3.1079 3.1079 3.9636 3.9636 4.2543 4.2543 4.4160 4.4160 4.4710 4.4710 4.9903 4.9903 5.0277 5.0277 5.2444 5.2444 6.0064 6.0064 6.2809 6.2809 6.4323 6.4323 7.0007 7.0007 7.3707 7.3707 7.4582 7.4582 7.7768 7.7768 8.7612 8.7612 8.9672 8.9672 9.2368 9.2368 9.6181 9.6181 10.0980 10.0980 10.2809 10.2809 k = 0.1277 0.3429 0.1512 ( 11956 PWs) bands (ev): -48.9788 -48.9788 -48.9765 -48.9765 -25.6814 -25.6814 -25.6713 -25.6713 -25.0746 -25.0746 -25.0654 -25.0654 -24.9576 -24.9576 -24.9421 -24.9421 -7.3024 -7.3024 -7.2897 -7.2897 -4.8228 -4.8228 -4.2352 -4.2352 -3.2702 -3.2702 -3.1687 -3.1687 2.8061 2.8061 3.1287 3.1287 3.9420 3.9420 4.2201 4.2201 4.3847 4.3847 4.4665 4.4665 4.9250 4.9250 4.9998 4.9998 5.2130 5.2130 5.9652 5.9652 6.2405 6.2405 6.4390 6.4390 7.0012 7.0012 7.3243 7.3243 7.4497 7.4497 7.7611 7.7611 8.7972 8.7972 8.9876 8.9876 9.2725 9.2725 9.6476 9.6476 10.0815 10.0815 10.2614 10.2614 k = 0.1383 0.3429 0.1512 ( 11954 PWs) bands (ev): -48.9786 -48.9786 -48.9763 -48.9763 -25.6821 -25.6821 -25.6720 -25.6720 -25.0758 -25.0758 -25.0664 -25.0664 -24.9576 -24.9576 -24.9422 -24.9422 -7.2913 -7.2913 -7.2795 -7.2795 -4.8039 -4.8039 -4.2229 -4.2229 -3.2622 -3.2622 -3.1611 -3.1611 2.8331 2.8331 3.1507 3.1507 3.9156 3.9156 4.1797 4.1797 4.3540 4.3540 4.4654 4.4654 4.8548 4.8548 4.9691 4.9691 5.1840 5.1840 5.9289 5.9289 6.1936 6.1936 6.4433 6.4433 7.0031 7.0031 7.2731 7.2731 7.4466 7.4466 7.7448 7.7448 8.8335 8.8335 9.0053 9.0053 9.3079 9.3079 9.6739 9.6739 10.0712 10.0712 10.2390 10.2390 k = 0.1489 0.3429 0.1512 ( 11942 PWs) bands (ev): -48.9784 -48.9784 -48.9761 -48.9761 -25.6829 -25.6829 -25.6728 -25.6728 -25.0770 -25.0770 -25.0675 -25.0675 -24.9575 -24.9575 -24.9424 -24.9424 -7.2795 -7.2795 -7.2688 -7.2688 -4.7835 -4.7835 -4.2097 -4.2097 -3.2538 -3.2538 -3.1532 -3.1532 2.8618 2.8618 3.1739 3.1739 3.8841 3.8841 4.1339 4.1339 4.3241 4.3241 4.4659 4.4659 4.7842 4.7842 4.9361 4.9361 5.1547 5.1547 5.8979 5.8979 6.1408 6.1408 6.4450 6.4450 7.0065 7.0065 7.2215 7.2215 7.4448 7.4448 7.7272 7.7272 8.8698 8.8698 9.0203 9.0203 9.3428 9.3428 9.6954 9.6954 10.0684 10.0684 10.2141 10.2141 k = 0.1596 0.3429 0.1512 ( 11932 PWs) bands (ev): -48.9782 -48.9782 -48.9760 -48.9760 -25.6837 -25.6837 -25.6736 -25.6736 -25.0783 -25.0783 -25.0687 -25.0687 -24.9575 -24.9575 -24.9425 -24.9425 -7.2671 -7.2671 -7.2574 -7.2574 -4.7619 -4.7619 -4.1957 -4.1957 -3.2450 -3.2450 -3.1449 -3.1449 2.8921 2.8921 3.1979 3.1979 3.8475 3.8475 4.0833 4.0833 4.2948 4.2948 4.4658 4.4658 4.7172 4.7172 4.9016 4.9016 5.1236 5.1236 5.8719 5.8719 6.0828 6.0828 6.4441 6.4441 7.0114 7.0114 7.1710 7.1710 7.4430 7.4430 7.7078 7.7078 8.9058 8.9058 9.0329 9.0329 9.3773 9.3773 9.7114 9.7114 10.0740 10.0740 10.1871 10.1871 k = 0.1702 0.3429 0.1512 ( 11938 PWs) bands (ev): -48.9780 -48.9780 -48.9758 -48.9758 -25.6845 -25.6845 -25.6745 -25.6745 -25.0796 -25.0796 -25.0699 -25.0699 -24.9574 -24.9574 -24.9426 -24.9426 -7.2542 -7.2542 -7.2456 -7.2456 -4.7389 -4.7389 -4.1810 -4.1810 -3.2358 -3.2358 -3.1362 -3.1362 2.9240 2.9240 3.2226 3.2226 3.8059 3.8059 4.0281 4.0281 4.2657 4.2657 4.4614 4.4614 4.6586 4.6586 4.8670 4.8670 5.0901 5.0901 5.8505 5.8505 6.0205 6.0205 6.4407 6.4407 7.0174 7.0174 7.1224 7.1224 7.4408 7.4408 7.6862 7.6862 8.9414 8.9414 9.0432 9.0432 9.4111 9.4111 9.7221 9.7221 10.0877 10.0877 10.1586 10.1586 k = 0.1809 0.3429 0.1512 ( 11940 PWs) bands (ev): -48.9778 -48.9778 -48.9756 -48.9756 -25.6854 -25.6854 -25.6754 -25.6754 -25.0810 -25.0810 -25.0712 -25.0712 -24.9574 -24.9574 -24.9428 -24.9428 -7.2409 -7.2409 -7.2331 -7.2331 -4.7147 -4.7147 -4.1655 -4.1655 -3.2264 -3.2264 -3.1273 -3.1273 2.9570 2.9570 3.2478 3.2478 3.7598 3.7598 3.9682 3.9682 4.2362 4.2362 4.4473 4.4473 4.6151 4.6151 4.8333 4.8333 5.0539 5.0539 5.8329 5.8329 5.9552 5.9552 6.4348 6.4348 7.0236 7.0236 7.0765 7.0765 7.4378 7.4378 7.6620 7.6620 8.9764 8.9764 9.0516 9.0516 9.4443 9.4443 9.7287 9.7287 10.1078 10.1078 10.1292 10.1292 k = 0.1915 0.3429 0.1512 ( 11942 PWs) bands (ev): -48.9775 -48.9775 -48.9754 -48.9754 -25.6863 -25.6863 -25.6764 -25.6764 -25.0824 -25.0824 -25.0726 -25.0726 -24.9573 -24.9573 -24.9429 -24.9429 -7.2271 -7.2271 -7.2203 -7.2203 -4.6893 -4.6893 -4.1493 -4.1493 -3.2167 -3.2167 -3.1182 -3.1182 2.9911 2.9911 3.2731 3.2731 3.7098 3.7098 3.9038 3.9038 4.2057 4.2057 4.4192 4.4192 4.5916 4.5916 4.8018 4.8018 5.0151 5.0151 5.8161 5.8161 5.8900 5.8900 6.4264 6.4264 7.0205 7.0205 7.0428 7.0428 7.4339 7.4339 7.6352 7.6352 9.0106 9.0106 9.0583 9.0583 9.4769 9.4769 9.7331 9.7331 10.0983 10.0983 10.1340 10.1340 k = 0.2021 0.3429 0.1512 ( 11940 PWs) bands (ev): -48.9773 -48.9773 -48.9752 -48.9752 -25.6873 -25.6873 -25.6774 -25.6774 -25.0838 -25.0838 -25.0740 -25.0740 -24.9571 -24.9571 -24.9430 -24.9430 -7.2130 -7.2130 -7.2069 -7.2069 -4.6628 -4.6628 -4.1325 -4.1325 -3.2068 -3.2068 -3.1090 -3.1090 3.0255 3.0255 3.2982 3.2982 3.6569 3.6569 3.8351 3.8351 4.1739 4.1739 4.3811 4.3811 4.5849 4.5849 4.7732 4.7732 4.9737 4.9737 5.7857 5.7857 5.8396 5.8396 6.4155 6.4155 6.9848 6.9848 7.0441 7.0441 7.4289 7.4289 7.6057 7.6057 9.0441 9.0441 9.0638 9.0638 9.5086 9.5086 9.7369 9.7369 10.0682 10.0682 10.1626 10.1626 k = 0.2128 0.3429 0.1512 ( 11938 PWs) bands (ev): -48.9770 -48.9770 -48.9750 -48.9750 -25.6882 -25.6882 -25.6784 -25.6784 -25.0853 -25.0853 -25.0755 -25.0755 -24.9570 -24.9570 -24.9432 -24.9432 -7.1986 -7.1986 -7.1932 -7.1932 -4.6351 -4.6351 -4.1152 -4.1152 -3.1969 -3.1969 -3.0996 -3.0996 3.0598 3.0598 3.3227 3.3227 3.6022 3.6022 3.7625 3.7625 4.1405 4.1405 4.3403 4.3403 4.5877 4.5877 4.7480 4.7480 4.9302 4.9302 5.7247 5.7247 5.8213 5.8213 6.4023 6.4023 6.9456 6.9456 7.0511 7.0511 7.4228 7.4228 7.5735 7.5735 9.0673 9.0673 9.0779 9.0779 9.5393 9.5393 9.7413 9.7413 10.0383 10.0383 10.1932 10.1932 k = 0.2234 0.3429 0.1512 ( 11936 PWs) bands (ev): -48.9768 -48.9768 -48.9748 -48.9748 -25.6892 -25.6892 -25.6795 -25.6795 -25.0868 -25.0868 -25.0770 -25.0770 -24.9568 -24.9568 -24.9433 -24.9433 -7.1841 -7.1841 -7.1791 -7.1791 -4.6065 -4.6065 -4.0973 -4.0973 -3.1869 -3.1869 -3.0902 -3.0902 3.0924 3.0924 3.3459 3.3459 3.5476 3.5476 3.6868 3.6868 4.1056 4.1056 4.3017 4.3017 4.5952 4.5952 4.7264 4.7264 4.8851 4.8851 5.6529 5.6529 5.8152 5.8152 6.3867 6.3867 6.9082 6.9082 7.0581 7.0581 7.4154 7.4154 7.5390 7.5390 9.0715 9.0715 9.1099 9.1099 9.5691 9.5691 9.7471 9.7471 10.0091 10.0091 10.2246 10.2246 k = 0.2340 0.3429 0.1512 ( 11948 PWs) bands (ev): -48.9765 -48.9765 -48.9746 -48.9746 -25.6902 -25.6902 -25.6806 -25.6806 -25.0882 -25.0882 -25.0785 -25.0785 -24.9566 -24.9566 -24.9434 -24.9434 -7.1695 -7.1695 -7.1647 -7.1647 -4.5769 -4.5769 -4.0790 -4.0790 -3.1768 -3.1768 -3.0808 -3.0808 3.1209 3.1209 3.3671 3.3671 3.4962 3.4962 3.6091 3.6091 4.0694 4.0694 4.2672 4.2672 4.6049 4.6049 4.7082 4.7082 4.8389 4.8389 5.5789 5.5789 5.8134 5.8134 6.3689 6.3689 6.8730 6.8730 7.0642 7.0642 7.4067 7.4067 7.5026 7.5026 9.0750 9.0750 9.1417 9.1417 9.5979 9.5979 9.7548 9.7548 9.9808 9.9808 10.2561 10.2561 k = 0.2447 0.3429 0.1512 ( 11950 PWs) bands (ev): -48.9763 -48.9763 -48.9745 -48.9745 -25.6912 -25.6912 -25.6818 -25.6818 -25.0897 -25.0897 -25.0800 -25.0800 -24.9563 -24.9563 -24.9435 -24.9435 -7.1549 -7.1549 -7.1500 -7.1500 -4.5463 -4.5463 -4.0603 -4.0603 -3.1669 -3.1669 -3.0715 -3.0715 3.1405 3.1405 3.3840 3.3840 3.4536 3.4536 3.5314 3.5314 4.0324 4.0324 4.2380 4.2380 4.6150 4.6150 4.6930 4.6930 4.7929 4.7929 5.5046 5.5046 5.8139 5.8139 6.3489 6.3489 6.8400 6.8400 7.0689 7.0689 7.3965 7.3965 7.4647 7.4647 9.0787 9.0787 9.1731 9.1731 9.6254 9.6254 9.7645 9.7645 9.9538 9.9538 10.2872 10.2872 k = 0.2553 0.3429 0.1512 ( 11956 PWs) bands (ev): -48.9760 -48.9760 -48.9743 -48.9743 -25.6922 -25.6922 -25.6829 -25.6829 -25.0911 -25.0911 -25.0816 -25.0816 -24.9561 -24.9561 -24.9436 -24.9436 -7.1403 -7.1403 -7.1351 -7.1351 -4.5150 -4.5150 -4.0414 -4.0414 -3.1570 -3.1570 -3.0624 -3.0624 3.1436 3.1436 3.3875 3.3875 3.4284 3.4284 3.4627 3.4627 3.9949 3.9949 4.2142 4.2142 4.6230 4.6230 4.6806 4.6806 4.7490 4.7490 5.4310 5.4310 5.8163 5.8163 6.3271 6.3271 6.8092 6.8092 7.0715 7.0715 7.3843 7.3843 7.4266 7.4266 9.0827 9.0827 9.2042 9.2042 9.6519 9.6519 9.7763 9.7763 9.9280 9.9280 10.3177 10.3177 k = 0.2660 0.3429 0.1512 ( 11960 PWs) bands (ev): -48.9758 -48.9758 -48.9741 -48.9741 -25.6932 -25.6932 -25.6841 -25.6841 -25.0926 -25.0926 -25.0832 -25.0832 -24.9558 -24.9558 -24.9437 -24.9437 -7.1258 -7.1258 -7.1201 -7.1201 -4.4830 -4.4830 -4.0222 -4.0222 -3.1473 -3.1473 -3.0535 -3.0535 3.1238 3.1238 3.3449 3.3449 3.4196 3.4196 3.4439 3.4439 3.9575 3.9575 4.1961 4.1961 4.6224 4.6224 4.6709 4.6709 4.7128 4.7128 5.3590 5.3590 5.8200 5.8200 6.3036 6.3036 6.7804 6.7804 7.0714 7.0714 7.3681 7.3681 7.3909 7.3909 9.0874 9.0874 9.2350 9.2350 9.6771 9.6771 9.7899 9.7899 9.9037 9.9037 10.3473 10.3473 k = 0.2766 0.3429 0.1512 ( 11968 PWs) bands (ev): -48.9755 -48.9755 -48.9739 -48.9739 -25.6942 -25.6942 -25.6853 -25.6853 -25.0940 -25.0940 -25.0847 -25.0847 -24.9555 -24.9555 -24.9438 -24.9438 -7.1114 -7.1114 -7.1052 -7.1052 -4.4503 -4.4503 -4.0030 -4.0030 -3.1379 -3.1379 -3.0449 -3.0449 3.0835 3.0835 3.2703 3.2703 3.4330 3.4330 3.4532 3.4532 3.9206 3.9206 4.1835 4.1835 4.6028 4.6028 4.6615 4.6615 4.6967 4.6967 5.2895 5.2895 5.8247 5.8247 6.2788 6.2788 6.7535 6.7535 7.0678 7.0678 7.3410 7.3410 7.3659 7.3659 9.0930 9.0930 9.2655 9.2655 9.7013 9.7013 9.8050 9.8050 9.8810 9.8810 10.3760 10.3760 k = 0.2872 0.3429 0.1512 ( 11968 PWs) bands (ev): -48.9752 -48.9752 -48.9737 -48.9737 -25.6952 -25.6952 -25.6865 -25.6865 -25.0953 -25.0953 -25.0863 -25.0863 -24.9552 -24.9552 -24.9439 -24.9439 -7.0971 -7.0971 -7.0903 -7.0903 -4.4170 -4.4170 -3.9838 -3.9838 -3.1287 -3.1287 -3.0366 -3.0366 3.0308 3.0308 3.1914 3.1914 3.4519 3.4519 3.4724 3.4724 3.8845 3.8845 4.1762 4.1762 4.5666 4.5666 4.6493 4.6493 4.7004 4.7004 5.2232 5.2232 5.8304 5.8304 6.2531 6.2531 6.7283 6.7283 7.0596 7.0596 7.3075 7.3075 7.3483 7.3483 9.0996 9.0996 9.2959 9.2959 9.7244 9.7244 9.8209 9.8209 9.8604 9.8604 10.4038 10.4038 k = 0.2979 0.3429 0.1512 ( 11974 PWs) bands (ev): -48.9750 -48.9750 -48.9735 -48.9735 -25.6961 -25.6961 -25.6878 -25.6878 -25.0967 -25.0967 -25.0879 -25.0879 -24.9548 -24.9548 -24.9441 -24.9441 -7.0830 -7.0830 -7.0757 -7.0757 -4.3833 -4.3833 -3.9647 -3.9647 -3.1198 -3.1198 -3.0288 -3.0288 2.9719 2.9719 3.1125 3.1125 3.4615 3.4615 3.5063 3.5063 3.8497 3.8497 4.1738 4.1738 4.5242 4.5242 4.6358 4.6358 4.7115 4.7115 5.1613 5.1613 5.8367 5.8367 6.2268 6.2268 6.7045 6.7045 7.0457 7.0457 7.2761 7.2761 7.3312 7.3312 9.1074 9.1074 9.3262 9.3262 9.7464 9.7464 9.8307 9.8307 9.8486 9.8486 10.4305 10.4305 k = 0.3085 0.3429 0.1512 ( 11974 PWs) bands (ev): -48.9747 -48.9747 -48.9733 -48.9733 -25.6971 -25.6971 -25.6890 -25.6890 -25.0979 -25.0979 -25.0894 -25.0894 -24.9545 -24.9545 -24.9442 -24.9442 -7.0691 -7.0691 -7.0614 -7.0614 -4.3493 -4.3493 -3.9460 -3.9460 -3.1112 -3.1112 -3.0215 -3.0215 2.9102 2.9102 3.0351 3.0351 3.4662 3.4662 3.5465 3.5465 3.8165 3.8165 4.1757 4.1757 4.4807 4.4807 4.6201 4.6201 4.7248 4.7248 5.1048 5.1048 5.8436 5.8436 6.2004 6.2004 6.6819 6.6819 7.0251 7.0251 7.2491 7.2491 7.3134 7.3134 9.1164 9.1164 9.3565 9.3565 9.7663 9.7663 9.8185 9.8185 9.8621 9.8621 10.4562 10.4562 k = 0.3191 0.3429 0.1512 ( 11984 PWs) bands (ev): -48.9745 -48.9745 -48.9731 -48.9731 -25.6980 -25.6980 -25.6902 -25.6902 -25.0992 -25.0992 -25.0909 -25.0909 -24.9541 -24.9541 -24.9443 -24.9443 -7.0555 -7.0555 -7.0474 -7.0474 -4.3150 -4.3150 -3.9276 -3.9276 -3.1031 -3.1031 -3.0147 -3.0147 2.8480 2.8480 2.9596 2.9596 3.4680 3.4680 3.5886 3.5886 3.7857 3.7857 4.1809 4.1809 4.4380 4.4380 4.6009 4.6009 4.7388 4.7388 5.0547 5.0547 5.8510 5.8510 6.1744 6.1744 6.6603 6.6603 6.9977 6.9977 7.2272 7.2272 7.2950 7.2950 9.1265 9.1265 9.3869 9.3869 9.7781 9.7781 9.8098 9.8098 9.8810 9.8810 10.4802 10.4802 k = 0.3298 0.3429 0.1512 ( 11982 PWs) bands (ev): -48.9743 -48.9743 -48.9730 -48.9730 -25.6989 -25.6989 -25.6914 -25.6914 -25.1003 -25.1003 -25.0924 -25.0924 -24.9537 -24.9537 -24.9444 -24.9444 -7.0422 -7.0422 -7.0338 -7.0338 -4.2807 -4.2807 -3.9097 -3.9097 -3.0953 -3.0953 -3.0085 -3.0085 2.7863 2.7863 2.8866 2.8866 3.4675 3.4675 3.6296 3.6296 3.7592 3.7592 4.1884 4.1884 4.3976 4.3976 4.5773 4.5773 4.7531 4.7531 5.0121 5.0121 5.8587 5.8587 6.1493 6.1493 6.6393 6.6393 6.9646 6.9646 7.2099 7.2099 7.2760 7.2760 9.1378 9.1378 9.4174 9.4174 9.7698 9.7698 9.8209 9.8209 9.9009 9.9009 10.4916 10.4916 k = 0.3404 0.3429 0.1512 ( 11984 PWs) bands (ev): -48.9740 -48.9740 -48.9728 -48.9728 -25.6997 -25.6997 -25.6926 -25.6926 -25.1014 -25.1014 -25.0938 -25.0938 -24.9533 -24.9533 -24.9445 -24.9445 -7.0293 -7.0293 -7.0207 -7.0207 -4.2463 -4.2463 -3.8926 -3.8926 -3.0879 -3.0879 -3.0030 -3.0030 2.7260 2.7260 2.8163 2.8163 3.4652 3.4652 3.6614 3.6614 3.7443 3.7443 4.1966 4.1966 4.3605 4.3605 4.5487 4.5487 4.7671 4.7671 4.9774 4.9774 5.8668 5.8668 6.1255 6.1255 6.6188 6.6188 6.9272 6.9272 7.1962 7.1962 7.2566 7.2566 9.1502 9.1502 9.4482 9.4482 9.7531 9.7531 9.8402 9.8402 9.9212 9.9212 10.4727 10.4727 k = 0.3511 0.3429 0.1512 ( 11976 PWs) bands (ev): -48.9738 -48.9738 -48.9727 -48.9727 -25.7005 -25.7005 -25.6937 -25.6937 -25.1025 -25.1025 -25.0952 -25.0952 -24.9529 -24.9529 -24.9446 -24.9446 -7.0169 -7.0169 -7.0082 -7.0082 -4.2121 -4.2121 -3.8764 -3.8764 -3.0809 -3.0809 -2.9982 -2.9982 2.6678 2.6678 2.7492 2.7492 3.4615 3.4615 3.6655 3.6655 3.7590 3.7590 4.2031 4.2031 4.3289 4.3289 4.5154 4.5154 4.7808 4.7808 4.9502 4.9502 5.8753 5.8753 6.1035 6.1035 6.5986 6.5986 6.8870 6.8870 7.1847 7.1847 7.2372 7.2372 9.1637 9.1637 9.4793 9.4793 9.7347 9.7347 9.8610 9.8610 9.9415 9.9415 10.4482 10.4482 k = 0.3617 0.3429 0.1512 ( 11982 PWs) bands (ev): -48.9736 -48.9736 -48.9725 -48.9725 -25.7013 -25.7013 -25.6949 -25.6949 -25.1034 -25.1034 -25.0966 -25.0966 -24.9525 -24.9525 -24.9448 -24.9448 -7.0051 -7.0051 -6.9964 -6.9964 -4.1782 -4.1782 -3.8612 -3.8612 -3.0743 -3.0743 -2.9941 -2.9941 2.6121 2.6121 2.6855 2.6855 3.4570 3.4570 3.6487 3.6487 3.7963 3.7963 4.2038 4.2038 4.3063 4.3063 4.4782 4.4782 4.7940 4.7940 4.9299 4.9299 5.8840 5.8840 6.0836 6.0836 6.5784 6.5784 6.8451 6.8451 7.1747 7.1747 7.2180 7.2180 9.1781 9.1781 9.5109 9.5109 9.7155 9.7155 9.8823 9.8823 9.9615 9.9615 10.4217 10.4217 k = 0.3723 0.3429 0.1512 ( 11988 PWs) bands (ev): -48.9734 -48.9734 -48.9724 -48.9724 -25.7019 -25.7019 -25.6960 -25.6960 -25.1043 -25.1043 -25.0979 -25.0979 -24.9521 -24.9521 -24.9449 -24.9449 -6.9937 -6.9937 -6.9852 -6.9852 -4.1448 -4.1448 -3.8473 -3.8473 -3.0680 -3.0680 -2.9908 -2.9908 2.5594 2.5594 2.6253 2.6253 3.4520 3.4520 3.6272 3.6272 3.8394 3.8394 4.1946 4.1946 4.2962 4.2962 4.4386 4.4386 4.8065 4.8065 4.9151 4.9151 5.8931 5.8931 6.0661 6.0661 6.5582 6.5582 6.8026 6.8026 7.1655 7.1655 7.1994 7.1994 9.1934 9.1934 9.5429 9.5429 9.6957 9.6957 9.9037 9.9037 9.9809 9.9809 10.3937 10.3937 k = 0.3830 0.3429 0.1512 ( 11990 PWs) bands (ev): -48.9732 -48.9732 -48.9723 -48.9723 -25.7026 -25.7026 -25.6970 -25.6970 -25.1051 -25.1051 -25.0991 -25.0991 -24.9517 -24.9517 -24.9451 -24.9451 -6.9830 -6.9830 -6.9747 -6.9747 -4.1119 -4.1119 -3.8348 -3.8348 -3.0621 -3.0621 -2.9883 -2.9883 2.5099 2.5099 2.5690 2.5690 3.4470 3.4470 3.6053 3.6053 3.8838 3.8838 4.1770 4.1770 4.2968 4.2968 4.3977 4.3977 4.8181 4.8181 4.9047 4.9047 5.9025 5.9025 6.0513 6.0513 6.5379 6.5379 6.7599 6.7599 7.1568 7.1568 7.1817 7.1817 9.2095 9.2095 9.5755 9.5755 9.6753 9.6753 9.9251 9.9251 9.9996 9.9996 10.3643 10.3643 k = 0.3936 0.3429 0.1512 ( 11996 PWs) bands (ev): -48.9730 -48.9730 -48.9722 -48.9722 -25.7031 -25.7031 -25.6980 -25.6980 -25.1058 -25.1058 -25.1003 -25.1003 -24.9513 -24.9513 -24.9452 -24.9452 -6.9730 -6.9730 -6.9650 -6.9650 -4.0798 -4.0798 -3.8239 -3.8239 -3.0564 -3.0564 -2.9865 -2.9865 2.4641 2.4641 2.5168 2.5168 3.4421 3.4421 3.5842 3.5842 3.9280 3.9280 4.1559 4.1559 4.3025 4.3025 4.3569 4.3569 4.8288 4.8288 4.8976 4.8976 5.9123 5.9123 6.0394 6.0394 6.5175 6.5175 6.7178 6.7178 7.1485 7.1485 7.1652 7.1652 9.2264 9.2264 9.6085 9.6085 9.6546 9.6546 9.9462 9.9462 10.0172 10.0172 10.3337 10.3337 k = 0.4043 0.3429 0.1512 ( 11992 PWs) bands (ev): -48.9728 -48.9728 -48.9721 -48.9721 -25.7036 -25.7036 -25.6990 -25.6990 -25.1064 -25.1064 -25.1014 -25.1014 -24.9509 -24.9509 -24.9454 -24.9454 -6.9637 -6.9637 -6.9562 -6.9562 -4.0486 -4.0486 -3.8149 -3.8149 -3.0510 -3.0510 -2.9856 -2.9856 2.4222 2.4222 2.4688 2.4688 3.4378 3.4378 3.5643 3.5643 3.9712 3.9712 4.1350 4.1350 4.3078 4.3078 4.3186 4.3186 4.8386 4.8386 4.8929 4.8929 5.9224 5.9224 6.0304 6.0304 6.4973 6.4973 6.6764 6.6764 7.1403 7.1403 7.1501 7.1501 9.2439 9.2439 9.6296 9.6296 9.6459 9.6459 9.9668 9.9668 10.0336 10.0336 10.3019 10.3019 k = 0.4149 0.3429 0.1512 ( 11998 PWs) bands (ev): -48.9727 -48.9727 -48.9720 -48.9720 -25.7041 -25.7041 -25.6999 -25.6999 -25.1069 -25.1069 -25.1025 -25.1025 -24.9505 -24.9505 -24.9456 -24.9456 -6.9552 -6.9552 -6.9482 -6.9482 -4.0186 -4.0186 -3.8078 -3.8078 -3.0458 -3.0458 -2.9855 -2.9855 2.3843 2.3843 2.4251 2.4251 3.4342 3.4342 3.5457 3.5457 4.0130 4.0130 4.1160 4.1160 4.2777 4.2777 4.3166 4.3166 4.8473 4.8473 4.8898 4.8898 5.9330 5.9330 6.0241 6.0241 6.4776 6.4776 6.6364 6.6364 7.1322 7.1322 7.1370 7.1370 9.2620 9.2620 9.6094 9.6094 9.6787 9.6787 9.9867 9.9867 10.0484 10.0484 10.2689 10.2689 k = 0.4255 0.3429 0.1512 ( 11992 PWs) bands (ev): -48.9725 -48.9725 -48.9719 -48.9719 -25.7044 -25.7044 -25.7008 -25.7008 -25.1074 -25.1074 -25.1034 -25.1034 -24.9501 -24.9501 -24.9458 -24.9458 -6.9476 -6.9476 -6.9412 -6.9412 -3.9898 -3.9898 -3.8029 -3.8029 -3.0407 -3.0407 -2.9861 -2.9861 2.3507 2.3507 2.3860 2.3860 3.4315 3.4315 3.5285 3.5285 4.0529 4.0529 4.0997 4.0997 4.2420 4.2420 4.3209 4.3209 4.8550 4.8550 4.8879 4.8879 5.9439 5.9439 6.0204 6.0204 6.4587 6.4587 6.5978 6.5978 7.1232 7.1232 7.1268 7.1268 9.2807 9.2807 9.5871 9.5871 9.7140 9.7140 10.0056 10.0056 10.0613 10.0613 10.2350 10.2350 k = 0.4362 0.3429 0.1512 ( 11984 PWs) bands (ev): -48.9724 -48.9724 -48.9719 -48.9719 -25.7047 -25.7047 -25.7015 -25.7015 -25.1077 -25.1077 -25.1043 -25.1043 -24.9497 -24.9497 -24.9460 -24.9460 -6.9407 -6.9407 -6.9351 -6.9351 -3.9624 -3.9624 -3.8003 -3.8003 -3.0356 -3.0356 -2.9874 -2.9874 2.3216 2.3216 2.3515 2.3515 3.4298 3.4298 3.5126 3.5126 4.0831 4.0831 4.0939 4.0939 4.2091 4.2091 4.3228 4.3228 4.8617 4.8617 4.8868 4.8868 5.9550 5.9550 6.0187 6.0187 6.4413 6.4413 6.5613 6.5613 7.1140 7.1140 7.1192 7.1192 9.3000 9.3000 9.5642 9.5642 9.7500 9.7500 10.0233 10.0233 10.0723 10.0723 10.2003 10.2003 k = 0.4468 0.3429 0.1512 ( 11994 PWs) bands (ev): -48.9722 -48.9722 -48.9718 -48.9718 -25.7049 -25.7049 -25.7022 -25.7022 -25.1079 -25.1079 -25.1051 -25.1051 -24.9493 -24.9493 -24.9462 -24.9462 -6.9348 -6.9348 -6.9300 -6.9300 -3.9367 -3.9367 -3.8002 -3.8002 -3.0307 -3.0307 -2.9894 -2.9894 2.2970 2.2970 2.3217 2.3217 3.4294 3.4294 3.4982 3.4982 4.0752 4.0752 4.1262 4.1262 4.1803 4.1803 4.3219 4.3219 4.8673 4.8673 4.8861 4.8861 5.9662 5.9662 6.0186 6.0186 6.4260 6.4260 6.5272 6.5272 7.1062 7.1062 7.1125 7.1125 9.3199 9.3199 9.5412 9.5412 9.7867 9.7867 10.0395 10.0395 10.0808 10.0808 10.1649 10.1649 k = 0.4574 0.3429 0.1512 ( 11998 PWs) bands (ev): -48.9721 -48.9721 -48.9718 -48.9718 -25.7050 -25.7050 -25.7029 -25.7029 -25.1081 -25.1081 -25.1058 -25.1058 -24.9490 -24.9490 -24.9465 -24.9465 -6.9298 -6.9298 -6.9259 -6.9259 -3.9127 -3.9127 -3.8026 -3.8026 -3.0258 -3.0258 -2.9920 -2.9920 2.2772 2.2772 2.2969 2.2969 3.4301 3.4301 3.4851 3.4851 4.0686 4.0686 4.1434 4.1434 4.1695 4.1695 4.3178 4.3178 4.8719 4.8719 4.8857 4.8857 5.9773 5.9773 6.0191 6.0191 6.4138 6.4138 6.4959 6.4959 7.1001 7.1001 7.1067 7.1067 9.3402 9.3402 9.5180 9.5180 9.8239 9.8239 10.0540 10.0540 10.0862 10.0862 10.1297 10.1297 k = 0.4681 0.3429 0.1512 ( 12002 PWs) bands (ev): -48.9720 -48.9720 -48.9718 -48.9718 -25.7050 -25.7050 -25.7034 -25.7034 -25.1081 -25.1081 -25.1064 -25.1064 -24.9486 -24.9486 -24.9467 -24.9467 -6.9258 -6.9258 -6.9228 -6.9228 -3.8907 -3.8907 -3.8075 -3.8075 -3.0210 -3.0210 -2.9952 -2.9952 2.2622 2.2622 2.2769 2.2769 3.4322 3.4322 3.4734 3.4734 4.0656 4.0656 4.1253 4.1253 4.1949 4.1949 4.3103 4.3103 4.8757 4.8757 4.8853 4.8853 5.9879 5.9879 6.0195 6.0195 6.4056 6.4056 6.4681 6.4681 7.0958 7.0958 7.1017 7.1017 9.3611 9.3611 9.4948 9.4948 9.8615 9.8615 10.0666 10.0666 10.0811 10.0811 10.1020 10.1020 k = 0.4787 0.3429 0.1512 ( 12008 PWs) bands (ev): -48.9720 -48.9720 -48.9718 -48.9718 -25.7050 -25.7050 -25.7039 -25.7039 -25.1081 -25.1081 -25.1069 -25.1069 -24.9483 -24.9483 -24.9470 -24.9470 -6.9227 -6.9227 -6.9207 -6.9207 -3.8709 -3.8709 -3.8151 -3.8151 -3.0162 -3.0162 -2.9988 -2.9988 2.2522 2.2522 2.2619 2.2619 3.4356 3.4356 3.4631 3.4631 4.0663 4.0663 4.1064 4.1064 4.2218 4.2218 4.2994 4.2994 4.8787 4.8787 4.8847 4.8847 5.9975 5.9975 6.0189 6.0189 6.4021 6.4021 6.4444 6.4444 7.0932 7.0932 7.0976 7.0976 9.3824 9.3824 9.4718 9.4718 9.8994 9.8994 10.0500 10.0500 10.0772 10.0772 10.0972 10.0972 k = 0.4894 0.3429 0.1512 ( 12000 PWs) bands (ev): -48.9719 -48.9719 -48.9718 -48.9718 -25.7048 -25.7048 -25.7043 -25.7043 -25.1079 -25.1079 -25.1074 -25.1074 -24.9479 -24.9479 -24.9473 -24.9473 -6.9207 -6.9207 -6.9197 -6.9197 -3.8533 -3.8533 -3.8253 -3.8253 -3.0115 -3.0115 -3.0028 -3.0028 2.2471 2.2471 2.2519 2.2519 3.4404 3.4404 3.4541 3.4541 4.0706 4.0706 4.0908 4.0908 4.2461 4.2461 4.2850 4.2850 4.8810 4.8810 4.8839 4.8839 6.0058 6.0058 6.0166 6.0166 6.4041 6.4041 6.4255 6.4255 7.0922 7.0922 7.0945 7.0945 9.4042 9.4042 9.4489 9.4489 9.9374 9.9374 10.0131 10.0131 10.0856 10.0856 10.0953 10.0953 k = 0.5000 0.3429 0.1512 ( 12004 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9197 -6.9197 -6.9197 -6.9197 -3.8380 -3.8380 -3.8380 -3.8380 -3.0070 -3.0070 -3.0070 -3.0070 2.2470 2.2470 2.2470 2.2470 3.4466 3.4466 3.4466 3.4466 4.0788 4.0788 4.0788 4.0788 4.2672 4.2672 4.2672 4.2672 4.8827 4.8827 4.8827 4.8827 6.0122 6.0122 6.0122 6.0122 6.4120 6.4120 6.4120 6.4120 7.0927 7.0927 7.0927 7.0927 9.4264 9.4264 9.4264 9.4264 9.9754 9.9754 9.9754 9.9754 10.0916 10.0916 10.0916 10.0916 k = 0.5000 0.3429 0.1512 ( 12004 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9197 -6.9197 -6.9197 -6.9197 -3.8380 -3.8380 -3.8380 -3.8380 -3.0070 -3.0070 -3.0070 -3.0070 2.2470 2.2470 2.2470 2.2470 3.4466 3.4466 3.4466 3.4466 4.0788 4.0788 4.0788 4.0788 4.2672 4.2672 4.2672 4.2672 4.8827 4.8827 4.8827 4.8827 6.0122 6.0122 6.0122 6.0122 6.4120 6.4120 6.4120 6.4120 7.0927 7.0927 7.0927 7.0927 9.4264 9.4264 9.4264 9.4264 9.9754 9.9754 9.9754 9.9754 10.0916 10.0916 10.0916 10.0916 k = 0.5000 0.3468 0.1424 ( 12010 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9197 -6.9197 -6.9197 -6.9197 -3.8381 -3.8381 -3.8381 -3.8381 -3.0068 -3.0068 -3.0068 -3.0068 2.2476 2.2476 2.2477 2.2477 3.4457 3.4457 3.4458 3.4458 4.0751 4.0751 4.0766 4.0766 4.2689 4.2689 4.2711 4.2711 4.8816 4.8816 4.8818 4.8818 6.0130 6.0130 6.0134 6.0134 6.4109 6.4109 6.4120 6.4120 7.0931 7.0931 7.0936 7.0936 9.4273 9.4273 9.4275 9.4275 9.9753 9.9753 9.9757 9.9757 10.0914 10.0914 10.0919 10.0919 k = 0.5000 0.3507 0.1336 ( 12012 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9200 -6.9200 -6.9200 -6.9200 -3.8382 -3.8382 -3.8381 -3.8381 -3.0060 -3.0060 -3.0059 -3.0059 2.2496 2.2496 2.2497 2.2497 3.4432 3.4432 3.4433 3.4433 4.0663 4.0663 4.0689 4.0689 4.2758 4.2758 4.2798 4.2798 4.8785 4.8785 4.8789 4.8789 6.0157 6.0157 6.0164 6.0164 6.4087 6.4087 6.4111 6.4111 7.0948 7.0948 7.0959 7.0959 9.4301 9.4301 9.4306 9.4306 9.9754 9.9754 9.9761 9.9761 10.0914 10.0914 10.0924 10.0924 k = 0.5000 0.3546 0.1248 ( 12010 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9204 -6.9204 -6.9203 -6.9203 -3.8384 -3.8384 -3.8383 -3.8383 -3.0047 -3.0047 -3.0046 -3.0046 2.2529 2.2529 2.2530 2.2530 3.4389 3.4389 3.4391 3.4391 4.0536 4.0536 4.0569 4.0569 4.2867 4.2867 4.2922 4.2922 4.8735 4.8735 4.8740 4.8740 6.0200 6.0200 6.0212 6.0212 6.4056 6.4056 6.4092 6.4092 7.0978 7.0978 7.0994 7.0994 9.4349 9.4349 9.4356 9.4356 9.9756 9.9756 9.9766 9.9766 10.0916 10.0916 10.0931 10.0931 k = 0.5000 0.3585 0.1160 ( 12004 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9209 -6.9209 -6.9209 -6.9209 -3.8387 -3.8387 -3.8385 -3.8385 -3.0028 -3.0028 -3.0027 -3.0027 2.2574 2.2574 2.2576 2.2576 3.4329 3.4329 3.4332 3.4332 4.0385 4.0385 4.0421 4.0421 4.3005 4.3005 4.3069 4.3069 4.8666 4.8666 4.8672 4.8672 6.0256 6.0256 6.0275 6.0275 6.4016 6.4016 6.4065 6.4065 7.1022 7.1022 7.1044 7.1044 9.4415 9.4415 9.4425 9.4425 9.9760 9.9760 9.9773 9.9773 10.0920 10.0920 10.0939 10.0939 k = 0.5000 0.3624 0.1072 ( 11994 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9216 -6.9216 -6.9216 -6.9216 -3.8390 -3.8390 -3.8388 -3.8388 -3.0004 -3.0004 -3.0003 -3.0003 2.2632 2.2632 2.2634 2.2634 3.4250 3.4250 3.4254 3.4254 4.0222 4.0222 4.0257 4.0257 4.3160 4.3160 4.3230 4.3230 4.8580 4.8580 4.8587 4.8587 6.0320 6.0320 6.0349 6.0349 6.3967 6.3967 6.4031 6.4031 7.1080 7.1080 7.1108 7.1108 9.4499 9.4499 9.4512 9.4512 9.9765 9.9765 9.9782 9.9782 10.0925 10.0925 10.0949 10.0949 k = 0.5000 0.3624 0.1072 ( 11994 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9216 -6.9216 -6.9216 -6.9216 -3.8390 -3.8390 -3.8388 -3.8388 -3.0004 -3.0004 -3.0003 -3.0003 2.2632 2.2632 2.2634 2.2634 3.4250 3.4250 3.4254 3.4254 4.0222 4.0222 4.0257 4.0257 4.3160 4.3160 4.3230 4.3230 4.8580 4.8580 4.8587 4.8587 6.0320 6.0320 6.0349 6.0349 6.3967 6.3967 6.4031 6.4031 7.1080 7.1080 7.1108 7.1108 9.4499 9.4499 9.4512 9.4512 9.9765 9.9765 9.9782 9.9782 10.0925 10.0925 10.0949 10.0949 k = 0.5000 0.3611 0.0971 ( 11980 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9213 -6.9213 -6.9213 -6.9213 -3.8388 -3.8388 -3.8386 -3.8386 -3.0014 -3.0014 -3.0013 -3.0013 2.2702 2.2702 2.2705 2.2705 3.4131 3.4131 3.4136 3.4136 4.0030 4.0030 4.0063 4.0063 4.3384 4.3384 4.3456 4.3456 4.8605 4.8605 4.8606 4.8606 6.0378 6.0378 6.0414 6.0414 6.3901 6.3901 6.3972 6.3972 7.1161 7.1161 7.1185 7.1185 9.4484 9.4484 9.4494 9.4494 9.9732 9.9732 9.9747 9.9747 10.0930 10.0930 10.0953 10.0953 k = 0.5000 0.3598 0.0870 ( 11982 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9211 -6.9211 -6.9211 -6.9211 -3.8386 -3.8386 -3.8385 -3.8385 -3.0025 -3.0025 -3.0024 -3.0024 2.2785 2.2785 2.2788 2.2788 3.3986 3.3986 3.3992 3.3992 3.9838 3.9838 3.9868 3.9868 4.3628 4.3628 4.3701 4.3701 4.8618 4.8618 4.8622 4.8622 6.0441 6.0441 6.0484 6.0484 6.3820 6.3820 6.3899 6.3899 7.1261 7.1261 7.1282 7.1282 9.4471 9.4471 9.4479 9.4479 9.9691 9.9691 9.9704 9.9704 10.0936 10.0936 10.0958 10.0958 k = 0.5000 0.3585 0.0769 ( 11986 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9209 -6.9209 -6.9209 -6.9209 -3.8385 -3.8385 -3.8383 -3.8383 -3.0035 -3.0035 -3.0034 -3.0034 2.2880 2.2880 2.2883 2.2883 3.3819 3.3819 3.3826 3.3826 3.9650 3.9650 3.9677 3.9677 4.3886 4.3886 4.3960 4.3960 4.8622 4.8622 4.8631 4.8631 6.0507 6.0507 6.0557 6.0557 6.3729 6.3729 6.3813 6.3813 7.1376 7.1376 7.1394 7.1394 9.4461 9.4461 9.4468 9.4468 9.9643 9.9643 9.9655 9.9655 10.0942 10.0942 10.0964 10.0964 k = 0.5000 0.3572 0.0669 ( 11978 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9207 -6.9207 -6.9207 -6.9207 -3.8383 -3.8383 -3.8381 -3.8381 -3.0044 -3.0044 -3.0043 -3.0043 2.2984 2.2984 2.2987 2.2987 3.3636 3.3636 3.3644 3.3644 3.9468 3.9468 3.9492 3.9492 4.4155 4.4155 4.4228 4.4228 4.8618 4.8618 4.8632 4.8632 6.0574 6.0574 6.0630 6.0630 6.3629 6.3629 6.3719 6.3719 7.1503 7.1503 7.1519 7.1519 9.4454 9.4454 9.4459 9.4459 9.9591 9.9591 9.9602 9.9602 10.0948 10.0948 10.0970 10.0970 k = 0.5000 0.3559 0.0568 ( 11982 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9205 -6.9205 -6.9205 -6.9205 -3.8381 -3.8381 -3.8379 -3.8379 -3.0053 -3.0053 -3.0052 -3.0052 2.3096 2.3096 2.3098 2.3098 3.3443 3.3443 3.3451 3.3451 3.9294 3.9294 3.9315 3.9315 4.4428 4.4428 4.4501 4.4501 4.8606 4.8606 4.8625 4.8625 6.0639 6.0639 6.0701 6.0701 6.3526 6.3526 6.3619 6.3619 7.1637 7.1637 7.1652 7.1652 9.4448 9.4448 9.4452 9.4452 9.9535 9.9535 9.9545 9.9545 10.0956 10.0956 10.0976 10.0976 k = 0.5000 0.3546 0.0467 ( 11986 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9203 -6.9203 -6.9203 -6.9203 -3.8379 -3.8379 -3.8378 -3.8378 -3.0061 -3.0061 -3.0061 -3.0061 2.3212 2.3212 2.3215 2.3215 3.3243 3.3243 3.3251 3.3251 3.9131 3.9131 3.9149 3.9149 4.4703 4.4703 4.4774 4.4774 4.8585 4.8585 4.8608 4.8608 6.0701 6.0701 6.0767 6.0767 6.3423 6.3423 6.3518 6.3518 7.1776 7.1776 7.1788 7.1788 9.4443 9.4443 9.4446 9.4446 9.9478 9.9478 9.9486 9.9486 10.0963 10.0963 10.0981 10.0981 k = 0.5000 0.3533 0.0366 ( 11988 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9202 -6.9202 -6.9202 -6.9202 -3.8378 -3.8378 -3.8376 -3.8376 -3.0069 -3.0069 -3.0068 -3.0068 2.3331 2.3331 2.3333 2.3333 3.3044 3.3044 3.3052 3.3052 3.8980 3.8980 3.8996 3.8996 4.4974 4.4974 4.5043 4.5043 4.8556 4.8556 4.8582 4.8582 6.0759 6.0759 6.0827 6.0827 6.3323 6.3323 6.3418 6.3418 7.1913 7.1913 7.1924 7.1924 9.4440 9.4440 9.4443 9.4443 9.9420 9.9420 9.9427 9.9427 10.0970 10.0970 10.0987 10.0987 k = 0.5000 0.3520 0.0265 ( 11982 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9201 -6.9201 -6.9201 -6.9201 -3.8376 -3.8376 -3.8375 -3.8375 -3.0075 -3.0075 -3.0075 -3.0075 2.3448 2.3448 2.3451 2.3451 3.2850 3.2850 3.2857 3.2857 3.8843 3.8843 3.8856 3.8856 4.5236 4.5236 4.5303 4.5303 4.8518 4.8518 4.8548 4.8548 6.0810 6.0810 6.0879 6.0879 6.3231 6.3231 6.3323 6.3323 7.2046 7.2046 7.2056 7.2056 9.4438 9.4438 9.4440 9.4440 9.9364 9.9364 9.9370 9.9370 10.0977 10.0977 10.0993 10.0993 k = 0.5000 0.3507 0.0164 ( 11980 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9200 -6.9200 -6.9199 -6.9199 -3.8375 -3.8375 -3.8374 -3.8374 -3.0081 -3.0081 -3.0081 -3.0081 2.3561 2.3561 2.3563 2.3563 3.2667 3.2667 3.2674 3.2674 3.8721 3.8721 3.8732 3.8732 4.5486 4.5486 4.5550 4.5550 4.8473 4.8473 4.8505 4.8505 6.0855 6.0855 6.0922 6.0922 6.3148 6.3148 6.3234 6.3234 7.2171 7.2171 7.2179 7.2179 9.4437 9.4437 9.4438 9.4438 9.9312 9.9312 9.9317 9.9317 10.0984 10.0984 10.0997 10.0997 k = 0.5000 0.3494 0.0064 ( 11980 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9199 -6.9199 -6.9199 -6.9199 -3.8374 -3.8374 -3.8373 -3.8373 -3.0086 -3.0086 -3.0086 -3.0086 2.3666 2.3666 2.3668 2.3668 3.2500 3.2500 3.2506 3.2506 3.8616 3.8616 3.8625 3.8625 4.5718 4.5718 4.5777 4.5777 4.8423 4.8423 4.8456 4.8456 6.0894 6.0894 6.0955 6.0955 6.3077 6.3077 6.3155 6.3155 7.2283 7.2283 7.2290 7.2290 9.4436 9.4436 9.4437 9.4437 9.9265 9.9265 9.9269 9.9269 10.0991 10.0991 10.1002 10.1002 k = 0.5000 0.3481-0.0037 ( 11980 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9198 -6.9198 -6.9198 -6.9198 -3.8373 -3.8373 -3.8372 -3.8372 -3.0091 -3.0091 -3.0090 -3.0090 2.3759 2.3759 2.3760 2.3760 3.2355 3.2355 3.2360 3.2360 3.8528 3.8528 3.8535 3.8535 4.5926 4.5926 4.5978 4.5978 4.8371 4.8371 4.8402 4.8402 6.0925 6.0925 6.0979 6.0979 6.3020 6.3020 6.3087 6.3087 7.2380 7.2380 7.2385 7.2385 9.4435 9.4435 9.4436 9.4436 9.9224 9.9224 9.9227 9.9227 10.0996 10.0996 10.1005 10.1005 k = 0.5000 0.3468-0.0138 ( 11974 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9197 -6.9197 -6.9197 -6.9197 -3.8372 -3.8372 -3.8371 -3.8371 -3.0094 -3.0094 -3.0094 -3.0094 2.3836 2.3836 2.3837 2.3837 3.2237 3.2237 3.2240 3.2240 3.8459 3.8459 3.8464 3.8464 4.6104 4.6104 4.6147 4.6147 4.8322 4.8322 4.8349 4.8349 6.0950 6.0950 6.0993 6.0993 6.2978 6.2978 6.3031 6.3031 7.2458 7.2458 7.2462 7.2462 9.4435 9.4435 9.4435 9.4435 9.9191 9.9191 9.9194 9.9194 10.1001 10.1001 10.1008 10.1008 k = 0.5000 0.3455-0.0239 ( 11968 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9197 -6.9197 -6.9197 -6.9197 -3.8371 -3.8371 -3.8371 -3.8371 -3.0096 -3.0096 -3.0096 -3.0096 2.3893 2.3893 2.3894 2.3894 3.2149 3.2149 3.2151 3.2151 3.8410 3.8410 3.8413 3.8413 4.6243 4.6243 4.6274 4.6274 4.8280 4.8280 4.8301 4.8301 6.0970 6.0970 6.1000 6.1000 6.2951 6.2951 6.2988 6.2988 7.2516 7.2516 7.2519 7.2519 9.4434 9.4434 9.4434 9.4434 9.9167 9.9167 9.9169 9.9169 10.1005 10.1005 10.1010 10.1010 k = 0.5000 0.3442-0.0340 ( 11960 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9197 -6.9197 -6.9197 -6.9197 -3.8371 -3.8371 -3.8371 -3.8371 -3.0098 -3.0098 -3.0098 -3.0098 2.3929 2.3929 2.3930 2.3930 3.2095 3.2095 3.2096 3.2096 3.8380 3.8380 3.8382 3.8382 4.6335 4.6335 4.6351 4.6351 4.8254 4.8254 4.8266 4.8266 6.0985 6.0985 6.1000 6.1000 6.2939 6.2939 6.2958 6.2958 7.2552 7.2552 7.2553 7.2553 9.4434 9.4434 9.4434 9.4434 9.9152 9.9152 9.9153 9.9153 10.1008 10.1008 10.1010 10.1010 k = 0.5000 0.3429-0.0441 ( 11960 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9196 -6.9196 -6.9196 -6.9196 -3.8371 -3.8371 -3.8371 -3.8371 -3.0098 -3.0098 -3.0098 -3.0098 2.3942 2.3942 2.3942 2.3942 3.2077 3.2077 3.2077 3.2077 3.8371 3.8371 3.8371 3.8371 4.6372 4.6372 4.6372 4.6372 4.8249 4.8249 4.8249 4.8249 6.0995 6.0995 6.0995 6.0995 6.2941 6.2941 6.2941 6.2941 7.2564 7.2564 7.2564 7.2564 9.4434 9.4434 9.4434 9.4434 9.9148 9.9148 9.9148 9.9148 10.1010 10.1010 10.1010 10.1010 k = 0.5000 0.3429-0.0441 ( 11960 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9196 -6.9196 -6.9196 -6.9196 -3.8371 -3.8371 -3.8371 -3.8371 -3.0098 -3.0098 -3.0098 -3.0098 2.3942 2.3942 2.3942 2.3942 3.2077 3.2077 3.2077 3.2077 3.8371 3.8371 3.8371 3.8371 4.6372 4.6372 4.6372 4.6372 4.8249 4.8249 4.8249 4.8249 6.0995 6.0995 6.0995 6.0995 6.2941 6.2941 6.2941 6.2941 7.2564 7.2564 7.2564 7.2564 9.4434 9.4434 9.4434 9.4434 9.9148 9.9148 9.9148 9.9148 10.1010 10.1010 10.1010 10.1010 k = 0.4894 0.3429-0.0441 ( 11964 PWs) bands (ev): -48.9719 -48.9719 -48.9718 -48.9718 -25.7048 -25.7048 -25.7043 -25.7043 -25.1079 -25.1079 -25.1074 -25.1074 -24.9479 -24.9479 -24.9473 -24.9473 -6.9209 -6.9209 -6.9194 -6.9194 -3.8522 -3.8522 -3.8245 -3.8245 -3.0136 -3.0136 -3.0062 -3.0062 2.3937 2.3937 2.3988 2.3988 3.1967 3.1967 3.2206 3.2206 3.8158 3.8158 3.8599 3.8599 4.6302 4.6302 4.6453 4.6453 4.8234 4.8234 4.8269 4.8269 6.0876 6.0876 6.1047 6.1047 6.2888 6.2888 6.3061 6.3061 7.2471 7.2471 7.2660 7.2660 9.4316 9.4316 9.4543 9.4543 9.8823 9.8823 9.9467 9.9467 10.0945 10.0945 10.1072 10.1072 k = 0.4787 0.3429-0.0441 ( 11968 PWs) bands (ev): -48.9720 -48.9720 -48.9718 -48.9718 -25.7050 -25.7050 -25.7039 -25.7039 -25.1081 -25.1081 -25.1069 -25.1069 -24.9483 -24.9483 -24.9470 -24.9470 -6.9232 -6.9232 -6.9202 -6.9202 -3.8698 -3.8698 -3.8145 -3.8145 -3.0174 -3.0174 -3.0028 -3.0028 2.3973 2.3973 2.4077 2.4077 3.1877 3.1877 3.2354 3.2354 3.7960 3.7960 3.8840 3.8840 4.6247 4.6247 4.6539 4.6539 4.8227 4.8227 4.8293 4.8293 6.0712 6.0712 6.1019 6.1019 6.2916 6.2916 6.3226 6.3226 7.2380 7.2380 7.2756 7.2756 9.4189 9.4189 9.4643 9.4643 9.8496 9.8496 9.9773 9.9773 10.0875 10.0875 10.1141 10.1141 k = 0.4681 0.3429-0.0441 ( 11966 PWs) bands (ev): -48.9720 -48.9720 -48.9718 -48.9718 -25.7050 -25.7050 -25.7034 -25.7034 -25.1081 -25.1081 -25.1064 -25.1064 -24.9486 -24.9486 -24.9467 -24.9467 -6.9266 -6.9266 -6.9220 -6.9220 -3.8896 -3.8896 -3.8070 -3.8070 -3.0214 -3.0214 -2.9996 -2.9996 2.4051 2.4051 2.4208 2.4208 3.1808 3.1808 3.2518 3.2518 3.7778 3.7778 3.9095 3.9095 4.6207 4.6207 4.6625 4.6625 4.8230 4.8230 4.8325 4.8325 6.0522 6.0522 6.0915 6.0915 6.3021 6.3021 6.3416 6.3416 7.2295 7.2295 7.2851 7.2851 9.4054 9.4054 9.4732 9.4732 9.8170 9.8170 10.0053 10.0053 10.0796 10.0796 10.1229 10.1229 k = 0.4574 0.3429-0.0441 ( 11972 PWs) bands (ev): -48.9721 -48.9721 -48.9718 -48.9718 -25.7050 -25.7050 -25.7029 -25.7029 -25.1081 -25.1081 -25.1058 -25.1058 -24.9490 -24.9490 -24.9465 -24.9465 -6.9309 -6.9309 -6.9248 -6.9248 -3.9117 -3.9117 -3.8022 -3.8022 -3.0254 -3.0254 -2.9969 -2.9969 2.4170 2.4170 2.4380 2.4380 3.1760 3.1760 3.2697 3.2697 3.7610 3.7610 3.9362 3.9362 4.6186 4.6186 4.6703 4.6703 4.8239 4.8239 4.8374 4.8374 6.0319 6.0319 6.0755 6.0755 6.3187 6.3187 6.3619 6.3619 7.2216 7.2216 7.2944 7.2944 9.3914 9.3914 9.4813 9.4813 9.7844 9.7844 10.0285 10.0285 10.0706 10.0706 10.1355 10.1355 k = 0.4468 0.3429-0.0441 ( 11978 PWs) bands (ev): -48.9722 -48.9722 -48.9718 -48.9718 -25.7049 -25.7049 -25.7022 -25.7022 -25.1079 -25.1079 -25.1051 -25.1051 -24.9493 -24.9493 -24.9462 -24.9462 -6.9363 -6.9363 -6.9285 -6.9285 -3.9357 -3.9357 -3.7999 -3.7999 -3.0295 -3.0295 -2.9945 -2.9945 2.4328 2.4328 2.4594 2.4594 3.1734 3.1734 3.2890 3.2890 3.7457 3.7457 3.9638 3.9638 4.6182 4.6182 4.6764 4.6764 4.8246 4.8246 4.8458 4.8458 6.0112 6.0112 6.0559 6.0559 6.3395 6.3395 6.3826 6.3826 7.2145 7.2145 7.3033 7.3033 9.3770 9.3770 9.4885 9.4885 9.7519 9.7519 10.0448 10.0448 10.0606 10.0606 10.1540 10.1540 k = 0.4362 0.3429-0.0441 ( 11980 PWs) bands (ev): -48.9724 -48.9724 -48.9719 -48.9719 -25.7047 -25.7047 -25.7015 -25.7015 -25.1077 -25.1077 -25.1043 -25.1043 -24.9497 -24.9497 -24.9460 -24.9460 -6.9426 -6.9426 -6.9332 -6.9332 -3.9616 -3.9616 -3.8001 -3.8001 -3.0337 -3.0337 -2.9927 -2.9927 2.4526 2.4526 2.4848 2.4848 3.1729 3.1729 3.3094 3.3094 3.7317 3.7317 3.9922 3.9922 4.6198 4.6198 4.6802 4.6802 4.8246 4.8246 4.8588 4.8588 5.9910 5.9910 6.0343 6.0343 6.3632 6.3632 6.4034 6.4034 7.2082 7.2082 7.3116 7.3116 9.3623 9.3623 9.4950 9.4950 9.7195 9.7195 10.0477 10.0477 10.0554 10.0554 10.1787 10.1787 k = 0.4255 0.3429-0.0441 ( 11982 PWs) bands (ev): -48.9725 -48.9725 -48.9719 -48.9719 -25.7044 -25.7044 -25.7008 -25.7008 -25.1074 -25.1074 -25.1034 -25.1034 -24.9501 -24.9501 -24.9458 -24.9458 -6.9499 -6.9499 -6.9389 -6.9389 -3.9891 -3.9891 -3.8026 -3.8026 -3.0381 -3.0381 -2.9915 -2.9915 2.4761 2.4761 2.5144 2.5144 3.1745 3.1745 3.3306 3.3306 3.7192 3.7192 4.0211 4.0211 4.6231 4.6231 4.6815 4.6815 4.8236 4.8236 4.8769 4.8769 5.9716 5.9716 6.0116 6.0116 6.3890 6.3890 6.4239 6.4239 7.2030 7.2030 7.3192 7.3192 9.3476 9.3476 9.5007 9.5007 9.6873 9.6873 10.0353 10.0353 10.0584 10.0584 10.2079 10.2079 k = 0.4149 0.3429-0.0441 ( 11978 PWs) bands (ev): -48.9727 -48.9727 -48.9720 -48.9720 -25.7041 -25.7041 -25.6999 -25.6999 -25.1069 -25.1069 -25.1025 -25.1025 -24.9505 -24.9505 -24.9456 -24.9456 -6.9582 -6.9582 -6.9454 -6.9454 -4.0181 -4.0181 -3.8073 -3.8073 -3.0427 -3.0427 -2.9909 -2.9909 2.5033 2.5033 2.5479 2.5479 3.1783 3.1783 3.3524 3.3524 3.7082 3.7082 4.0501 4.0501 4.6283 4.6283 4.6805 4.6805 4.8216 4.8216 4.9001 4.9001 5.9536 5.9536 5.9888 5.9888 6.4163 6.4163 6.4440 6.4440 7.1990 7.1990 7.3260 7.3260 9.3330 9.3330 9.5054 9.5054 9.6554 9.6554 10.0209 10.0209 10.0579 10.0579 10.2396 10.2396 k = 0.4043 0.3429-0.0441 ( 11984 PWs) bands (ev): -48.9728 -48.9728 -48.9721 -48.9721 -25.7036 -25.7036 -25.6990 -25.6990 -25.1064 -25.1064 -25.1014 -25.1014 -24.9509 -24.9509 -24.9454 -24.9454 -6.9673 -6.9673 -6.9527 -6.9527 -4.0484 -4.0484 -3.8140 -3.8140 -3.0477 -3.0477 -2.9911 -2.9911 2.5341 2.5341 2.5854 2.5854 3.1840 3.1840 3.3742 3.3742 3.6989 3.6989 4.0790 4.0790 4.6352 4.6352 4.6777 4.6777 4.8188 4.8188 4.9280 4.9280 5.9371 5.9371 5.9665 5.9665 6.4442 6.4442 6.4647 6.4647 7.1962 7.1962 7.3318 7.3318 9.3188 9.3188 9.5089 9.5089 9.6243 9.6243 10.0050 10.0050 10.0545 10.0545 10.2726 10.2726 k = 0.3936 0.3429-0.0441 ( 11970 PWs) bands (ev): -48.9730 -48.9730 -48.9722 -48.9722 -25.7031 -25.7031 -25.6980 -25.6980 -25.1058 -25.1058 -25.1003 -25.1003 -24.9513 -24.9513 -24.9452 -24.9452 -6.9774 -6.9774 -6.9608 -6.9608 -4.0797 -4.0797 -3.8225 -3.8225 -3.0531 -3.0531 -2.9921 -2.9921 2.5681 2.5681 2.6266 2.6266 3.1918 3.1918 3.3955 3.3955 3.6918 3.6918 4.1073 4.1073 4.6434 4.6434 4.6738 4.6738 4.8150 4.8150 4.9602 4.9602 5.9216 5.9216 5.9461 5.9461 6.4696 6.4696 6.4885 6.4885 7.1948 7.1948 7.3366 7.3366 9.3052 9.3052 9.5097 9.5097 9.5955 9.5955 9.9878 9.9878 10.0490 10.0490 10.3060 10.3060 k = 0.3830 0.3429-0.0441 ( 11960 PWs) bands (ev): -48.9732 -48.9732 -48.9723 -48.9723 -25.7026 -25.7026 -25.6970 -25.6970 -25.1051 -25.1051 -25.0991 -25.0991 -24.9517 -24.9517 -24.9451 -24.9451 -6.9882 -6.9882 -6.9697 -6.9697 -4.1120 -4.1120 -3.8326 -3.8326 -3.0590 -3.0590 -2.9939 -2.9939 2.6053 2.6053 2.6715 2.6715 3.2014 3.2014 3.4154 3.4154 3.6874 3.6874 4.1346 4.1346 4.6520 4.6520 4.6700 4.6700 4.8103 4.8103 4.9963 4.9963 5.9051 5.9051 5.9304 5.9304 6.4897 6.4897 6.5183 6.5183 7.1949 7.1949 7.3403 7.3403 9.2922 9.2922 9.5043 9.5043 9.5724 9.5724 9.9694 9.9694 10.0415 10.0415 10.3393 10.3393 k = 0.3723 0.3429-0.0441 ( 11952 PWs) bands (ev): -48.9734 -48.9734 -48.9724 -48.9724 -25.7019 -25.7019 -25.6960 -25.6960 -25.1043 -25.1043 -25.0979 -25.0979 -24.9521 -24.9521 -24.9449 -24.9449 -6.9998 -6.9998 -6.9793 -6.9793 -4.1450 -4.1450 -3.8442 -3.8442 -3.0654 -3.0654 -2.9965 -2.9965 2.6452 2.6452 2.7198 2.7198 3.2128 3.2128 3.4327 3.4327 3.6868 3.6868 4.1606 4.1606 4.6555 4.6555 4.6722 4.6722 4.8048 4.8048 5.0360 5.0360 5.8862 5.8862 5.9216 5.9216 6.5065 6.5065 6.5524 6.5524 7.1966 7.1966 7.3428 7.3428 9.2802 9.2802 9.4878 9.4878 9.5598 9.5598 9.9502 9.9502 10.0323 10.0323 10.3719 10.3719 k = 0.3617 0.3429-0.0441 ( 11938 PWs) bands (ev): -48.9736 -48.9736 -48.9725 -48.9725 -25.7013 -25.7013 -25.6949 -25.6949 -25.1034 -25.1034 -25.0966 -25.0966 -24.9525 -24.9525 -24.9448 -24.9448 -7.0121 -7.0121 -6.9895 -6.9895 -4.1786 -4.1786 -3.8571 -3.8571 -3.0724 -3.0724 -3.0000 -3.0000 2.6877 2.6877 2.7715 2.7715 3.2260 3.2260 3.4463 3.4463 3.6913 3.6913 4.1849 4.1849 4.6511 4.6511 4.6831 4.6831 4.7985 4.7985 5.0791 5.0791 5.8661 5.8661 5.9190 5.9190 6.5214 6.5214 6.5891 6.5891 7.1999 7.1999 7.3440 7.3440 9.2691 9.2691 9.4614 9.4614 9.5562 9.5562 9.9306 9.9306 10.0215 10.0215 10.4034 10.4034 k = 0.3511 0.3429-0.0441 ( 11936 PWs) bands (ev): -48.9738 -48.9738 -48.9727 -48.9727 -25.7005 -25.7005 -25.6937 -25.6937 -25.1025 -25.1025 -25.0952 -25.0952 -24.9529 -24.9529 -24.9446 -24.9446 -7.0251 -7.0251 -7.0004 -7.0004 -4.2126 -4.2126 -3.8710 -3.8710 -3.0800 -3.0800 -3.0043 -3.0043 2.7324 2.7324 2.8263 2.8263 3.2408 3.2408 3.4549 3.4549 3.7020 3.7020 4.2071 4.2071 4.6445 4.6445 4.6972 4.6972 4.7914 4.7914 5.1252 5.1252 5.8459 5.8459 5.9222 5.9222 6.5350 6.5350 6.6281 6.6281 7.2051 7.2051 7.3440 7.3440 9.2592 9.2592 9.4303 9.4303 9.5561 9.5561 9.9113 9.9113 10.0091 10.0091 10.4335 10.4335 k = 0.3404 0.3429-0.0441 ( 11940 PWs) bands (ev): -48.9740 -48.9740 -48.9728 -48.9728 -25.6997 -25.6997 -25.6926 -25.6926 -25.1014 -25.1014 -25.0938 -25.0938 -24.9533 -24.9533 -24.9445 -24.9445 -7.0387 -7.0387 -7.0117 -7.0117 -4.2469 -4.2469 -3.8859 -3.8859 -3.0882 -3.0882 -3.0094 -3.0094 2.7787 2.7787 2.8838 2.8838 3.2571 3.2571 3.4582 3.4582 3.7195 3.7195 4.2271 4.2271 4.6374 4.6374 4.7127 4.7127 4.7835 4.7835 5.1740 5.1740 5.8265 5.8265 5.9309 5.9309 6.5475 6.5475 6.6693 6.6693 7.2122 7.2122 7.3428 7.3428 9.2504 9.2504 9.3972 9.3972 9.5562 9.5562 9.8932 9.8932 9.9952 9.9952 10.4615 10.4615 k = 0.3298 0.3429-0.0441 ( 11946 PWs) bands (ev): -48.9743 -48.9743 -48.9730 -48.9730 -25.6989 -25.6989 -25.6914 -25.6914 -25.1003 -25.1003 -25.0924 -25.0924 -24.9537 -24.9537 -24.9444 -24.9444 -7.0528 -7.0528 -7.0236 -7.0236 -4.2813 -4.2813 -3.9014 -3.9014 -3.0972 -3.0972 -3.0152 -3.0152 2.8261 2.8261 2.9438 2.9438 3.2749 3.2749 3.4568 3.4568 3.7435 3.7435 4.2447 4.2447 4.6302 4.6302 4.7290 4.7290 4.7751 4.7751 5.2252 5.2252 5.8081 5.8081 5.9453 5.9453 6.5590 6.5590 6.7125 6.7125 7.2212 7.2212 7.3405 7.3405 9.2429 9.2429 9.3631 9.3631 9.5548 9.5548 9.8771 9.8771 9.9799 9.9799 10.4864 10.4864 k = 0.3191 0.3429-0.0441 ( 11952 PWs) bands (ev): -48.9745 -48.9745 -48.9731 -48.9731 -25.6980 -25.6980 -25.6902 -25.6902 -25.0992 -25.0992 -25.0909 -25.0909 -24.9541 -24.9541 -24.9443 -24.9443 -7.0674 -7.0674 -7.0358 -7.0358 -4.3157 -4.3157 -3.9175 -3.9175 -3.1067 -3.1067 -3.0219 -3.0219 2.8739 2.8739 3.0057 3.0057 3.2941 3.2941 3.4520 3.4520 3.7732 3.7732 4.2601 4.2601 4.6231 4.6231 4.7450 4.7450 4.7672 4.7672 5.2783 5.2783 5.7910 5.7910 5.9655 5.9655 6.5698 6.5698 6.7579 6.7579 7.2321 7.2321 7.3371 7.3371 9.2366 9.2366 9.3286 9.3286 9.5504 9.5504 9.8643 9.8643 9.9632 9.9632 10.5055 10.5055 k = 0.3085 0.3429-0.0441 ( 11956 PWs) bands (ev): -48.9747 -48.9747 -48.9733 -48.9733 -25.6971 -25.6971 -25.6890 -25.6890 -25.0979 -25.0979 -25.0894 -25.0894 -24.9545 -24.9545 -24.9442 -24.9442 -7.0824 -7.0824 -7.0485 -7.0485 -4.3499 -4.3499 -3.9341 -3.9341 -3.1169 -3.1169 -3.0292 -3.0292 2.9212 2.9212 3.0690 3.0690 3.3149 3.3149 3.4452 3.4452 3.8076 3.8076 4.2733 4.2733 4.6163 4.6163 4.7504 4.7504 4.7697 4.7697 5.3325 5.3325 5.7757 5.7757 5.9912 5.9912 6.5800 6.5800 6.8052 6.8052 7.2451 7.2451 7.3329 7.3329 9.2314 9.2314 9.2940 9.2940 9.5420 9.5420 9.8558 9.8558 9.9450 9.9450 10.5138 10.5138 k = 0.2979 0.3429-0.0441 ( 11964 PWs) bands (ev): -48.9750 -48.9750 -48.9735 -48.9735 -25.6961 -25.6961 -25.6878 -25.6878 -25.0967 -25.0967 -25.0879 -25.0879 -24.9548 -24.9548 -24.9441 -24.9441 -7.0978 -7.0978 -7.0614 -7.0614 -4.3839 -4.3839 -3.9509 -3.9509 -3.1276 -3.1276 -3.0371 -3.0371 2.9667 2.9667 3.1326 3.1326 3.3375 3.3375 3.4385 3.4385 3.8459 3.8459 4.2848 4.2848 4.6101 4.6101 4.7419 4.7419 4.7857 4.7857 5.3871 5.3871 5.7628 5.7628 6.0225 6.0225 6.5898 6.5898 6.8544 6.8544 7.2601 7.2601 7.3281 7.3281 9.2271 9.2271 9.2597 9.2597 9.5290 9.5290 9.8521 9.8521 9.9256 9.9256 10.5074 10.5074 k = 0.2872 0.3429-0.0441 ( 11968 PWs) bands (ev): -48.9752 -48.9752 -48.9737 -48.9737 -25.6952 -25.6952 -25.6865 -25.6865 -25.0953 -25.0953 -25.0863 -25.0863 -24.9552 -24.9552 -24.9439 -24.9439 -7.1134 -7.1134 -7.0746 -7.0746 -4.4174 -4.4174 -3.9679 -3.9679 -3.1389 -3.1389 -3.0456 -3.0456 3.0088 3.0088 3.1952 3.1952 3.3624 3.3624 3.4340 3.4340 3.8871 3.8871 4.2951 4.2951 4.6049 4.6049 4.7312 4.7312 4.8034 4.8034 5.4408 5.4408 5.7531 5.7531 6.0588 6.0588 6.5997 6.5997 6.9054 6.9054 7.2768 7.2768 7.3231 7.3231 9.2211 9.2211 9.2284 9.2284 9.5112 9.5112 9.8533 9.8533 9.9049 9.9049 10.4907 10.4907 k = 0.2766 0.3429-0.0441 ( 11968 PWs) bands (ev): -48.9755 -48.9755 -48.9739 -48.9739 -25.6942 -25.6942 -25.6853 -25.6853 -25.0940 -25.0940 -25.0847 -25.0847 -24.9555 -24.9555 -24.9438 -24.9438 -7.1292 -7.1292 -7.0879 -7.0879 -4.4505 -4.4505 -3.9850 -3.9850 -3.1506 -3.1506 -3.0547 -3.0547 3.0452 3.0452 3.2540 3.2540 3.3909 3.3909 3.4348 3.4348 3.9306 3.9306 4.3050 4.3050 4.6011 4.6011 4.7199 4.7199 4.8209 4.8209 5.4916 5.4916 5.7484 5.7484 6.0996 6.0996 6.6099 6.6099 6.9579 6.9579 7.2946 7.2946 7.3191 7.3191 9.1907 9.1907 9.2225 9.2225 9.4893 9.4893 9.8588 9.8588 9.8836 9.8836 10.4691 10.4691 k = 0.2660 0.3429-0.0441 ( 11978 PWs) bands (ev): -48.9758 -48.9758 -48.9741 -48.9741 -25.6932 -25.6932 -25.6841 -25.6841 -25.0926 -25.0926 -25.0832 -25.0832 -24.9558 -24.9558 -24.9437 -24.9437 -7.1452 -7.1452 -7.1014 -7.1014 -4.4830 -4.4830 -4.0020 -4.0020 -3.1628 -3.1628 -3.0641 -3.0641 3.0736 3.0736 3.3055 3.3055 3.4222 3.4222 3.4471 3.4471 3.9756 3.9756 4.3150 4.3150 4.5991 4.5991 4.7085 4.7085 4.8378 4.8378 5.5363 5.5363 5.7512 5.7512 6.1440 6.1440 6.6213 6.6213 7.0117 7.0117 7.3065 7.3065 7.3232 7.3232 9.1575 9.1575 9.2204 9.2204 9.4639 9.4639 9.8571 9.8571 9.8724 9.8724 10.4453 10.4453 k = 0.2553 0.3429-0.0441 ( 11978 PWs) bands (ev): -48.9760 -48.9760 -48.9743 -48.9743 -25.6922 -25.6922 -25.6829 -25.6829 -25.0911 -25.0911 -25.0816 -25.0816 -24.9561 -24.9561 -24.9436 -24.9436 -7.1612 -7.1612 -7.1149 -7.1149 -4.5149 -4.5149 -4.0189 -4.0189 -3.1753 -3.1753 -3.0740 -3.0740 3.0919 3.0919 3.3464 3.3464 3.4476 3.4476 3.4836 3.4836 4.0214 4.0214 4.3262 4.3262 4.5996 4.5996 4.6972 4.6972 4.8536 4.8536 5.5707 5.5707 5.7652 5.7652 6.1909 6.1909 6.6346 6.6346 7.0665 7.0665 7.3058 7.3058 7.3426 7.3426 9.1247 9.1247 9.2186 9.2186 9.4361 9.4361 9.8348 9.8348 9.8841 9.8841 10.4202 10.4202 k = 0.2447 0.3429-0.0441 ( 11972 PWs) bands (ev): -48.9763 -48.9763 -48.9745 -48.9745 -25.6912 -25.6912 -25.6818 -25.6818 -25.0897 -25.0897 -25.0800 -25.0800 -24.9563 -24.9563 -24.9435 -24.9435 -7.1772 -7.1772 -7.1285 -7.1285 -4.5459 -4.5459 -4.0356 -4.0356 -3.1881 -3.1881 -3.0841 -3.0841 3.0997 3.0997 3.3776 3.3776 3.4741 3.4741 3.5359 3.5359 4.0669 4.0669 4.3393 4.3393 4.6035 4.6035 4.6864 4.6864 4.8683 4.8683 5.5926 5.5926 5.7922 5.7922 6.2386 6.2386 6.6512 6.6512 7.1218 7.1218 7.3041 7.3041 7.3660 7.3660 9.0923 9.0923 9.2166 9.2166 9.4067 9.4067 9.8105 9.8105 9.8998 9.8998 10.3946 10.3946 k = 0.2340 0.3429-0.0441 ( 11978 PWs) bands (ev): -48.9765 -48.9765 -48.9746 -48.9746 -25.6902 -25.6902 -25.6806 -25.6806 -25.0882 -25.0882 -25.0785 -25.0785 -24.9566 -24.9566 -24.9434 -24.9434 -7.1932 -7.1932 -7.1419 -7.1419 -4.5761 -4.5761 -4.0520 -4.0520 -3.2010 -3.2010 -3.0944 -3.0944 3.0982 3.0982 3.4023 3.4023 3.5067 3.5067 3.5934 3.5934 4.1110 4.1110 4.3551 4.3551 4.6116 4.6116 4.6766 4.6766 4.8816 4.8816 5.6040 5.6040 5.8296 5.8296 6.2851 6.2851 6.6726 6.6726 7.1771 7.1771 7.3046 7.3046 7.3911 7.3911 9.0605 9.0605 9.2140 9.2140 9.3766 9.3766 9.7856 9.7856 9.9176 9.9176 10.3688 10.3688 k = 0.2234 0.3429-0.0441 ( 11988 PWs) bands (ev): -48.9768 -48.9768 -48.9748 -48.9748 -25.6892 -25.6892 -25.6795 -25.6795 -25.0868 -25.0868 -25.0770 -25.0770 -24.9568 -24.9568 -24.9433 -24.9433 -7.2089 -7.2089 -7.1552 -7.1552 -4.6055 -4.6055 -4.0680 -4.0680 -3.2140 -3.2140 -3.1048 -3.1048 3.0894 3.0894 3.4225 3.4225 3.5444 3.5444 3.6517 3.6517 4.1527 4.1527 4.3739 4.3739 4.6249 4.6249 4.6685 4.6685 4.8934 4.8934 5.6093 5.6093 5.8724 5.8724 6.3278 6.3278 6.7011 6.7011 7.2306 7.2306 7.3095 7.3095 7.4172 7.4172 9.0290 9.0290 9.2101 9.2101 9.3466 9.3466 9.7607 9.7607 9.9367 9.9367 10.3431 10.3431 k = 0.2128 0.3429-0.0441 ( 11988 PWs) bands (ev): -48.9770 -48.9770 -48.9750 -48.9750 -25.6882 -25.6882 -25.6784 -25.6784 -25.0853 -25.0853 -25.0755 -25.0755 -24.9570 -24.9570 -24.9432 -24.9432 -7.2245 -7.2245 -7.1684 -7.1684 -4.6338 -4.6338 -4.0835 -4.0835 -3.2271 -3.2271 -3.1154 -3.1154 3.0756 3.0756 3.4393 3.4393 3.5853 3.5853 3.7085 3.7085 4.1908 4.1908 4.3957 4.3957 4.6440 4.6440 4.6633 4.6633 4.9038 4.9038 5.6122 5.6122 5.9166 5.9166 6.3645 6.3645 6.7385 6.7385 7.2763 7.2763 7.3254 7.3254 7.4440 7.4440 8.9977 8.9977 9.2043 9.2043 9.3175 9.3175 9.7362 9.7362 9.9569 9.9569 10.3178 10.3178 k = 0.2021 0.3429-0.0441 ( 11982 PWs) bands (ev): -48.9773 -48.9773 -48.9752 -48.9752 -25.6873 -25.6873 -25.6774 -25.6774 -25.0838 -25.0838 -25.0740 -25.0740 -24.9571 -24.9571 -24.9430 -24.9430 -7.2397 -7.2397 -7.1813 -7.1813 -4.6611 -4.6611 -4.0986 -4.0986 -3.2401 -3.2401 -3.1259 -3.1259 3.0584 3.0584 3.4531 3.4531 3.6275 3.6275 3.7624 3.7624 4.2248 4.2248 4.4192 4.4192 4.6618 4.6618 4.6698 4.6698 4.9130 4.9130 5.6147 5.6147 5.9595 5.9595 6.3933 6.3933 6.7861 6.7861 7.3027 7.3027 7.3636 7.3636 7.4712 7.4712 8.9664 8.9664 9.1961 9.1961 9.2900 9.2900 9.7125 9.7125 9.9777 9.9777 10.2933 10.2933 k = 0.1915 0.3429-0.0441 ( 11986 PWs) bands (ev): -48.9775 -48.9775 -48.9754 -48.9754 -25.6863 -25.6863 -25.6764 -25.6764 -25.0824 -25.0824 -25.0726 -25.0726 -24.9572 -24.9572 -24.9429 -24.9429 -7.2546 -7.2546 -7.1939 -7.1939 -4.6873 -4.6873 -4.1132 -4.1132 -3.2529 -3.2529 -3.1363 -3.1363 3.0391 3.0391 3.4639 3.4639 3.6696 3.6696 3.8130 3.8130 4.2547 4.2547 4.4420 4.4420 4.6676 4.6676 4.7007 4.7007 4.9216 4.9216 5.6182 5.6182 5.9995 5.9995 6.4142 6.4142 6.8435 6.8435 7.3206 7.3206 7.4138 7.4138 7.4984 7.4984 8.9349 8.9349 9.1847 9.1847 9.2647 9.2647 9.6903 9.6903 9.9988 9.9988 10.2698 10.2698 k = 0.1809 0.3429-0.0441 ( 11982 PWs) bands (ev): -48.9778 -48.9778 -48.9756 -48.9756 -25.6854 -25.6854 -25.6754 -25.6754 -25.0810 -25.0810 -25.0713 -25.0713 -24.9574 -24.9574 -24.9428 -24.9428 -7.2691 -7.2691 -7.2061 -7.2061 -4.7123 -4.7123 -4.1272 -4.1272 -3.2656 -3.2656 -3.1465 -3.1465 3.0187 3.0187 3.4720 3.4720 3.7105 3.7105 3.8602 3.8602 4.2810 4.2810 4.4609 4.4609 4.6819 4.6819 4.7367 4.7367 4.9304 4.9304 5.6233 5.6233 6.0357 6.0357 6.4277 6.4277 6.9096 6.9096 7.3401 7.3401 7.4653 7.4653 7.5256 7.5256 8.9029 8.9029 9.1697 9.1697 9.2421 9.2421 9.6699 9.6699 10.0198 10.0198 10.2476 10.2476 k = 0.1702 0.3429-0.0441 ( 11968 PWs) bands (ev): -48.9780 -48.9780 -48.9758 -48.9758 -25.6845 -25.6845 -25.6745 -25.6745 -25.0796 -25.0796 -25.0699 -25.0699 -24.9574 -24.9574 -24.9427 -24.9427 -7.2831 -7.2831 -7.2180 -7.2180 -4.7361 -4.7361 -4.1406 -4.1406 -3.2779 -3.2779 -3.1566 -3.1566 2.9977 2.9977 3.4775 3.4775 3.7492 3.7492 3.9043 3.9043 4.3050 4.3050 4.4734 4.4734 4.7050 4.7050 4.7757 4.7757 4.9412 4.9412 5.6307 5.6307 6.0679 6.0679 6.4351 6.4351 6.9825 6.9825 7.3636 7.3636 7.5144 7.5144 7.5535 7.5535 8.8703 8.8703 9.1505 9.1505 9.2228 9.2228 9.6517 9.6517 10.0404 10.0404 10.2270 10.2270 k = 0.1596 0.3429-0.0441 ( 11966 PWs) bands (ev): -48.9782 -48.9782 -48.9760 -48.9760 -25.6837 -25.6837 -25.6736 -25.6736 -25.0783 -25.0783 -25.0687 -25.0687 -24.9575 -24.9575 -24.9425 -24.9425 -7.2966 -7.2966 -7.2293 -7.2293 -4.7587 -4.7587 -4.1533 -4.1533 -3.2899 -3.2899 -3.1663 -3.1663 2.9766 2.9766 3.4806 3.4806 3.7848 3.7848 3.9458 3.9458 4.3279 4.3279 4.4792 4.4792 4.7335 4.7335 4.8161 4.8161 4.9569 4.9569 5.6404 5.6404 6.0960 6.0960 6.4377 6.4377 7.0605 7.0605 7.3918 7.3918 7.5562 7.5562 7.5859 7.5859 8.8370 8.8370 9.1269 9.1269 9.2070 9.2070 9.6359 9.6359 10.0605 10.0605 10.2085 10.2085 k = 0.1489 0.3429-0.0441 ( 11964 PWs) bands (ev): -48.9784 -48.9784 -48.9761 -48.9761 -25.6829 -25.6829 -25.6728 -25.6728 -25.0770 -25.0770 -25.0675 -25.0675 -24.9575 -24.9575 -24.9424 -24.9424 -7.3095 -7.3095 -7.2402 -7.2402 -4.7800 -4.7800 -4.1654 -4.1654 -3.3014 -3.3014 -3.1757 -3.1757 2.9559 2.9559 3.4815 3.4815 3.8169 3.8169 3.9853 3.9853 4.3509 4.3509 4.4799 4.4799 4.7606 4.7606 4.8560 4.8560 4.9820 4.9820 5.6523 5.6523 6.1208 6.1208 6.4361 6.4361 7.1421 7.1421 7.4244 7.4244 7.5859 7.5859 7.6264 7.6264 8.8031 8.8031 9.0990 9.0990 9.1947 9.1947 9.6223 9.6223 10.0795 10.0795 10.1922 10.1922 k = 0.1383 0.3429-0.0441 ( 11964 PWs) bands (ev): -48.9786 -48.9786 -48.9763 -48.9763 -25.6821 -25.6821 -25.6720 -25.6720 -25.0758 -25.0758 -25.0664 -25.0664 -24.9576 -24.9576 -24.9422 -24.9422 -7.3217 -7.3217 -7.2506 -7.2506 -4.8000 -4.8000 -4.1767 -4.1767 -3.3125 -3.3125 -3.1848 -3.1848 2.9357 2.9357 3.4806 3.4806 3.8449 3.8449 4.0232 4.0232 4.3751 4.3751 4.4772 4.4772 4.7798 4.7798 4.8939 4.8939 5.0199 5.0199 5.6659 5.6659 6.1430 6.1430 6.4311 6.4311 7.2259 7.2259 7.4610 7.4610 7.6088 7.6088 7.6693 7.6693 8.7687 8.7687 9.0669 9.0669 9.1858 9.1858 9.6109 9.6109 10.0973 10.0973 10.1785 10.1785 k = 0.1277 0.3429-0.0441 ( 11958 PWs) bands (ev): -48.9788 -48.9788 -48.9765 -48.9765 -25.6814 -25.6814 -25.6713 -25.6713 -25.0746 -25.0746 -25.0654 -25.0654 -24.9576 -24.9576 -24.9421 -24.9421 -7.3332 -7.3332 -7.2603 -7.2603 -4.8186 -4.8186 -4.1873 -4.1873 -3.3229 -3.3229 -3.1933 -3.1933 2.9163 2.9163 3.4782 3.4782 3.8688 3.8688 4.0601 4.0601 4.4008 4.4008 4.4727 4.4727 4.7890 4.7890 4.9285 4.9285 5.0708 5.0708 5.6804 5.6804 6.1641 6.1641 6.4230 6.4230 7.3109 7.3109 7.5010 7.5010 7.6282 7.6282 7.7106 7.7106 8.7342 8.7342 9.0313 9.0313 9.1799 9.1799 9.6013 9.6013 10.1132 10.1132 10.1679 10.1679 k = 0.1170 0.3429-0.0441 ( 11956 PWs) bands (ev): -48.9790 -48.9790 -48.9766 -48.9766 -25.6807 -25.6807 -25.6707 -25.6707 -25.0735 -25.0735 -25.0644 -25.0644 -24.9575 -24.9575 -24.9420 -24.9420 -7.3440 -7.3440 -7.2695 -7.2695 -4.8358 -4.8358 -4.1971 -4.1971 -3.3328 -3.3328 -3.2014 -3.2014 2.8979 2.8979 3.4746 3.4746 3.8885 3.8885 4.0960 4.0960 4.4281 4.4281 4.4674 4.4674 4.7895 4.7895 4.9591 4.9591 5.1313 5.1313 5.6946 5.6946 6.1854 6.1854 6.4121 6.4121 7.3959 7.3959 7.5434 7.5434 7.6452 7.6452 7.7490 7.7490 8.6999 8.6999 8.9928 8.9928 9.1765 9.1765 9.5929 9.5929 10.1266 10.1266 10.1607 10.1607 k = 0.1064 0.3429-0.0441 ( 11958 PWs) bands (ev): -48.9791 -48.9791 -48.9767 -48.9767 -25.6801 -25.6801 -25.6701 -25.6701 -25.0725 -25.0725 -25.0635 -25.0635 -24.9575 -24.9575 -24.9418 -24.9418 -7.3540 -7.3540 -7.2779 -7.2779 -4.8516 -4.8516 -4.2061 -4.2061 -3.3419 -3.3419 -3.2089 -3.2089 2.8807 2.8807 3.4702 3.4702 3.9043 3.9043 4.1312 4.1312 4.4543 4.4543 4.4646 4.4646 4.7837 4.7837 4.9855 4.9855 5.1977 5.1977 5.7071 5.7071 6.2084 6.2084 6.3985 6.3985 7.4796 7.4796 7.5872 7.5872 7.6602 7.6602 7.7842 7.7842 8.6663 8.6663 8.9522 8.9522 9.1749 9.1749 9.5855 9.5855 10.1365 10.1365 10.1577 10.1577 k = 0.0957 0.3429-0.0441 ( 11962 PWs) bands (ev): -48.9793 -48.9793 -48.9768 -48.9768 -25.6795 -25.6795 -25.6695 -25.6695 -25.0716 -25.0716 -25.0627 -25.0627 -24.9575 -24.9575 -24.9417 -24.9417 -7.3632 -7.3632 -7.2857 -7.2857 -4.8660 -4.8660 -4.2143 -4.2143 -3.3504 -3.3504 -3.2158 -3.2158 2.8648 2.8648 3.4653 3.4653 3.9167 3.9167 4.1656 4.1656 4.4541 4.4541 4.4891 4.4891 4.7735 4.7735 5.0077 5.0077 5.2671 5.2671 5.7167 5.7167 6.2339 6.2339 6.3823 6.3823 7.5601 7.5601 7.6313 7.6313 7.6741 7.6741 7.8160 7.8160 8.6339 8.6339 8.9105 8.9105 9.1746 9.1746 9.5786 9.5786 10.1419 10.1419 10.1594 10.1594 k = 0.0851 0.3429-0.0441 ( 11960 PWs) bands (ev): -48.9794 -48.9794 -48.9770 -48.9770 -25.6790 -25.6790 -25.6690 -25.6690 -25.0707 -25.0707 -25.0620 -25.0620 -24.9574 -24.9574 -24.9416 -24.9416 -7.3715 -7.3715 -7.2927 -7.2927 -4.8789 -4.8789 -4.2217 -4.2217 -3.3580 -3.3580 -3.2221 -3.2221 2.8503 2.8503 3.4602 3.4602 3.9262 3.9262 4.1992 4.1992 4.4489 4.4489 4.5195 4.5195 4.7601 4.7601 5.0260 5.0260 5.3372 5.3372 5.7227 5.7227 6.2621 6.2621 6.3639 6.3639 7.6331 7.6331 7.6717 7.6717 7.6931 7.6931 7.8446 7.8446 8.6031 8.6031 8.8684 8.8684 9.1748 9.1748 9.5722 9.5722 10.1450 10.1450 10.1633 10.1633 k = 0.0745 0.3429-0.0441 ( 11968 PWs) bands (ev): -48.9795 -48.9795 -48.9771 -48.9771 -25.6785 -25.6785 -25.6686 -25.6686 -25.0700 -25.0700 -25.0614 -25.0614 -24.9574 -24.9574 -24.9415 -24.9415 -7.3789 -7.3789 -7.2990 -7.2990 -4.8904 -4.8904 -4.2283 -4.2283 -3.3649 -3.3649 -3.2277 -3.2277 2.8373 2.8373 3.4551 3.4551 3.9333 3.9333 4.2317 4.2317 4.4440 4.4440 4.5497 4.5497 4.7444 4.7444 5.0407 5.0407 5.4063 5.4063 5.7249 5.7249 6.2924 6.2924 6.3435 6.3435 7.6783 7.6783 7.7030 7.7030 7.7402 7.7402 7.8705 7.8705 8.5745 8.5745 8.8272 8.8272 9.1750 9.1750 9.5662 9.5662 10.1478 10.1478 10.1666 10.1666 k = 0.0638 0.3429-0.0441 ( 11958 PWs) bands (ev): -48.9796 -48.9796 -48.9771 -48.9771 -25.6781 -25.6781 -25.6682 -25.6682 -25.0693 -25.0693 -25.0608 -25.0608 -24.9573 -24.9573 -24.9414 -24.9414 -7.3854 -7.3854 -7.3045 -7.3045 -4.9003 -4.9003 -4.2340 -4.2340 -3.3709 -3.3709 -3.2326 -3.2326 2.8258 2.8258 3.4503 3.4503 3.9385 3.9385 4.2627 4.2627 4.4397 4.4397 4.5786 4.5786 4.7272 4.7272 5.0522 5.0522 5.4728 5.4728 5.7237 5.7237 6.3158 6.3158 6.3295 6.3295 7.6908 7.6908 7.7403 7.7403 7.8025 7.8025 7.8944 7.8944 8.5484 8.5484 8.7877 8.7877 9.1748 9.1748 9.5605 9.5605 10.1499 10.1499 10.1698 10.1698 k = 0.0532 0.3429-0.0441 ( 11960 PWs) bands (ev): -48.9797 -48.9797 -48.9772 -48.9772 -25.6777 -25.6777 -25.6679 -25.6679 -25.0687 -25.0687 -25.0604 -25.0604 -24.9573 -24.9573 -24.9413 -24.9413 -7.3909 -7.3909 -7.3092 -7.3092 -4.9088 -4.9088 -4.2388 -4.2388 -3.3760 -3.3760 -3.2369 -3.2369 2.8161 2.8161 3.4459 3.4459 3.9422 3.9422 4.2916 4.2916 4.4364 4.4364 4.6053 4.6053 4.7093 4.7093 5.0611 5.0611 5.5353 5.5353 5.7201 5.7201 6.2959 6.2959 6.3572 6.3572 7.6974 7.6974 7.7707 7.7707 7.8634 7.8634 7.9169 7.9169 8.5254 8.5254 8.7511 8.7511 9.1739 9.1739 9.5553 9.5553 10.1495 10.1495 10.1744 10.1744 k = 0.0426 0.3429-0.0441 ( 11956 PWs) bands (ev): -48.9798 -48.9798 -48.9773 -48.9773 -25.6774 -25.6774 -25.6676 -25.6676 -25.0682 -25.0682 -25.0600 -25.0600 -24.9573 -24.9573 -24.9413 -24.9413 -7.3954 -7.3954 -7.3130 -7.3130 -4.9157 -4.9157 -4.2428 -4.2428 -3.3803 -3.3803 -3.2403 -3.2403 2.8080 2.8080 3.4421 3.4421 3.9448 3.9448 4.3176 4.3176 4.4342 4.4342 4.6287 4.6287 4.6915 4.6915 5.0678 5.0678 5.5919 5.5919 5.7151 5.7151 6.2723 6.2723 6.3859 6.3859 7.7020 7.7020 7.7937 7.7937 7.9169 7.9169 7.9386 7.9386 8.5059 8.5059 8.7186 8.7186 9.1724 9.1724 9.5507 9.5507 10.1466 10.1466 10.1807 10.1807 k = 0.0319 0.3429-0.0441 ( 11950 PWs) bands (ev): -48.9799 -48.9799 -48.9773 -48.9773 -25.6772 -25.6772 -25.6674 -25.6674 -25.0679 -25.0679 -25.0597 -25.0597 -24.9572 -24.9572 -24.9412 -24.9412 -7.3990 -7.3990 -7.3160 -7.3160 -4.9211 -4.9211 -4.2459 -4.2459 -3.3836 -3.3836 -3.2431 -3.2431 2.8017 2.8017 3.4391 3.4391 3.9465 3.9465 4.3396 4.3396 4.4334 4.4334 4.6478 4.6478 4.6751 4.6751 5.0726 5.0726 5.6405 5.6405 5.7098 5.7098 6.2498 6.2498 6.4107 6.4107 7.7052 7.7052 7.8099 7.8099 7.9541 7.9541 7.9652 7.9652 8.4902 8.4902 8.6914 8.6914 9.1705 9.1705 9.5469 9.5469 10.1424 10.1424 10.1875 10.1875 k = 0.0213 0.3429-0.0441 ( 11952 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6771 -25.6771 -25.6673 -25.6673 -25.0676 -25.0676 -25.0595 -25.0595 -24.9572 -24.9572 -24.9412 -24.9412 -7.4015 -7.4015 -7.3182 -7.3182 -4.9250 -4.9250 -4.2481 -4.2481 -3.3860 -3.3860 -3.2450 -3.2450 2.7971 2.7971 3.4368 3.4368 3.9476 3.9476 4.3561 4.3561 4.4340 4.4340 4.6583 4.6583 4.6651 4.6651 5.0758 5.0758 5.6784 5.6784 5.7054 5.7054 6.2308 6.2308 6.4298 6.4298 7.7074 7.7074 7.8202 7.8202 7.9710 7.9710 7.9971 7.9971 8.4787 8.4787 8.6708 8.6708 9.1687 9.1687 9.5441 9.5441 10.1383 10.1383 10.1936 10.1936 k = 0.0106 0.3429-0.0441 ( 11938 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6770 -25.6770 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.4031 -7.4031 -7.3195 -7.3195 -4.9273 -4.9273 -4.2495 -4.2495 -3.3874 -3.3874 -3.2462 -3.2462 2.7944 2.7944 3.4354 3.4354 3.9482 3.9482 4.3662 4.3662 4.4353 4.4353 4.6507 4.6507 4.6722 4.6722 5.0776 5.0776 5.6999 5.6999 5.7054 5.7054 6.2177 6.2177 6.4418 6.4418 7.7086 7.7086 7.8258 7.8258 7.9813 7.9813 8.0177 8.0177 8.4717 8.4717 8.6579 8.6579 9.1673 9.1673 9.5423 9.5423 10.1354 10.1354 10.1977 10.1977 k = 0.0000 0.3429-0.0441 ( 11934 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.4036 -7.4036 -7.3199 -7.3199 -4.9280 -4.9280 -4.2499 -4.2499 -3.3879 -3.3879 -3.2466 -3.2466 2.7935 2.7935 3.4350 3.4350 3.9484 3.9484 4.3695 4.3695 4.4359 4.4359 4.6475 4.6475 4.6751 4.6751 5.0782 5.0782 5.7003 5.7003 5.7125 5.7125 6.2130 6.2130 6.4458 6.4458 7.7090 7.7090 7.8275 7.8275 7.9849 7.9849 8.0247 8.0247 8.4694 8.4694 8.6535 8.6535 9.1668 9.1668 9.5417 9.5417 10.1344 10.1344 10.1992 10.1992 k = 0.0000 0.3429-0.0441 ( 11934 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.4036 -7.4036 -7.3199 -7.3199 -4.9280 -4.9280 -4.2499 -4.2499 -3.3879 -3.3879 -3.2466 -3.2466 2.7935 2.7935 3.4350 3.4350 3.9484 3.9484 4.3695 4.3695 4.4359 4.4359 4.6475 4.6475 4.6751 4.6751 5.0782 5.0782 5.7003 5.7003 5.7125 5.7125 6.2130 6.2130 6.4458 6.4458 7.7090 7.7090 7.8275 7.8275 7.9849 7.9849 8.0247 8.0247 8.4694 8.4694 8.6535 8.6535 9.1668 9.1668 9.5417 9.5417 10.1344 10.1344 10.1992 10.1992 k = 0.0000 0.3442-0.0340 ( 11950 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.4034 -7.4034 -7.3201 -7.3201 -4.9282 -4.9282 -4.2502 -4.2502 -3.3874 -3.3874 -3.2465 -3.2465 2.7916 2.7916 3.4320 3.4320 3.9482 3.9482 4.3725 4.3725 4.4379 4.4379 4.6474 4.6474 4.6751 4.6751 5.0788 5.0788 5.6968 5.6968 5.7195 5.7195 6.2133 6.2133 6.4464 6.4464 7.7035 7.7035 7.8266 7.8266 7.9844 7.9844 8.0237 8.0237 8.4686 8.4686 8.6553 8.6553 9.1654 9.1654 9.5401 9.5401 10.1360 10.1360 10.2001 10.2001 k = 0.0000 0.3455-0.0239 ( 11942 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.4029 -7.4029 -7.3207 -7.3207 -4.9285 -4.9285 -4.2510 -4.2510 -3.3857 -3.3857 -3.2461 -3.2461 2.7860 2.7860 3.4234 3.4234 3.9478 3.9478 4.3793 4.3793 4.4457 4.4457 4.6472 4.6472 4.6749 4.6749 5.0806 5.0806 5.6925 5.6925 5.7342 5.7342 6.2139 6.2139 6.4479 6.4479 7.6873 7.6873 7.8238 7.8238 7.9830 7.9830 8.0208 8.0208 8.4666 8.4666 8.6605 8.6605 9.1611 9.1611 9.5355 9.5355 10.1407 10.1407 10.2028 10.2028 k = 0.0000 0.3468-0.0138 ( 11956 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.4020 -7.4020 -7.3216 -7.3216 -4.9290 -4.9290 -4.2524 -4.2524 -3.3830 -3.3830 -3.2454 -3.2454 2.7771 2.7771 3.4095 3.4095 3.9476 3.9476 4.3850 4.3850 4.4632 4.4632 4.6469 4.6469 4.6746 4.6746 5.0836 5.0836 5.6897 5.6897 5.7542 5.7542 6.2151 6.2151 6.4505 6.4505 7.6614 7.6614 7.8184 7.8184 7.9806 7.9806 8.0162 8.0162 8.4638 8.4638 8.6684 8.6684 9.1539 9.1539 9.5283 9.5283 10.1484 10.1484 10.2073 10.2073 k = 0.0000 0.3481-0.0037 ( 11960 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.4008 -7.4008 -7.3229 -7.3229 -4.9297 -4.9297 -4.2543 -4.2543 -3.3793 -3.3793 -3.2445 -3.2445 2.7653 2.7653 3.3910 3.3910 3.9479 3.9479 4.3862 4.3862 4.4926 4.4926 4.6465 4.6465 4.6742 4.6742 5.0876 5.0876 5.6882 5.6882 5.7794 5.7794 6.2166 6.2166 6.4540 6.4540 7.6268 7.6268 7.8102 7.8102 7.9772 7.9772 8.0102 8.0102 8.4609 8.4609 8.6781 8.6781 9.1440 9.1440 9.5189 9.5189 10.1587 10.1587 10.2134 10.2134 k = 0.0000 0.3494 0.0064 ( 11954 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3993 -7.3993 -7.3245 -7.3245 -4.9306 -4.9306 -4.2567 -4.2567 -3.3748 -3.3748 -3.2433 -3.2433 2.7511 2.7511 3.3686 3.3686 3.9489 3.9489 4.3835 4.3835 4.5319 4.5319 4.6461 4.6461 4.6737 4.6737 5.0924 5.0924 5.6877 5.6877 5.8096 5.8096 6.2185 6.2185 6.4584 6.4584 7.5847 7.5847 7.7987 7.7987 7.9726 7.9726 8.0030 8.0030 8.4583 8.4583 8.6889 8.6889 9.1314 9.1314 9.5081 9.5081 10.1712 10.1712 10.2210 10.2210 k = 0.0000 0.3507 0.0164 ( 11949 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3974 -7.3974 -7.3265 -7.3265 -4.9316 -4.9316 -4.2594 -4.2594 -3.3694 -3.3694 -3.2419 -3.2419 2.7351 2.7351 3.3432 3.3432 3.9508 3.9508 4.3781 4.3781 4.5784 4.5784 4.6457 4.6457 4.6733 4.6733 5.0979 5.0979 5.6882 5.6882 5.8445 5.8445 6.2207 6.2207 6.4637 6.4637 7.5362 7.5362 7.7839 7.7839 7.9667 7.9667 7.9953 7.9953 8.4566 8.4566 8.6999 8.6999 9.1165 9.1165 9.4965 9.4965 10.1855 10.1855 10.2298 10.2298 k = 0.0000 0.3520 0.0265 ( 11946 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3953 -7.3953 -7.3288 -7.3288 -4.9326 -4.9326 -4.2625 -4.2625 -3.3635 -3.3635 -3.2403 -3.2403 2.7181 2.7181 3.3156 3.3156 3.9535 3.9535 4.3712 4.3712 4.6282 4.6282 4.6463 4.6463 4.6733 4.6733 5.1038 5.1038 5.6895 5.6895 5.8836 5.8836 6.2231 6.2231 6.4696 6.4696 7.4825 7.4825 7.7656 7.7656 7.9592 7.9592 7.9877 7.9877 8.4561 8.4561 8.7104 8.7104 9.0996 9.0996 9.4847 9.4847 10.2011 10.2011 10.2397 10.2397 k = 0.0000 0.3533 0.0366 ( 11957 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3929 -7.3929 -7.3314 -7.3314 -4.9337 -4.9337 -4.2659 -4.2659 -3.3572 -3.3572 -3.2384 -3.2384 2.7006 2.7006 3.2866 3.2866 3.9568 3.9568 4.3631 4.3631 4.6432 4.6432 4.6679 4.6679 4.6906 4.6906 5.1100 5.1100 5.6919 5.6919 5.9261 5.9261 6.2258 6.2258 6.4760 6.4760 7.4248 7.4248 7.7441 7.7441 7.9500 7.9500 7.9806 7.9806 8.4569 8.4569 8.7200 8.7200 9.0812 9.0812 9.4732 9.4732 10.2174 10.2174 10.2504 10.2504 k = 0.0000 0.3546 0.0467 ( 11961 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3902 -7.3902 -7.3343 -7.3343 -4.9348 -4.9348 -4.2694 -4.2694 -3.3508 -3.3508 -3.2363 -3.2363 2.6833 2.6833 3.2570 3.2570 3.9607 3.9607 4.3542 4.3542 4.6430 4.6430 4.6693 4.6693 4.7451 4.7451 5.1162 5.1162 5.6955 5.6955 5.9713 5.9713 6.2287 6.2287 6.4830 6.4830 7.3644 7.3644 7.7192 7.7192 7.9394 7.9394 7.9744 7.9744 8.4594 8.4594 8.7282 8.7282 9.0619 9.0619 9.4624 9.4624 10.2339 10.2339 10.2619 10.2619 k = 0.0000 0.3559 0.0568 ( 11951 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3873 -7.3873 -7.3375 -7.3375 -4.9358 -4.9358 -4.2731 -4.2731 -3.3444 -3.3444 -3.2338 -3.2338 2.6666 2.6666 3.2274 3.2274 3.9649 3.9649 4.3450 4.3450 4.6424 4.6424 4.6687 4.6687 4.8021 4.8021 5.1224 5.1224 5.7004 5.7004 6.0181 6.0181 6.2317 6.2317 6.4902 6.4902 7.3028 7.3028 7.6914 7.6914 7.9278 7.9278 7.9688 7.9688 8.4635 8.4635 8.7346 8.7346 9.0423 9.0423 9.4525 9.4525 10.2501 10.2501 10.2740 10.2740 k = 0.0000 0.3572 0.0669 ( 11957 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3842 -7.3842 -7.3409 -7.3409 -4.9368 -4.9368 -4.2768 -4.2768 -3.3384 -3.3384 -3.2309 -3.2309 2.6511 2.6511 3.1984 3.1984 3.9692 3.9692 4.3356 4.3356 4.6418 4.6418 4.6678 4.6678 4.8580 4.8580 5.1282 5.1282 5.7069 5.7069 6.0655 6.0655 6.2349 6.2349 6.4975 6.4975 7.2415 7.2415 7.6609 7.6609 7.9157 7.9157 7.9640 7.9640 8.4691 8.4691 8.7390 8.7390 9.0233 9.0233 9.4438 9.4438 10.2651 10.2651 10.2867 10.2867 k = 0.0000 0.3585 0.0769 ( 11960 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3810 -7.3810 -7.3445 -7.3445 -4.9376 -4.9376 -4.2804 -4.2804 -3.3330 -3.3330 -3.2275 -3.2275 2.6372 2.6372 3.1705 3.1705 3.9735 3.9735 4.3263 4.3263 4.6412 4.6412 4.6668 4.6668 4.9112 4.9112 5.1335 5.1335 5.7151 5.7151 6.1121 6.1121 6.2383 6.2383 6.5048 6.5048 7.1821 7.1821 7.6283 7.6283 7.9036 7.9036 7.9598 7.9598 8.4763 8.4763 8.7411 8.7411 9.0056 9.0056 9.4364 9.4364 10.2784 10.2784 10.2999 10.2999 k = 0.0000 0.3598 0.0870 ( 11964 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3777 -7.3777 -7.3483 -7.3483 -4.9382 -4.9382 -4.2839 -4.2839 -3.3286 -3.3286 -3.2234 -3.2234 2.6252 2.6252 3.1441 3.1441 3.9775 3.9775 4.3174 4.3174 4.6407 4.6407 4.6658 4.6658 4.9597 4.9597 5.1385 5.1385 5.7252 5.7252 6.1560 6.1560 6.2427 6.2427 6.5119 6.5119 7.1265 7.1265 7.5941 7.5941 7.8919 7.8919 7.9564 7.9564 8.4848 8.4848 8.7410 8.7410 8.9899 8.9899 9.4303 9.4303 10.2898 10.2898 10.3134 10.3134 k = 0.0000 0.3611 0.0971 ( 11967 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3744 -7.3744 -7.3520 -7.3520 -4.9387 -4.9387 -4.2871 -4.2871 -3.3252 -3.3252 -3.2188 -3.2188 2.6153 2.6153 3.1196 3.1196 3.9812 3.9812 4.3090 4.3090 4.6403 4.6403 4.6648 4.6648 5.0019 5.0019 5.1430 5.1430 5.7368 5.7368 6.1938 6.1938 6.2501 6.2501 6.5187 6.5187 7.0766 7.0766 7.5594 7.5594 7.8809 7.8809 7.9537 7.9537 8.4943 8.4943 8.7388 8.7388 8.9765 8.9765 9.4255 9.4255 10.2993 10.2993 10.3264 10.3264 k = 0.0000 0.3624 0.1072 ( 11959 PWs) bands (ev): -48.9799 -48.9799 -48.9774 -48.9774 -25.6769 -25.6769 -25.6672 -25.6672 -25.0674 -25.0674 -25.0593 -25.0593 -24.9572 -24.9572 -24.9411 -24.9411 -7.3714 -7.3714 -7.3555 -7.3555 -4.9390 -4.9390 -4.2900 -4.2900 -3.3232 -3.3232 -3.2135 -3.2135 2.6078 2.6078 3.0975 3.0975 3.9844 3.9844 4.3014 4.3014 4.6401 4.6401 4.6639 4.6639 5.0359 5.0359 5.1472 5.1472 5.7495 5.7495 6.2187 6.2187 6.2662 6.2662 6.5250 6.5250 7.0342 7.0342 7.5253 7.5253 7.8708 7.8708 7.9519 7.9519 8.5045 8.5045 8.7350 8.7350 8.9658 8.9658 9.4221 9.4221 10.3071 10.3071 10.3384 10.3384 k = 0.5000 0.3235 0.1953 ( 11994 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9216 -6.9216 -6.9216 -6.9216 -3.8390 -3.8390 -3.8388 -3.8388 -3.0004 -3.0004 -3.0003 -3.0003 2.2632 2.2632 2.2634 2.2634 3.4250 3.4250 3.4254 3.4254 4.0222 4.0222 4.0257 4.0257 4.3160 4.3160 4.3230 4.3230 4.8580 4.8580 4.8587 4.8587 6.0320 6.0320 6.0349 6.0349 6.3967 6.3967 6.4031 6.4031 7.1080 7.1080 7.1108 7.1108 9.4499 9.4499 9.4512 9.4512 9.9765 9.9765 9.9782 9.9782 10.0925 10.0925 10.0949 10.0949 k = 0.5000 0.3127 0.1953 ( 11992 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9476 -24.9476 -6.9243 -6.9243 -6.9242 -6.9242 -3.8405 -3.8405 -3.8402 -3.8402 -2.9903 -2.9903 -2.9901 -2.9901 2.2653 2.2653 2.2657 2.2657 3.4243 3.4243 3.4247 3.4247 4.0245 4.0245 4.0279 4.0279 4.3102 4.3102 4.3179 4.3179 4.8259 4.8259 4.8276 4.8276 6.0364 6.0364 6.0402 6.0402 6.3954 6.3954 6.4036 6.4036 7.1108 7.1108 7.1155 7.1155 9.4788 9.4788 9.4810 9.4810 9.9850 9.9850 9.9877 9.9877 10.0932 10.0932 10.0966 10.0966 k = 0.5000 0.3019 0.1953 ( 12006 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7046 -25.7046 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9475 -24.9475 -6.9281 -6.9281 -6.9281 -6.9281 -3.8427 -3.8427 -3.8422 -3.8422 -2.9760 -2.9760 -2.9757 -2.9757 2.2685 2.2685 2.2689 2.2689 3.4204 3.4204 3.4208 3.4208 4.0305 4.0305 4.0339 4.0339 4.3032 4.3032 4.3116 4.3116 4.7819 4.7819 4.7843 4.7843 6.0408 6.0408 6.0456 6.0456 6.3925 6.3925 6.4024 6.4024 7.1172 7.1172 7.1238 7.1238 9.5175 9.5175 9.5207 9.5207 9.9972 9.9972 10.0005 10.0005 10.0943 10.0943 10.0989 10.0989 k = 0.5000 0.2912 0.1953 ( 12000 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7045 -25.7045 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9475 -24.9475 -6.9330 -6.9330 -6.9329 -6.9329 -3.8454 -3.8454 -3.8448 -3.8448 -2.9574 -2.9574 -2.9571 -2.9571 2.2724 2.2724 2.2730 2.2730 3.4137 3.4137 3.4142 3.4142 4.0396 4.0396 4.0429 4.0429 4.2944 4.2944 4.3036 4.3036 4.7285 4.7285 4.7315 4.7315 6.0448 6.0448 6.0505 6.0505 6.3882 6.3882 6.3997 6.3997 7.1272 7.1272 7.1355 7.1355 9.5630 9.5630 9.5671 9.5671 10.0142 10.0142 10.0176 10.0176 10.0961 10.0961 10.1024 10.1024 k = 0.5000 0.2804 0.1953 ( 11998 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7045 -25.7045 -25.1077 -25.1077 -25.1077 -25.1077 -24.9476 -24.9476 -24.9475 -24.9475 -6.9389 -6.9389 -6.9388 -6.9388 -3.8487 -3.8487 -3.8480 -3.8480 -2.9347 -2.9347 -2.9343 -2.9343 2.2771 2.2771 2.2778 2.2778 3.4047 3.4047 3.4053 3.4053 4.0505 4.0505 4.0536 4.0536 4.2822 4.2822 4.2922 4.2922 4.6700 4.6700 4.6733 4.6733 6.0477 6.0477 6.0544 6.0544 6.3829 6.3829 6.3959 6.3959 7.1401 7.1401 7.1499 7.1499 9.6113 9.6113 9.6164 9.6164 10.0369 10.0369 10.0393 10.0393 10.0994 10.0994 10.1084 10.1084 k = 0.5000 0.2696 0.1953 ( 11988 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7045 -25.7045 -25.1077 -25.1077 -25.1077 -25.1077 -24.9475 -24.9475 -24.9474 -24.9474 -6.9457 -6.9457 -6.9457 -6.9457 -3.8525 -3.8525 -3.8518 -3.8518 -2.9080 -2.9080 -2.9076 -2.9076 2.2822 2.2822 2.2830 2.2830 3.3939 3.3939 3.3947 3.3947 4.0620 4.0620 4.0649 4.0649 4.2634 4.2634 4.2745 4.2745 4.6121 4.6121 4.6154 4.6154 6.0490 6.0490 6.0565 6.0565 6.3773 6.3773 6.3916 6.3916 7.1556 7.1556 7.1667 7.1667 9.6581 9.6581 9.6643 9.6643 10.0626 10.0626 10.0633 10.0633 10.1078 10.1078 10.1213 10.1213 k = 0.5000 0.2588 0.1953 ( 11986 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7045 -25.7045 -25.1077 -25.1077 -25.1077 -25.1077 -24.9475 -24.9475 -24.9474 -24.9474 -6.9534 -6.9534 -6.9533 -6.9533 -3.8569 -3.8569 -3.8560 -3.8560 -2.8775 -2.8775 -2.8771 -2.8771 2.2877 2.2877 2.2885 2.2885 3.3815 3.3815 3.3826 3.3826 4.0724 4.0724 4.0753 4.0753 4.2330 4.2330 4.2454 4.2454 4.5628 4.5628 4.5661 4.5661 6.0479 6.0479 6.0560 6.0560 6.3717 6.3717 6.3871 6.3871 7.1731 7.1731 7.1854 7.1854 9.6996 9.6996 9.7070 9.7070 10.0796 10.0796 10.0819 10.0819 10.1336 10.1336 10.1498 10.1498 k = 0.5000 0.2480 0.1953 ( 11966 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7045 -25.7045 -25.1077 -25.1077 -25.1077 -25.1077 -24.9474 -24.9474 -24.9473 -24.9473 -6.9618 -6.9618 -6.9617 -6.9617 -3.8617 -3.8617 -3.8608 -3.8608 -2.8434 -2.8434 -2.8429 -2.8429 2.2933 2.2933 2.2942 2.2942 3.3680 3.3680 3.3694 3.3694 4.0785 4.0785 4.0822 4.0822 4.1877 4.1877 4.2021 4.2021 4.5297 4.5297 4.5329 4.5329 6.0438 6.0438 6.0522 6.0522 6.3668 6.3668 6.3830 6.3830 7.1923 7.1923 7.2056 7.2056 9.7340 9.7340 9.7426 9.7426 10.0882 10.0882 10.0888 10.0888 10.1791 10.1791 10.1943 10.1943 k = 0.5000 0.2372 0.1953 ( 11972 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7045 -25.7045 -25.1077 -25.1077 -25.1077 -25.1077 -24.9474 -24.9474 -24.9473 -24.9473 -6.9709 -6.9709 -6.9708 -6.9708 -3.8669 -3.8669 -3.8659 -3.8659 -2.8059 -2.8059 -2.8054 -2.8054 2.2987 2.2987 2.2997 2.2997 3.3532 3.3532 3.3551 3.3551 4.0679 4.0679 4.0724 4.0724 4.1397 4.1397 4.1561 4.1561 4.5153 4.5153 4.5186 4.5186 6.0363 6.0363 6.0447 6.0447 6.3629 6.3629 6.3795 6.3795 7.2128 7.2128 7.2268 7.2268 9.7614 9.7614 9.7711 9.7711 10.0918 10.0918 10.0927 10.0927 10.2326 10.2326 10.2467 10.2467 k = 0.5000 0.2265 0.1953 ( 11968 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7045 -25.7045 -25.1077 -25.1077 -25.1077 -25.1077 -24.9473 -24.9473 -24.9472 -24.9472 -6.9805 -6.9805 -6.9804 -6.9804 -3.8724 -3.8724 -3.8714 -3.8714 -2.7653 -2.7653 -2.7647 -2.7647 2.3037 2.3037 2.3048 2.3048 3.3369 3.3369 3.3392 3.3392 4.0138 4.0138 4.0146 4.0146 4.1263 4.1263 4.1384 4.1384 4.5165 4.5165 4.5198 4.5198 6.0252 6.0252 6.0331 6.0331 6.3600 6.3600 6.3767 6.3767 7.2343 7.2343 7.2487 7.2487 9.7832 9.7832 9.7939 9.7939 10.0935 10.0935 10.0956 10.0956 10.2865 10.2865 10.2995 10.2995 k = 0.5000 0.2157 0.1953 ( 11970 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7044 -25.7044 -25.1077 -25.1077 -25.1077 -25.1077 -24.9473 -24.9473 -24.9471 -24.9471 -6.9906 -6.9906 -6.9904 -6.9904 -3.8783 -3.8783 -3.8773 -3.8773 -2.7217 -2.7217 -2.7211 -2.7211 2.3082 2.3082 2.3093 2.3093 3.3181 3.3181 3.3209 3.3209 3.9296 3.9296 3.9335 3.9335 4.1309 4.1309 4.1410 4.1410 4.5286 4.5286 4.5320 4.5320 6.0104 6.0104 6.0174 6.0174 6.3580 6.3580 6.3745 6.3745 7.2566 7.2566 7.2713 7.2713 9.8012 9.8012 9.8127 9.8127 10.0947 10.0947 10.0975 10.0975 10.3358 10.3358 10.3477 10.3477 k = 0.5000 0.2049 0.1953 ( 11968 PWs) bands (ev): -48.9718 -48.9718 -48.9718 -48.9718 -25.7046 -25.7046 -25.7044 -25.7044 -25.1077 -25.1077 -25.1077 -25.1077 -24.9472 -24.9472 -24.9471 -24.9471 -7.0009 -7.0009 -7.0008 -7.0008 -3.8844 -3.8844 -3.8834 -3.8834 -2.6756 -2.6756 -2.6749 -2.6749 2.3119 2.3119 2.3130 2.3130 3.2955 3.2955 3.2988 3.2988 3.8404 3.8404 3.8454 3.8454 4.1396 4.1396 4.1495 4.1495 4.5479 4.5479 4.5514 4.5514 5.9918 5.9918 5.9977 5.9977 6.3565 6.3565 6.3725 6.3725 7.2795 7.2795 7.2942 7.2942 9.8170 9.8170 9.8291 9.8291 10.0954 10.0954 10.0988 10.0988 10.3777 10.3777 10.3883 10.3883 k = 0.5000 0.1941 0.1953 ( 11976 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7046 -25.7046 -25.7044 -25.7044 -25.1077 -25.1077 -25.1077 -25.1077 -24.9472 -24.9472 -24.9470 -24.9470 -7.0115 -7.0115 -7.0113 -7.0113 -3.8908 -3.8908 -3.8896 -3.8896 -2.6272 -2.6272 -2.6265 -2.6265 2.3146 2.3146 2.3157 2.3157 3.2668 3.2668 3.2704 3.2704 3.7537 3.7537 3.7591 3.7591 4.1505 4.1505 4.1609 4.1609 4.5719 4.5719 4.5755 4.5755 5.9699 5.9699 5.9742 5.9742 6.3551 6.3551 6.3704 6.3704 7.3029 7.3029 7.3174 7.3174 9.8315 9.8315 9.8441 9.8441 10.0958 10.0958 10.0996 10.0996 10.4114 10.4114 10.4205 10.4205 k = 0.5000 0.1833 0.1953 ( 11978 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7046 -25.7046 -25.7044 -25.7044 -25.1077 -25.1077 -25.1077 -25.1077 -24.9471 -24.9471 -24.9470 -24.9470 -7.0221 -7.0221 -7.0220 -7.0220 -3.8972 -3.8972 -3.8961 -3.8961 -2.5768 -2.5768 -2.5761 -2.5761 2.3162 2.3162 2.3174 2.3174 3.2291 3.2291 3.2328 3.2328 3.6753 3.6753 3.6805 3.6805 4.1639 4.1639 4.1748 4.1748 4.5988 4.5988 4.6027 4.6027 5.9447 5.9447 5.9473 5.9473 6.3533 6.3533 6.3678 6.3678 7.3267 7.3267 7.3409 7.3409 9.8458 9.8458 9.8586 9.8586 10.0958 10.0958 10.0999 10.0999 10.4375 10.4375 10.4453 10.4453 k = 0.5000 0.1725 0.1953 ( 11976 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7046 -25.7046 -25.7044 -25.7044 -25.1077 -25.1077 -25.1077 -25.1077 -24.9470 -24.9470 -24.9469 -24.9469 -7.0328 -7.0328 -7.0326 -7.0326 -3.9036 -3.9036 -3.9025 -3.9025 -2.5250 -2.5250 -2.5242 -2.5242 2.3165 2.3165 2.3177 2.3177 3.1796 3.1796 3.1830 3.1830 3.6096 3.6096 3.6141 3.6141 4.1802 4.1802 4.1916 4.1916 4.6274 4.6274 4.6317 4.6317 5.9164 5.9164 5.9172 5.9172 6.3508 6.3508 6.3644 6.3644 7.3508 7.3508 7.3647 7.3647 9.8603 9.8603 9.8730 9.8730 10.0955 10.0955 10.0998 10.0998 10.4577 10.4577 10.4642 10.4642 k = 0.5000 0.1618 0.1953 ( 11982 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7045 -25.7045 -25.7044 -25.7044 -25.1077 -25.1077 -25.1077 -25.1077 -24.9470 -24.9470 -24.9468 -24.9468 -7.0433 -7.0433 -7.0432 -7.0432 -3.9101 -3.9101 -3.9090 -3.9090 -2.4719 -2.4719 -2.4711 -2.4711 2.3153 2.3153 2.3166 2.3166 3.1171 3.1171 3.1200 3.1200 3.5589 3.5589 3.5625 3.5625 4.1997 4.1997 4.2116 4.2116 4.6568 4.6568 4.6615 4.6615 5.8841 5.8841 5.8851 5.8851 6.3475 6.3475 6.3600 6.3600 7.3753 7.3753 7.3885 7.3885 9.8752 9.8752 9.8878 9.8878 10.0949 10.0949 10.0993 10.0993 10.4736 10.4736 10.4790 10.4790 k = 0.5000 0.1510 0.1953 ( 11982 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7045 -25.7045 -25.7044 -25.7044 -25.1077 -25.1077 -25.1077 -25.1077 -24.9469 -24.9469 -24.9468 -24.9468 -7.0536 -7.0536 -7.0535 -7.0535 -3.9165 -3.9165 -3.9154 -3.9154 -2.4182 -2.4182 -2.4174 -2.4174 2.3127 2.3127 2.3140 2.3140 3.0437 3.0437 3.0458 3.0458 3.5221 3.5221 3.5246 3.5246 4.2227 4.2227 4.2350 4.2350 4.6862 4.6862 4.6915 4.6915 5.8480 5.8480 5.8511 5.8511 6.3432 6.3432 6.3547 6.3547 7.3999 7.3999 7.4124 7.4124 9.8907 9.8907 9.9030 9.9030 10.0939 10.0939 10.0983 10.0983 10.4867 10.4867 10.4913 10.4913 k = 0.5000 0.1402 0.1953 ( 11984 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7045 -25.7045 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9469 -24.9469 -24.9467 -24.9467 -7.0637 -7.0637 -7.0636 -7.0636 -3.9227 -3.9227 -3.9217 -3.9217 -2.3642 -2.3642 -2.3634 -2.3634 2.3082 2.3082 2.3096 2.3096 2.9633 2.9633 2.9649 2.9649 3.4961 3.4961 3.4976 3.4976 4.2496 4.2496 4.2620 4.2620 4.7150 4.7150 4.7211 4.7211 5.8091 5.8091 5.8142 5.8142 6.3380 6.3380 6.3485 6.3485 7.4246 7.4246 7.4363 7.4363 9.9068 9.9068 9.9185 9.9185 10.0926 10.0926 10.0970 10.0970 10.4983 10.4983 10.5024 10.5024 k = 0.5000 0.1294 0.1953 ( 11986 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7045 -25.7045 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9468 -24.9468 -24.9466 -24.9466 -7.0733 -7.0733 -7.0732 -7.0732 -3.9288 -3.9288 -3.9277 -3.9277 -2.3105 -2.3105 -2.3097 -2.3097 2.3018 2.3018 2.3032 2.3032 2.8803 2.8803 2.8814 2.8814 3.4776 3.4776 3.4783 3.4783 4.2803 4.2803 4.2928 4.2928 4.7429 4.7429 4.7498 4.7498 5.7674 5.7674 5.7746 5.7746 6.3322 6.3322 6.3417 6.3417 7.4491 7.4491 7.4600 7.4600 9.9232 9.9232 9.9342 9.9342 10.0910 10.0910 10.0953 10.0953 10.5093 10.5093 10.5131 10.5131 k = 0.5000 0.1186 0.1953 ( 11984 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7045 -25.7045 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9467 -24.9467 -24.9466 -24.9466 -7.0825 -7.0825 -7.0824 -7.0824 -3.9346 -3.9346 -3.9336 -3.9336 -2.2577 -2.2577 -2.2569 -2.2569 2.2929 2.2929 2.2944 2.2944 2.7983 2.7983 2.7991 2.7991 3.4641 3.4641 3.4641 3.4641 4.3147 4.3147 4.3271 4.3271 4.7694 4.7694 4.7774 4.7774 5.7231 5.7231 5.7323 5.7323 6.3260 6.3260 6.3344 6.3344 7.4732 7.4732 7.4832 7.4832 9.9397 9.9397 9.9500 9.9500 10.0892 10.0892 10.0933 10.0933 10.5206 10.5206 10.5242 10.5242 k = 0.5000 0.1078 0.1953 ( 11984 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7045 -25.7045 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9467 -24.9467 -24.9465 -24.9465 -7.0911 -7.0911 -7.0910 -7.0910 -3.9400 -3.9400 -3.9391 -3.9391 -2.2062 -2.2062 -2.2055 -2.2055 2.2811 2.2811 2.2827 2.2827 2.7206 2.7206 2.7213 2.7213 3.4535 3.4535 3.4539 3.4539 4.3528 4.3528 4.3647 4.3647 4.7943 4.7943 4.8034 4.8034 5.6763 5.6763 5.6875 5.6875 6.3196 6.3196 6.3270 6.3270 7.4967 7.4967 7.5057 7.5057 9.9561 9.9561 9.9654 9.9654 10.0872 10.0872 10.0911 10.0911 10.5325 10.5325 10.5361 10.5361 k = 0.5000 0.0971 0.1953 ( 11980 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7045 -25.7045 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9466 -24.9466 -24.9465 -24.9465 -7.0991 -7.0991 -7.0990 -7.0990 -3.9451 -3.9451 -3.9443 -3.9443 -2.1568 -2.1568 -2.1561 -2.1561 2.2655 2.2655 2.2672 2.2672 2.6498 2.6498 2.6504 2.6504 3.4452 3.4452 3.4459 3.4459 4.3941 4.3941 4.4054 4.4054 4.8173 4.8173 4.8277 4.8277 5.6273 5.6273 5.6404 5.6404 6.3133 6.3133 6.3197 6.3197 7.5192 7.5192 7.5273 7.5273 9.9719 9.9719 9.9802 9.9802 10.0851 10.0851 10.0888 10.0888 10.5454 10.5454 10.5490 10.5490 k = 0.5000 0.0863 0.1953 ( 11982 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7044 -25.7044 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9466 -24.9466 -24.9465 -24.9465 -7.1065 -7.1065 -7.1064 -7.1064 -3.9498 -3.9498 -3.9491 -3.9491 -2.1101 -2.1101 -2.1094 -2.1094 2.2456 2.2456 2.2473 2.2473 2.5884 2.5884 2.5890 2.5890 3.4386 3.4386 3.4395 3.4395 4.4381 4.4381 4.4484 4.4484 4.8383 4.8383 4.8503 4.8503 5.5765 5.5765 5.5913 5.5913 6.3074 6.3074 6.3128 6.3128 7.5405 7.5405 7.5477 7.5477 9.9868 9.9868 9.9941 9.9941 10.0830 10.0830 10.0865 10.0865 10.5594 10.5594 10.5631 10.5631 k = 0.5000 0.0755 0.1953 ( 11984 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7044 -25.7044 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9465 -24.9465 -24.9464 -24.9464 -7.1131 -7.1131 -7.1130 -7.1130 -3.9541 -3.9541 -3.9534 -3.9534 -2.0667 -2.0667 -2.0661 -2.0661 2.2211 2.2211 2.2227 2.2227 2.5378 2.5378 2.5384 2.5384 3.4332 3.4332 3.4342 3.4342 4.4841 4.4841 4.4933 4.4933 4.8573 4.8573 4.8708 4.8708 5.5245 5.5245 5.5409 5.5409 6.3020 6.3020 6.3065 6.3065 7.5602 7.5602 7.5665 7.5665 10.0006 10.0006 10.0068 10.0068 10.0810 10.0810 10.0842 10.0842 10.5743 10.5743 10.5782 10.5782 k = 0.5000 0.0647 0.1953 ( 11990 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7044 -25.7044 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9465 -24.9465 -24.9464 -24.9464 -7.1189 -7.1189 -7.1188 -7.1188 -3.9578 -3.9578 -3.9572 -3.9572 -2.0273 -2.0273 -2.0268 -2.0268 2.1927 2.1927 2.1943 2.1943 2.4986 2.4986 2.4992 2.4992 3.4289 3.4289 3.4298 3.4298 4.5313 4.5313 4.5388 4.5388 4.8741 4.8741 4.8894 4.8894 5.4721 5.4721 5.4897 5.4897 6.2972 6.2972 6.3010 6.3010 7.5781 7.5781 7.5834 7.5834 10.0128 10.0128 10.0178 10.0178 10.0793 10.0793 10.0822 10.0822 10.5899 10.5899 10.5938 10.5938 k = 0.5000 0.0539 0.1953 ( 11986 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7044 -25.7044 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9464 -24.9464 -24.9464 -24.9464 -7.1239 -7.1239 -7.1238 -7.1238 -3.9610 -3.9610 -3.9605 -3.9605 -1.9926 -1.9926 -1.9922 -1.9922 2.1626 2.1626 2.1639 2.1639 2.4697 2.4697 2.4702 2.4702 3.4253 3.4253 3.4261 3.4261 4.5782 4.5782 4.5839 4.5839 4.8891 4.8891 4.9060 4.9060 5.4205 5.4205 5.4389 5.4389 6.2932 6.2932 6.2962 6.2962 7.5938 7.5938 7.5982 7.5982 10.0232 10.0232 10.0272 10.0272 10.0779 10.0779 10.0806 10.0806 10.6057 10.6057 10.6095 10.6095 k = 0.5000 0.0431 0.1953 ( 11996 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7044 -25.7044 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9464 -24.9464 -24.9463 -24.9463 -7.1280 -7.1280 -7.1280 -7.1280 -3.9637 -3.9637 -3.9633 -3.9633 -1.9632 -1.9632 -1.9628 -1.9628 2.1335 2.1335 2.1346 2.1346 2.4493 2.4493 2.4496 2.4496 3.4225 3.4225 3.4232 3.4232 4.6231 4.6231 4.6268 4.6268 4.9024 4.9024 4.9204 4.9204 5.3714 5.3714 5.3899 5.3899 6.2900 6.2900 6.2923 6.2923 7.6071 7.6071 7.6106 7.6106 10.0316 10.0316 10.0346 10.0346 10.0771 10.0771 10.0794 10.0794 10.6208 10.6208 10.6243 10.6243 k = 0.5000 0.0324 0.1953 ( 11990 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7044 -25.7044 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9464 -24.9464 -24.9463 -24.9463 -7.1312 -7.1312 -7.1312 -7.1312 -3.9658 -3.9658 -3.9655 -3.9655 -1.9397 -1.9397 -1.9394 -1.9394 2.1081 2.1081 2.1089 2.1089 2.4353 2.4353 2.4356 2.4356 3.4203 3.4203 3.4209 3.4209 4.6636 4.6636 4.6652 4.6652 4.9144 4.9144 4.9323 4.9323 5.3274 5.3274 5.3446 5.3446 6.2875 6.2875 6.2892 6.2892 7.6178 7.6178 7.6204 7.6204 10.0380 10.0380 10.0400 10.0400 10.0768 10.0768 10.0786 10.0786 10.6344 10.6344 10.6374 10.6374 k = 0.5000 0.0216 0.1953 ( 11994 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7044 -25.7044 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1336 -7.1336 -7.1336 -7.1336 -3.9673 -3.9673 -3.9671 -3.9671 -1.9225 -1.9225 -1.9223 -1.9223 2.0885 2.0885 2.0891 2.0891 2.4263 2.4263 2.4265 2.4265 3.4188 3.4188 3.4192 3.4192 4.6963 4.6963 4.6964 4.6964 4.9255 4.9255 4.9409 4.9409 5.2921 5.2921 5.3060 5.3060 6.2858 6.2858 6.2869 6.2869 7.6257 7.6257 7.6274 7.6274 10.0423 10.0423 10.0435 10.0435 10.0769 10.0769 10.0783 10.0783 10.6454 10.6454 10.6476 10.6476 k = 0.5000 0.0108 0.1953 ( 12002 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7044 -25.7044 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1350 -7.1350 -7.1350 -7.1350 -3.9682 -3.9682 -3.9681 -3.9681 -1.9120 -1.9120 -1.9119 -1.9119 2.0763 2.0763 2.0766 2.0766 2.4213 2.4213 2.4213 2.4213 3.4180 3.4180 3.4182 3.4182 4.7172 4.7172 4.7176 4.7176 4.9355 4.9355 4.9447 4.9447 5.2700 5.2700 5.2780 5.2780 6.2850 6.2850 6.2855 6.2855 7.6307 7.6307 7.6315 7.6315 10.0448 10.0448 10.0454 10.0454 10.0773 10.0773 10.0780 10.0780 10.6528 10.6528 10.6540 10.6540 k = 0.5000-0.0000 0.1953 ( 12004 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1354 -7.1354 -7.1354 -7.1354 -3.9684 -3.9684 -3.9684 -3.9684 -1.9084 -1.9084 -1.9084 -1.9084 2.0723 2.0723 2.0723 2.0723 2.4197 2.4197 2.4197 2.4197 3.4177 3.4177 3.4177 3.4177 4.7248 4.7248 4.7248 4.7248 4.9427 4.9427 4.9427 4.9427 5.2650 5.2650 5.2650 5.2650 6.2848 6.2848 6.2848 6.2848 7.6326 7.6326 7.6326 7.6326 10.0458 10.0458 10.0458 10.0458 10.0777 10.0777 10.0777 10.0777 10.6558 10.6558 10.6558 10.6558 k = 0.5000-0.0000 0.1953 ( 12004 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1354 -7.1354 -7.1354 -7.1354 -3.9684 -3.9684 -3.9684 -3.9684 -1.9084 -1.9084 -1.9084 -1.9084 2.0723 2.0723 2.0723 2.0723 2.4197 2.4197 2.4197 2.4197 3.4177 3.4177 3.4177 3.4177 4.7248 4.7248 4.7248 4.7248 4.9427 4.9427 4.9427 4.9427 5.2650 5.2650 5.2650 5.2650 6.2848 6.2848 6.2848 6.2848 7.6326 7.6326 7.6326 7.6326 10.0458 10.0458 10.0458 10.0458 10.0777 10.0777 10.0777 10.0777 10.6558 10.6558 10.6558 10.6558 k = 0.5000-0.0000 0.1850 ( 12004 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1354 -7.1354 -7.1354 -7.1354 -3.9684 -3.9684 -3.9684 -3.9684 -1.9084 -1.9084 -1.9084 -1.9084 2.0725 2.0725 2.0726 2.0726 2.4188 2.4188 2.4191 2.4191 3.4182 3.4182 3.4183 3.4183 4.7241 4.7241 4.7247 4.7247 4.9417 4.9417 4.9429 4.9429 5.2661 5.2661 5.2673 5.2673 6.2827 6.2827 6.2841 6.2841 7.6331 7.6331 7.6339 7.6339 10.0453 10.0453 10.0457 10.0457 10.0777 10.0777 10.0777 10.0777 10.6557 10.6557 10.6565 10.6565 k = 0.5000-0.0000 0.1747 ( 11990 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9684 -3.9684 -3.9684 -3.9684 -1.9085 -1.9085 -1.9085 -1.9085 2.0734 2.0734 2.0737 2.0737 2.4166 2.4166 2.4171 2.4171 3.4196 3.4196 3.4198 3.4198 4.7224 4.7224 4.7236 4.7236 4.9401 4.9401 4.9423 4.9423 5.2706 5.2706 5.2729 5.2729 6.2778 6.2778 6.2804 6.2804 7.6353 7.6353 7.6369 7.6369 10.0443 10.0443 10.0449 10.0449 10.0775 10.0775 10.0775 10.0775 10.6564 10.6564 10.6580 10.6580 k = 0.5000-0.0000 0.1645 ( 11982 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9684 -3.9684 -3.9684 -3.9684 -1.9085 -1.9085 -1.9085 -1.9085 2.0749 2.0749 2.0753 2.0753 2.4130 2.4130 2.4137 2.4137 3.4219 3.4219 3.4222 3.4222 4.7200 4.7200 4.7217 4.7217 4.9380 4.9380 4.9410 4.9410 5.2782 5.2782 5.2814 5.2814 6.2701 6.2701 6.2740 6.2740 7.6391 7.6391 7.6416 7.6416 10.0427 10.0427 10.0436 10.0436 10.0772 10.0772 10.0772 10.0772 10.6577 10.6577 10.6601 10.6601 k = 0.5000-0.0000 0.1542 ( 11992 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9683 -3.9683 -3.9683 -3.9683 -1.9085 -1.9085 -1.9085 -1.9085 2.0770 2.0770 2.0776 2.0776 2.4081 2.4081 2.4090 2.4090 3.4251 3.4251 3.4254 3.4254 4.7169 4.7169 4.7191 4.7191 4.9356 4.9356 4.9393 4.9393 5.2885 5.2885 5.2926 5.2926 6.2600 6.2600 6.2649 6.2649 7.6445 7.6445 7.6477 7.6477 10.0405 10.0405 10.0417 10.0417 10.0768 10.0768 10.0769 10.0769 10.6597 10.6597 10.6627 10.6627 k = 0.5000-0.0000 0.1439 ( 12000 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9683 -3.9683 -3.9683 -3.9683 -1.9085 -1.9085 -1.9085 -1.9085 2.0798 2.0798 2.0804 2.0804 2.4021 2.4021 2.4032 2.4032 3.4289 3.4289 3.4293 3.4293 4.7134 4.7134 4.7158 4.7158 4.9330 4.9330 4.9371 4.9371 5.3012 5.3012 5.3060 5.3060 6.2476 6.2476 6.2536 6.2536 7.6513 7.6513 7.6550 7.6550 10.0379 10.0379 10.0393 10.0393 10.0764 10.0764 10.0764 10.0764 10.6621 10.6621 10.6657 10.6657 k = 0.5000-0.0000 0.1336 ( 11980 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9682 -3.9682 -3.9682 -3.9682 -1.9085 -1.9085 -1.9085 -1.9085 2.0831 2.0831 2.0838 2.0838 2.3950 2.3950 2.3963 2.3963 3.4334 3.4334 3.4338 3.4338 4.7096 4.7096 4.7122 4.7122 4.9304 4.9304 4.9347 4.9347 5.3158 5.3158 5.3210 5.3210 6.2333 6.2333 6.2401 6.2401 7.6592 7.6592 7.6634 7.6634 10.0350 10.0350 10.0365 10.0365 10.0759 10.0759 10.0760 10.0760 10.6648 10.6648 10.6690 10.6690 k = 0.5000-0.0000 0.1233 ( 11978 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9682 -3.9682 -3.9682 -3.9682 -1.9085 -1.9085 -1.9085 -1.9085 2.0869 2.0869 2.0878 2.0878 2.3870 2.3870 2.3885 2.3885 3.4382 3.4382 3.4387 3.4387 4.7056 4.7056 4.7084 4.7084 4.9280 4.9280 4.9323 4.9323 5.3317 5.3317 5.3374 5.3374 6.2174 6.2174 6.2250 6.2250 7.6679 7.6679 7.6725 7.6725 10.0317 10.0317 10.0334 10.0334 10.0754 10.0754 10.0755 10.0755 10.6677 10.6677 10.6724 10.6724 k = 0.5000-0.0000 0.1131 ( 11972 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9681 -3.9681 -3.9681 -3.9681 -1.9085 -1.9085 -1.9085 -1.9085 2.0912 2.0912 2.0922 2.0922 2.3783 2.3783 2.3799 2.3799 3.4434 3.4434 3.4439 3.4439 4.7018 4.7018 4.7045 4.7045 4.9258 4.9258 4.9299 4.9299 5.3486 5.3486 5.3545 5.3545 6.2004 6.2004 6.2085 6.2085 7.6774 7.6774 7.6821 7.6821 10.0283 10.0283 10.0300 10.0300 10.0749 10.0749 10.0751 10.0751 10.6707 10.6707 10.6757 10.6757 k = 0.5000-0.0000 0.1028 ( 11988 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9680 -3.9680 -3.9680 -3.9680 -1.9085 -1.9085 -1.9085 -1.9085 2.0960 2.0960 2.0970 2.0970 2.3691 2.3691 2.3708 2.3708 3.4486 3.4486 3.4491 3.4491 4.6982 4.6982 4.7008 4.7008 4.9238 4.9238 4.9276 4.9276 5.3659 5.3659 5.3719 5.3719 6.1827 6.1827 6.1911 6.1911 7.6871 7.6871 7.6920 7.6920 10.0248 10.0248 10.0265 10.0265 10.0745 10.0745 10.0746 10.0746 10.6735 10.6735 10.6787 10.6787 k = 0.5000-0.0000 0.0925 ( 11996 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9680 -3.9680 -3.9680 -3.9680 -1.9086 -1.9086 -1.9086 -1.9086 2.1011 2.1011 2.1023 2.1023 2.3596 2.3596 2.3613 2.3613 3.4538 3.4538 3.4543 3.4543 4.6949 4.6949 4.6974 4.6974 4.9220 4.9220 4.9255 4.9255 5.3833 5.3833 5.3893 5.3893 6.1647 6.1647 6.1733 6.1733 7.6970 7.6970 7.7018 7.7018 10.0212 10.0212 10.0230 10.0230 10.0740 10.0740 10.0742 10.0742 10.6761 10.6761 10.6813 10.6813 k = 0.5000-0.0000 0.0822 ( 12006 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9679 -3.9679 -3.9679 -3.9679 -1.9086 -1.9086 -1.9086 -1.9086 2.1066 2.1066 2.1077 2.1077 2.3499 2.3499 2.3516 2.3516 3.4589 3.4589 3.4594 3.4594 4.6920 4.6920 4.6943 4.6943 4.9205 4.9205 4.9236 4.9236 5.4004 5.4004 5.4062 5.4062 6.1469 6.1469 6.1554 6.1554 7.7067 7.7067 7.7113 7.7113 10.0178 10.0178 10.0195 10.0195 10.0737 10.0737 10.0738 10.0738 10.6782 10.6782 10.6834 10.6834 k = 0.5000-0.0000 0.0719 ( 11998 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9679 -3.9679 -3.9679 -3.9679 -1.9086 -1.9086 -1.9086 -1.9086 2.1122 2.1122 2.1133 2.1133 2.3403 2.3403 2.3420 2.3420 3.4636 3.4636 3.4640 3.4640 4.6896 4.6896 4.6916 4.6916 4.9192 4.9192 4.9219 4.9219 5.4167 5.4167 5.4223 5.4223 6.1298 6.1298 6.1379 6.1379 7.7159 7.7159 7.7202 7.7202 10.0146 10.0146 10.0162 10.0162 10.0734 10.0734 10.0735 10.0735 10.6799 10.6799 10.6849 10.6849 k = 0.5000-0.0000 0.0617 ( 11998 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9678 -3.9678 -3.9678 -3.9678 -1.9086 -1.9086 -1.9086 -1.9086 2.1178 2.1178 2.1189 2.1189 2.3310 2.3310 2.3326 2.3326 3.4679 3.4679 3.4683 3.4683 4.6876 4.6876 4.6893 4.6893 4.9182 4.9182 4.9204 4.9204 5.4320 5.4320 5.4372 5.4372 6.1138 6.1138 6.1213 6.1213 7.7245 7.7245 7.7284 7.7284 10.0117 10.0117 10.0131 10.0131 10.0731 10.0731 10.0733 10.0733 10.6811 10.6811 10.6857 10.6857 k = 0.5000-0.0000 0.0514 ( 11996 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9677 -3.9677 -3.9677 -3.9677 -1.9086 -1.9086 -1.9086 -1.9086 2.1233 2.1233 2.1243 2.1243 2.3224 2.3224 2.3239 2.3239 3.4717 3.4717 3.4721 3.4721 4.6860 4.6860 4.6875 4.6875 4.9173 4.9173 4.9191 4.9191 5.4458 5.4458 5.4504 5.4504 6.0993 6.0993 6.1061 6.1061 7.7322 7.7322 7.7356 7.7356 10.0092 10.0092 10.0104 10.0104 10.0729 10.0729 10.0730 10.0730 10.6819 10.6819 10.6860 10.6860 k = 0.5000-0.0000 0.0411 ( 12000 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1355 -7.1355 -7.1355 -7.1355 -3.9677 -3.9677 -3.9677 -3.9677 -1.9086 -1.9086 -1.9086 -1.9086 2.1284 2.1284 2.1293 2.1293 2.3147 2.3147 2.3160 2.3160 3.4749 3.4749 3.4752 3.4752 4.6849 4.6849 4.6860 4.6860 4.9167 4.9167 4.9181 4.9181 5.4578 5.4578 5.4618 5.4618 6.0870 6.0870 6.0927 6.0927 7.7389 7.7389 7.7417 7.7417 10.0070 10.0070 10.0080 10.0080 10.0727 10.0727 10.0729 10.0729 10.6824 10.6824 10.6858 10.6858 k = 0.5000-0.0000 0.0308 ( 11998 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1356 -7.1356 -7.1356 -7.1356 -3.9677 -3.9677 -3.9677 -3.9677 -1.9086 -1.9086 -1.9086 -1.9086 2.1328 2.1328 2.1336 2.1336 2.3082 2.3082 2.3093 2.3093 3.4775 3.4775 3.4777 3.4777 4.6841 4.6841 4.6849 4.6849 4.9162 4.9162 4.9172 4.9172 5.4677 5.4677 5.4708 5.4708 6.0770 6.0770 6.0816 6.0816 7.7443 7.7443 7.7464 7.7464 10.0053 10.0053 10.0061 10.0061 10.0726 10.0726 10.0727 10.0727 10.6827 10.6827 10.6853 10.6853 k = 0.5000-0.0000 0.0206 ( 11998 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1356 -7.1356 -7.1356 -7.1356 -3.9676 -3.9676 -3.9676 -3.9676 -1.9086 -1.9086 -1.9086 -1.9086 2.1363 2.1363 2.1369 2.1369 2.3033 2.3033 2.3041 2.3041 3.4794 3.4794 3.4795 3.4795 4.6836 4.6836 4.6842 4.6842 4.9159 4.9159 4.9166 4.9166 5.4752 5.4752 5.4773 5.4773 6.0699 6.0699 6.0731 6.0731 7.7484 7.7484 7.7498 7.7498 10.0042 10.0042 10.0047 10.0047 10.0726 10.0726 10.0726 10.0726 10.6829 10.6829 10.6847 10.6847 k = 0.5000-0.0000 0.0103 ( 12000 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1356 -7.1356 -7.1356 -7.1356 -3.9676 -3.9676 -3.9676 -3.9676 -1.9086 -1.9086 -1.9086 -1.9086 2.1387 2.1387 2.1390 2.1390 2.3003 2.3003 2.3007 2.3007 3.4805 3.4805 3.4806 3.4806 4.6834 4.6834 4.6837 4.6837 4.9158 4.9158 4.9161 4.9161 5.4800 5.4800 5.4811 5.4811 6.0659 6.0659 6.0675 6.0675 7.7510 7.7510 7.7517 7.7517 10.0035 10.0035 10.0038 10.0038 10.0725 10.0725 10.0726 10.0726 10.6831 10.6831 10.6840 10.6840 k = 0.5000-0.0000-0.0000 ( 12010 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1356 -7.1356 -7.1356 -7.1356 -3.9676 -3.9676 -3.9676 -3.9676 -1.9086 -1.9086 -1.9086 -1.9086 2.1396 2.1396 2.1396 2.1396 2.2995 2.2995 2.2995 2.2995 3.4809 3.4809 3.4809 3.4809 4.6834 4.6834 4.6834 4.6834 4.9159 4.9159 4.9159 4.9159 5.4820 5.4820 5.4820 5.4820 6.0650 6.0650 6.0650 6.0650 7.7521 7.7521 7.7521 7.7521 10.0034 10.0034 10.0034 10.0034 10.0725 10.0725 10.0725 10.0725 10.6835 10.6835 10.6835 10.6835 k = 0.0000 0.0000 0.1953 ( 11950 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6780 -25.6780 -25.6652 -25.6652 -25.0692 -25.0692 -25.0572 -25.0572 -24.9569 -24.9569 -24.9388 -24.9388 -7.6839 -7.6839 -7.5826 -7.5826 -5.1713 -5.1713 -3.5926 -3.5926 -2.3203 -2.3203 -2.2425 -2.2425 1.6851 1.6851 1.8146 1.8146 2.0530 2.0530 3.0684 3.0684 4.1540 4.1540 4.4538 4.4538 4.5997 4.5997 5.3585 5.3585 5.9451 5.9451 6.2105 6.2105 6.5998 6.5998 7.3455 7.3455 7.7861 7.7861 7.8770 7.8770 8.2648 8.2648 8.3217 8.3217 8.4475 8.4475 9.0434 9.0434 10.0616 10.0616 10.5712 10.5712 10.6154 10.6154 10.6530 10.6530 k = 0.0106-0.0000 0.1953 ( 11954 PWs) bands (ev): -48.9801 -48.9801 -48.9773 -48.9773 -25.6781 -25.6781 -25.6653 -25.6653 -25.0693 -25.0693 -25.0573 -25.0573 -24.9570 -24.9570 -24.9388 -24.9388 -7.6834 -7.6834 -7.5821 -7.5821 -5.1708 -5.1708 -3.5923 -3.5923 -2.3200 -2.3200 -2.2420 -2.2420 1.6858 1.6858 1.8147 1.8147 2.0540 2.0540 3.0693 3.0693 4.1531 4.1531 4.4529 4.4529 4.5965 4.5965 5.3577 5.3577 5.9389 5.9389 6.2122 6.2122 6.6008 6.6008 7.3408 7.3408 7.7744 7.7744 7.8862 7.8862 8.2502 8.2502 8.3302 8.3302 8.4505 8.4505 9.0483 9.0483 10.0617 10.0617 10.5689 10.5689 10.6151 10.6151 10.6508 10.6508 k = 0.0213-0.0000 0.1953 ( 11956 PWs) bands (ev): -48.9800 -48.9800 -48.9773 -48.9773 -25.6782 -25.6782 -25.6654 -25.6654 -25.0694 -25.0694 -25.0574 -25.0574 -24.9570 -24.9570 -24.9388 -24.9388 -7.6819 -7.6819 -7.5804 -7.5804 -5.1690 -5.1690 -3.5913 -3.5913 -2.3191 -2.3191 -2.2407 -2.2407 1.6876 1.6876 1.8150 1.8150 2.0570 2.0570 3.0719 3.0719 4.1505 4.1505 4.4502 4.4502 4.5869 4.5869 5.3554 5.3554 5.9206 5.9206 6.2171 6.2171 6.6034 6.6034 7.3269 7.3269 7.7468 7.7468 7.9063 7.9063 8.2185 8.2185 8.3439 8.3439 8.4593 8.4593 9.0624 9.0624 10.0618 10.0618 10.5620 10.5620 10.6142 10.6142 10.6445 10.6445 k = 0.0319-0.0000 0.1953 ( 11966 PWs) bands (ev): -48.9800 -48.9800 -48.9772 -48.9772 -25.6783 -25.6783 -25.6655 -25.6655 -25.0697 -25.0697 -25.0576 -25.0576 -24.9570 -24.9570 -24.9389 -24.9389 -7.6794 -7.6794 -7.5776 -7.5776 -5.1661 -5.1661 -3.5897 -3.5897 -2.3176 -2.3176 -2.2386 -2.2386 1.6908 1.6908 1.8154 1.8154 2.0619 2.0619 3.0764 3.0764 4.1461 4.1461 4.4458 4.4458 4.5712 4.5712 5.3515 5.3515 5.8913 5.8913 6.2247 6.2247 6.6074 6.6074 7.3041 7.3041 7.7116 7.7116 7.9290 7.9290 8.1792 8.1792 8.3544 8.3544 8.4735 8.4735 9.0848 9.0848 10.0619 10.0619 10.5513 10.5513 10.6108 10.6108 10.6364 10.6364 k = 0.0426-0.0000 0.1953 ( 11958 PWs) bands (ev): -48.9799 -48.9799 -48.9772 -48.9772 -25.6785 -25.6785 -25.6657 -25.6657 -25.0700 -25.0700 -25.0580 -25.0580 -24.9570 -24.9570 -24.9389 -24.9389 -7.6760 -7.6760 -7.5737 -7.5737 -5.1620 -5.1620 -3.5875 -3.5875 -2.3154 -2.3154 -2.2356 -2.2356 1.6951 1.6951 1.8160 1.8160 2.0689 2.0689 3.0826 3.0826 4.1396 4.1396 4.4398 4.4398 4.5494 4.5494 5.3460 5.3460 5.8523 5.8523 6.2345 6.2345 6.6126 6.6126 7.2728 7.2728 7.6718 7.6718 7.9513 7.9513 8.1353 8.1353 8.3601 8.3601 8.4926 8.4926 9.1138 9.1138 10.0618 10.0618 10.5378 10.5378 10.6013 10.6013 10.6310 10.6310 k = 0.0532-0.0000 0.1953 ( 11958 PWs) bands (ev): -48.9799 -48.9799 -48.9771 -48.9771 -25.6788 -25.6788 -25.6660 -25.6660 -25.0705 -25.0705 -25.0584 -25.0584 -24.9571 -24.9571 -24.9390 -24.9390 -7.6715 -7.6715 -7.5687 -7.5687 -5.1567 -5.1567 -3.5846 -3.5846 -2.3127 -2.3127 -2.2317 -2.2317 1.7007 1.7007 1.8167 1.8167 2.0779 2.0779 3.0906 3.0906 4.1309 4.1309 4.4324 4.4324 4.5220 4.5220 5.3390 5.3390 5.8050 5.8050 6.2459 6.2459 6.6184 6.6184 7.2334 7.2334 7.6284 7.6284 7.9719 7.9719 8.0884 8.0884 8.3611 8.3611 8.5159 8.5159 9.1478 9.1478 10.0614 10.0614 10.5225 10.5225 10.5846 10.5846 10.6301 10.6301 k = 0.0638-0.0000 0.1953 ( 11958 PWs) bands (ev): -48.9798 -48.9798 -48.9771 -48.9771 -25.6791 -25.6791 -25.6664 -25.6664 -25.0710 -25.0710 -25.0589 -25.0589 -24.9571 -24.9571 -24.9391 -24.9391 -7.6661 -7.6661 -7.5626 -7.5626 -5.1503 -5.1503 -3.5812 -3.5812 -2.3094 -2.3094 -2.2270 -2.2270 1.7075 1.7075 1.8174 1.8174 2.0890 2.0890 3.1002 3.1002 4.1198 4.1198 4.4238 4.4238 4.4895 4.4895 5.3304 5.3304 5.7510 5.7510 6.2580 6.2580 6.6247 6.6247 7.1867 7.1867 7.5821 7.5821 7.9881 7.9881 8.0417 8.0417 8.3579 8.3579 8.5426 8.5426 9.1852 9.1852 10.0604 10.0604 10.5066 10.5066 10.5634 10.5634 10.6315 10.6315 k = 0.0745-0.0000 0.1953 ( 11972 PWs) bands (ev): -48.9797 -48.9797 -48.9770 -48.9770 -25.6795 -25.6795 -25.6668 -25.6668 -25.0716 -25.0716 -25.0595 -25.0595 -24.9571 -24.9571 -24.9392 -24.9392 -7.6598 -7.6598 -7.5555 -7.5555 -5.1427 -5.1427 -3.5773 -3.5773 -2.3055 -2.3055 -2.2215 -2.2215 1.7155 1.7155 1.8181 1.8181 2.1022 2.1022 3.1116 3.1116 4.1060 4.1060 4.4137 4.4137 4.4526 4.4526 5.3203 5.3203 5.6917 5.6917 6.2703 6.2703 6.6314 6.6314 7.1334 7.1334 7.5335 7.5335 7.9761 7.9761 8.0186 8.0186 8.3509 8.3509 8.5721 8.5721 9.2246 9.2246 10.0586 10.0586 10.4912 10.4912 10.5397 10.5397 10.6342 10.6342 k = 0.0851-0.0000 0.1953 ( 11968 PWs) bands (ev): -48.9795 -48.9795 -48.9769 -48.9769 -25.6799 -25.6799 -25.6672 -25.6672 -25.0724 -25.0724 -25.0601 -25.0601 -24.9572 -24.9572 -24.9393 -24.9393 -7.6525 -7.6525 -7.5474 -7.5474 -5.1339 -5.1339 -3.5729 -3.5729 -2.3010 -2.3010 -2.2152 -2.2152 1.7246 1.7246 1.8187 1.8187 2.1175 2.1175 3.1245 3.1245 4.0893 4.0893 4.3972 4.3972 4.4170 4.4170 5.3086 5.3086 5.6284 5.6284 6.2819 6.2819 6.6382 6.6382 7.0743 7.0743 7.4829 7.4829 7.9281 7.9281 8.0270 8.0270 8.3407 8.3407 8.6037 8.6037 9.2650 9.2650 10.0559 10.0559 10.4772 10.4772 10.5144 10.5144 10.6376 10.6376 k = 0.0957-0.0000 0.1953 ( 11960 PWs) bands (ev): -48.9794 -48.9794 -48.9768 -48.9768 -25.6804 -25.6804 -25.6678 -25.6678 -25.0732 -25.0732 -25.0609 -25.0609 -24.9572 -24.9572 -24.9394 -24.9394 -7.6444 -7.6444 -7.5383 -7.5383 -5.1239 -5.1239 -3.5681 -3.5681 -2.2960 -2.2960 -2.2082 -2.2082 1.7349 1.7349 1.8192 1.8192 2.1349 2.1349 3.1390 3.1390 4.0696 4.0696 4.3576 4.3576 4.3997 4.3997 5.2955 5.2955 5.5623 5.5623 6.2920 6.2920 6.6452 6.6452 7.0104 7.0104 7.4311 7.4311 7.8752 7.8752 8.0354 8.0354 8.3279 8.3279 8.6370 8.6370 9.3055 9.3055 10.0521 10.0521 10.4652 10.4652 10.4886 10.4886 10.6414 10.6414 k = 0.1064-0.0000 0.1953 ( 11960 PWs) bands (ev): -48.9793 -48.9793 -48.9766 -48.9766 -25.6810 -25.6810 -25.6683 -25.6683 -25.0741 -25.0741 -25.0618 -25.0618 -24.9572 -24.9572 -24.9396 -24.9396 -7.6353 -7.6353 -7.5283 -7.5283 -5.1128 -5.1128 -3.5629 -3.5629 -2.2905 -2.2905 -2.2004 -2.2004 1.7462 1.7462 1.8197 1.8197 2.1544 2.1544 3.1549 3.1549 4.0468 4.0468 4.3076 4.3076 4.3884 4.3884 5.2809 5.2809 5.4947 5.4947 6.2999 6.2999 6.6522 6.6522 6.9424 6.9424 7.3783 7.3783 7.8207 7.8207 8.0399 8.0399 8.3128 8.3128 8.6717 8.6717 9.3455 9.3455 10.0474 10.0474 10.4541 10.4541 10.4645 10.4645 10.6457 10.6457 k = 0.1170-0.0000 0.1953 ( 11968 PWs) bands (ev): -48.9791 -48.9791 -48.9765 -48.9765 -25.6816 -25.6816 -25.6690 -25.6690 -25.0750 -25.0750 -25.0627 -25.0627 -24.9572 -24.9572 -24.9397 -24.9397 -7.6255 -7.6255 -7.5174 -7.5174 -5.1004 -5.1004 -3.5574 -3.5574 -2.2844 -2.2844 -2.1920 -2.1920 1.7587 1.7587 1.8200 1.8200 2.1759 2.1759 3.1721 3.1721 4.0209 4.0209 4.2531 4.2531 4.3777 4.3777 5.2649 5.2649 5.4267 5.4267 6.3049 6.3049 6.6592 6.6592 6.8713 6.8713 7.3253 7.3253 7.7652 7.7652 8.0397 8.0397 8.2961 8.2961 8.7075 8.7075 9.3844 9.3844 10.0418 10.0418 10.4332 10.4332 10.4538 10.4538 10.6501 10.6501 k = 0.1277-0.0000 0.1953 ( 11960 PWs) bands (ev): -48.9789 -48.9789 -48.9764 -48.9764 -25.6822 -25.6822 -25.6697 -25.6697 -25.0761 -25.0761 -25.0637 -25.0637 -24.9572 -24.9572 -24.9398 -24.9398 -7.6148 -7.6148 -7.5057 -7.5057 -5.0869 -5.0869 -3.5516 -3.5516 -2.2778 -2.2778 -2.1829 -2.1829 1.7721 1.7721 1.8202 1.8202 2.1994 2.1994 3.1905 3.1905 3.9921 3.9921 4.1950 4.1950 4.3670 4.3670 5.2474 5.2474 5.3594 5.3594 6.3063 6.3063 6.6654 6.6654 6.7980 6.7980 7.2729 7.2729 7.7087 7.7087 8.0342 8.0342 8.2781 8.2781 8.7441 8.7441 9.4220 9.4220 10.0358 10.0358 10.4080 10.4080 10.4515 10.4515 10.6547 10.6547 k = 0.1383-0.0000 0.1953 ( 11962 PWs) bands (ev): -48.9787 -48.9787 -48.9762 -48.9762 -25.6829 -25.6829 -25.6704 -25.6704 -25.0772 -25.0772 -25.0648 -25.0648 -24.9572 -24.9572 -24.9400 -24.9400 -7.6033 -7.6033 -7.4932 -7.4932 -5.0722 -5.0722 -3.5457 -3.5457 -2.2707 -2.2707 -2.1731 -2.1731 1.7865 1.7865 1.8203 1.8203 2.2248 2.2248 3.2099 3.2099 3.9607 3.9607 4.1336 4.1336 4.3560 4.3560 5.2275 5.2275 5.2946 5.2946 6.3036 6.3036 6.6691 6.6691 6.7248 6.7248 7.2218 7.2218 7.6512 7.6512 8.0230 8.0230 8.2592 8.2592 8.7815 8.7815 9.4580 9.4580 10.0296 10.0296 10.3833 10.3833 10.4533 10.4533 10.6594 10.6594 k = 0.1489-0.0000 0.1953 ( 11952 PWs) bands (ev): -48.9785 -48.9785 -48.9761 -48.9761 -25.6837 -25.6837 -25.6712 -25.6712 -25.0784 -25.0784 -25.0660 -25.0660 -24.9572 -24.9572 -24.9401 -24.9401 -7.5911 -7.5911 -7.4800 -7.4800 -5.0562 -5.0562 -3.5397 -3.5397 -2.2632 -2.2632 -2.1628 -2.1628 1.8019 1.8019 1.8203 1.8203 2.2519 2.2519 3.2298 3.2298 3.9270 3.9270 4.0694 4.0694 4.3445 4.3445 5.2000 5.2000 5.2383 5.2383 6.2966 6.2966 6.6394 6.6394 6.6821 6.6821 7.1733 7.1733 7.5926 7.5926 8.0060 8.0060 8.2399 8.2399 8.8195 8.8195 9.4923 9.4923 10.0237 10.0237 10.3596 10.3596 10.4589 10.4589 10.6639 10.6639 k = 0.1596-0.0000 0.1953 ( 11956 PWs) bands (ev): -48.9783 -48.9783 -48.9759 -48.9759 -25.6844 -25.6844 -25.6721 -25.6721 -25.0796 -25.0796 -25.0672 -25.0672 -24.9572 -24.9572 -24.9403 -24.9403 -7.5782 -7.5782 -7.4662 -7.4662 -5.0391 -5.0391 -3.5338 -3.5338 -2.2552 -2.2552 -2.1520 -2.1520 1.8181 1.8181 1.8205 1.8205 2.2807 2.2807 3.2499 3.2499 3.8918 3.8918 4.0027 4.0027 4.3323 4.3323 5.1520 5.1520 5.2040 5.2040 6.2851 6.2851 6.5662 6.5662 6.6794 6.6794 7.1288 7.1288 7.5329 7.5329 7.9832 7.9832 8.2205 8.2205 8.8581 8.8581 9.5248 9.5248 10.0184 10.0184 10.3374 10.3374 10.4679 10.4679 10.6684 10.6684 k = 0.1702-0.0000 0.1953 ( 11954 PWs) bands (ev): -48.9781 -48.9781 -48.9757 -48.9757 -25.6852 -25.6852 -25.6730 -25.6730 -25.0809 -25.0809 -25.0685 -25.0685 -24.9571 -24.9571 -24.9404 -24.9404 -7.5646 -7.5646 -7.4517 -7.4517 -5.0208 -5.0208 -3.5280 -3.5280 -2.2468 -2.2468 -2.1407 -2.1407 1.8204 1.8204 1.8352 1.8352 2.3110 2.3110 3.2696 3.2696 3.8557 3.8557 3.9340 3.9340 4.3193 4.3193 5.0949 5.0949 5.1808 5.1808 6.2689 6.2689 6.4908 6.4908 6.6744 6.6744 7.0902 7.0902 7.4720 7.4720 7.9548 7.9548 8.2014 8.2014 8.8974 8.8974 9.5554 9.5554 10.0140 10.0140 10.3167 10.3167 10.4803 10.4803 10.6726 10.6726 k = 0.1809-0.0000 0.1953 ( 11952 PWs) bands (ev): -48.9779 -48.9779 -48.9755 -48.9755 -25.6861 -25.6861 -25.6740 -25.6740 -25.0822 -25.0822 -25.0699 -25.0699 -24.9570 -24.9570 -24.9406 -24.9406 -7.5505 -7.5505 -7.4368 -7.4368 -5.0012 -5.0012 -3.5224 -3.5224 -2.2379 -2.2379 -2.1289 -2.1289 1.8205 1.8205 1.8530 1.8530 2.3427 2.3427 3.2878 3.2878 3.8199 3.8199 3.8638 3.8638 4.3054 4.3054 5.0385 5.0385 5.1594 5.1594 6.2482 6.2482 6.4160 6.4160 6.6628 6.6628 7.0593 7.0593 7.4099 7.4099 7.9208 7.9208 8.1827 8.1827 8.9373 8.9373 9.5842 9.5842 10.0107 10.0107 10.2978 10.2978 10.4957 10.4957 10.6766 10.6766 k = 0.1915-0.0000 0.1953 ( 11950 PWs) bands (ev): -48.9776 -48.9776 -48.9754 -48.9754 -25.6870 -25.6870 -25.6750 -25.6750 -25.0836 -25.0836 -25.0713 -25.0713 -24.9569 -24.9569 -24.9407 -24.9407 -7.5357 -7.5357 -7.4214 -7.4214 -4.9805 -4.9805 -3.5172 -3.5172 -2.2287 -2.2287 -2.1168 -2.1168 1.8207 1.8207 1.8715 1.8715 2.3755 2.3755 3.3031 3.3031 3.7835 3.7835 3.7950 3.7950 4.2903 4.2903 4.9848 4.9848 5.1379 5.1379 6.2230 6.2230 6.3430 6.3430 6.6428 6.6428 7.0374 7.0374 7.3468 7.3468 7.8818 7.8818 8.1647 8.1647 8.9779 8.9779 9.6112 9.6112 10.0084 10.0084 10.2808 10.2808 10.5140 10.5140 10.6803 10.6803 k = 0.2021-0.0000 0.1953 ( 11938 PWs) bands (ev): -48.9774 -48.9774 -48.9752 -48.9752 -25.6879 -25.6879 -25.6761 -25.6761 -25.0849 -25.0849 -25.0728 -25.0728 -24.9567 -24.9567 -24.9409 -24.9409 -7.5205 -7.5205 -7.4057 -7.4057 -4.9586 -4.9586 -3.5124 -3.5124 -2.2190 -2.2190 -2.1044 -2.1044 1.8211 1.8211 1.8906 1.8906 2.4093 2.4093 3.3136 3.3136 3.7185 3.7185 3.7585 3.7585 4.2739 4.2739 4.9341 4.9341 5.1161 5.1161 6.1936 6.1936 6.2724 6.2724 6.6142 6.6142 7.0246 7.0246 7.2827 7.2827 7.8383 7.8383 8.1474 8.1474 9.0190 9.0190 9.6365 9.6365 10.0072 10.0072 10.2657 10.2657 10.5351 10.5351 10.6836 10.6836 k = 0.2128-0.0000 0.1953 ( 11940 PWs) bands (ev): -48.9772 -48.9772 -48.9750 -48.9750 -25.6888 -25.6888 -25.6771 -25.6771 -25.0863 -25.0863 -25.0743 -25.0743 -24.9565 -24.9565 -24.9410 -24.9410 -7.5048 -7.5048 -7.3896 -7.3896 -4.9354 -4.9354 -3.5083 -3.5083 -2.2090 -2.2090 -2.0917 -2.0917 1.8217 1.8217 1.9102 1.9102 2.4437 2.4437 3.3168 3.3168 3.6466 3.6466 3.7358 3.7358 4.2563 4.2563 4.8869 4.8869 5.0935 5.0935 6.1598 6.1598 6.2051 6.2051 6.5778 6.5778 7.0197 7.0197 7.2178 7.2178 7.7908 7.7908 8.1310 8.1310 9.0608 9.0608 9.6601 9.6601 10.0069 10.0069 10.2525 10.2525 10.5585 10.5586 10.6866 10.6866 k = 0.2234-0.0000 0.1953 ( 11942 PWs) bands (ev): -48.9769 -48.9769 -48.9748 -48.9748 -25.6897 -25.6897 -25.6783 -25.6783 -25.0878 -25.0878 -25.0758 -25.0758 -24.9563 -24.9563 -24.9411 -24.9411 -7.4887 -7.4887 -7.3734 -7.3734 -4.9111 -4.9111 -3.5048 -3.5048 -2.1986 -2.1986 -2.0789 -2.0789 1.8226 1.8226 1.9303 1.9303 2.4785 2.4785 3.3101 3.3101 3.5750 3.5750 3.7230 3.7230 4.2373 4.2373 4.8431 4.8431 5.0700 5.0700 6.1210 6.1210 6.1428 6.1428 6.5351 6.5351 7.0207 7.0207 7.1528 7.1528 7.7400 7.7400 8.1153 8.1153 9.1032 9.1032 9.6821 9.6821 10.0072 10.0072 10.2413 10.2413 10.5842 10.5842 10.6892 10.6892 k = 0.2340-0.0000 0.1953 ( 11940 PWs) bands (ev): -48.9766 -48.9766 -48.9746 -48.9746 -25.6907 -25.6907 -25.6794 -25.6794 -25.0892 -25.0892 -25.0774 -25.0774 -24.9561 -24.9561 -24.9413 -24.9413 -7.4722 -7.4722 -7.3570 -7.3570 -4.8855 -4.8855 -3.5022 -3.5022 -2.1879 -2.1879 -2.0659 -2.0659 1.8238 1.8238 1.9507 1.9507 2.5132 2.5132 3.2923 3.2923 3.5045 3.5045 3.7217 3.7217 4.2169 4.2169 4.8029 4.8029 5.0455 5.0455 6.0728 6.0728 6.0905 6.0905 6.4878 6.4878 7.0242 7.0242 7.0890 7.0890 7.6867 7.6867 8.1002 8.1002 9.1461 9.1461 9.7026 9.7026 10.0081 10.0081 10.2318 10.2318 10.6115 10.6115 10.6916 10.6916 k = 0.2447-0.0000 0.1953 ( 11944 PWs) bands (ev): -48.9764 -48.9764 -48.9744 -48.9744 -25.6916 -25.6916 -25.6806 -25.6806 -25.0906 -25.0906 -25.0790 -25.0790 -24.9558 -24.9558 -24.9414 -24.9414 -7.4554 -7.4554 -7.3407 -7.3407 -4.8588 -4.8588 -3.5007 -3.5007 -2.1769 -2.1769 -2.0529 -2.0529 1.8254 1.8254 1.9714 1.9714 2.5474 2.5474 3.2636 3.2636 3.4360 3.4360 3.7315 3.7315 4.1950 4.1950 4.7662 4.7662 5.0199 5.0199 6.0192 6.0192 6.0452 6.0452 6.4374 6.4374 7.0088 7.0088 7.0464 7.0464 7.6318 7.6318 8.0857 8.0857 9.1895 9.1895 9.7219 9.7219 10.0092 10.0092 10.2241 10.2241 10.6399 10.6399 10.6937 10.6937 k = 0.2553-0.0000 0.1953 ( 11954 PWs) bands (ev): -48.9761 -48.9761 -48.9742 -48.9742 -25.6926 -25.6926 -25.6818 -25.6818 -25.0920 -25.0920 -25.0806 -25.0806 -24.9556 -24.9556 -24.9416 -24.9416 -7.4384 -7.4384 -7.3243 -7.3243 -4.8309 -4.8309 -3.5002 -3.5002 -2.1656 -2.1656 -2.0400 -2.0400 1.8275 1.8275 1.9922 1.9922 2.5804 2.5804 3.2261 3.2261 3.3704 3.3704 3.7510 3.7510 4.1716 4.1716 4.7331 4.7331 4.9931 4.9931 5.9679 5.9679 5.9994 5.9994 6.3846 6.3846 6.9496 6.9496 7.0485 7.0485 7.5764 7.5764 8.0716 8.0716 9.2333 9.2333 9.7399 9.7399 10.0103 10.0103 10.2180 10.2180 10.6681 10.6681 10.6959 10.6959 k = 0.2660-0.0000 0.1953 ( 11958 PWs) bands (ev): -48.9759 -48.9759 -48.9740 -48.9740 -25.6936 -25.6936 -25.6831 -25.6831 -25.0934 -25.0934 -25.0822 -25.0822 -24.9553 -24.9553 -24.9417 -24.9417 -7.4213 -7.4213 -7.3082 -7.3082 -4.8019 -4.8019 -3.5010 -3.5010 -2.1540 -2.1540 -2.0271 -2.0271 1.8301 1.8301 2.0131 2.0131 2.6114 2.6114 3.1819 3.1819 3.3087 3.3087 3.7780 3.7780 4.1467 4.1467 4.7034 4.7034 4.9654 4.9654 5.9207 5.9207 5.9521 5.9521 6.3303 6.3303 6.8856 6.8856 7.0551 7.0551 7.5221 7.5221 8.0578 8.0578 9.2776 9.2776 9.7569 9.7569 10.0114 10.0114 10.2132 10.2132 10.6926 10.6926 10.7005 10.7005 k = 0.2766-0.0000 0.1953 ( 11972 PWs) bands (ev): -48.9756 -48.9756 -48.9738 -48.9738 -25.6945 -25.6945 -25.6843 -25.6843 -25.0948 -25.0948 -25.0838 -25.0838 -24.9549 -24.9549 -24.9418 -24.9418 -7.4040 -7.4040 -7.2922 -7.2922 -4.7717 -4.7717 -3.5031 -3.5031 -2.1421 -2.1421 -2.0144 -2.0144 1.8333 1.8333 2.0338 2.0338 2.6393 2.6393 3.1331 3.1331 3.2522 3.2522 3.8109 3.8109 4.1201 4.1201 4.6772 4.6772 4.9370 4.9370 5.8774 5.8774 5.9034 5.9034 6.2749 6.2749 6.8218 6.8218 7.0594 7.0594 7.4706 7.4706 8.0440 8.0440 9.3220 9.3220 9.7731 9.7731 10.0122 10.0122 10.2095 10.2095 10.6984 10.6984 10.7204 10.7204 k = 0.2872-0.0000 0.1953 ( 11972 PWs) bands (ev): -48.9753 -48.9753 -48.9736 -48.9736 -25.6955 -25.6955 -25.6856 -25.6856 -25.0961 -25.0961 -25.0854 -25.0854 -24.9546 -24.9546 -24.9419 -24.9419 -7.3868 -7.3868 -7.2766 -7.2766 -4.7403 -4.7403 -3.5068 -3.5068 -2.1299 -2.1299 -2.0020 -2.0020 1.8370 1.8370 2.0543 2.0543 2.6625 2.6625 3.0812 3.0812 3.2026 3.2026 3.8484 3.8484 4.0920 4.0920 4.6545 4.6545 4.9083 4.9083 5.8380 5.8380 5.8539 5.8539 6.2186 6.2186 6.7594 6.7594 7.0583 7.0583 7.4247 7.4247 8.0301 8.0301 9.3667 9.3667 9.7887 9.7887 10.0126 10.0126 10.2067 10.2067 10.7008 10.7008 10.7388 10.7388 k = 0.2979-0.0000 0.1953 ( 11978 PWs) bands (ev): -48.9751 -48.9751 -48.9734 -48.9734 -25.6964 -25.6964 -25.6869 -25.6869 -25.0974 -25.0974 -25.0870 -25.0870 -24.9542 -24.9542 -24.9421 -24.9421 -7.3695 -7.3695 -7.2613 -7.2613 -4.7079 -4.7079 -3.5121 -3.5121 -2.1176 -2.1176 -1.9899 -1.9899 1.8414 1.8414 2.0744 2.0744 2.6792 2.6792 3.0276 3.0276 3.1618 3.1618 3.8894 3.8894 4.0621 4.0621 4.6352 4.6352 4.8799 4.8799 5.8002 5.8002 5.8052 5.8052 6.1618 6.1618 6.6987 6.6987 7.0487 7.0487 7.3876 7.3876 8.0159 8.0159 9.4115 9.4115 9.8038 9.8038 10.0127 10.0127 10.2044 10.2044 10.7032 10.7032 10.7511 10.7511 k = 0.3085-0.0000 0.1953 ( 11976 PWs) bands (ev): -48.9748 -48.9748 -48.9733 -48.9733 -25.6973 -25.6973 -25.6881 -25.6881 -25.0986 -25.0986 -25.0886 -25.0886 -24.9538 -24.9538 -24.9422 -24.9422 -7.3523 -7.3523 -7.2466 -7.2466 -4.6745 -4.6745 -3.5191 -3.5191 -2.1050 -2.1050 -1.9782 -1.9782 1.8465 1.8465 2.0940 2.0940 2.6874 2.6874 2.9730 2.9730 3.1319 3.1319 3.9333 3.9333 4.0305 4.0305 4.6194 4.6194 4.8522 4.8522 5.7518 5.7518 5.7696 5.7696 6.1045 6.1045 6.6403 6.6403 7.0280 7.0280 7.3618 7.3618 8.0013 8.0013 9.4562 9.4562 9.8188 9.8188 10.0125 10.0125 10.2024 10.2024 10.7060 10.7060 10.7578 10.7578 k = 0.3191-0.0000 0.1953 ( 11982 PWs) bands (ev): -48.9746 -48.9746 -48.9731 -48.9731 -25.6982 -25.6982 -25.6894 -25.6894 -25.0998 -25.0998 -25.0902 -25.0902 -24.9534 -24.9534 -24.9424 -24.9424 -7.3353 -7.3353 -7.2324 -7.2324 -4.6400 -4.6400 -3.5280 -3.5280 -2.0923 -2.0923 -1.9670 -1.9670 1.8523 1.8523 2.1128 2.1128 2.6857 2.6857 2.9184 2.9184 3.1141 3.1141 3.9791 3.9791 3.9979 3.9979 4.6069 4.6069 4.8260 4.8260 5.7011 5.7011 5.7383 5.7383 6.0468 6.0468 6.5848 6.5848 6.9958 6.9958 7.3483 7.3483 7.9860 7.9860 9.5008 9.5008 9.8338 9.8338 10.0119 10.0119 10.2003 10.2003 10.7091 10.7091 10.7605 10.7605 k = 0.3298-0.0000 0.1953 ( 11984 PWs) bands (ev): -48.9743 -48.9743 -48.9729 -48.9729 -25.6991 -25.6991 -25.6906 -25.6906 -25.1009 -25.1009 -25.0917 -25.0917 -24.9530 -24.9530 -24.9425 -24.9425 -7.3186 -7.3186 -7.2189 -7.2189 -4.6045 -4.6045 -3.5387 -3.5387 -2.0795 -2.0795 -1.9563 -1.9563 1.8588 1.8588 2.1307 2.1307 2.6744 2.6744 2.8642 2.8642 3.1084 3.1084 3.9620 3.9620 4.0287 4.0287 4.5978 4.5978 4.8016 4.8016 5.6506 5.6506 5.7085 5.7085 5.9890 5.9890 6.5325 6.5325 6.9538 6.9538 7.3452 7.3452 7.9701 7.9701 9.5452 9.5452 9.8490 9.8490 10.0112 10.0112 10.1977 10.1977 10.7126 10.7126 10.7604 10.7604 k = 0.3404-0.0000 0.1953 ( 11990 PWs) bands (ev): -48.9741 -48.9741 -48.9728 -48.9728 -25.6999 -25.6999 -25.6918 -25.6918 -25.1020 -25.1020 -25.0932 -25.0932 -24.9526 -24.9526 -24.9426 -24.9426 -7.3021 -7.3021 -7.2061 -7.2061 -4.5681 -4.5681 -3.5514 -3.5514 -2.0666 -2.0666 -1.9463 -1.9463 1.8661 1.8661 2.1475 2.1475 2.6553 2.6553 2.8111 2.8111 3.1129 3.1129 3.9259 3.9259 4.0789 4.0789 4.5921 4.5921 4.7797 4.7797 5.6006 5.6006 5.6794 5.6794 5.9310 5.9310 6.4838 6.4838 6.9053 6.9053 7.3499 7.3499 7.9534 7.9534 9.5892 9.5892 9.8647 9.8647 10.0103 10.0103 10.1946 10.1946 10.7163 10.7163 10.7586 10.7586 k = 0.3511-0.0000 0.1953 ( 11996 PWs) bands (ev): -48.9739 -48.9739 -48.9726 -48.9726 -25.7006 -25.7006 -25.6930 -25.6930 -25.1030 -25.1030 -25.0946 -25.0946 -24.9522 -24.9522 -24.9428 -24.9428 -7.2861 -7.2861 -7.1941 -7.1941 -4.5308 -4.5308 -3.5661 -3.5661 -2.0537 -2.0537 -1.9370 -1.9370 1.8741 1.8741 2.1628 2.1628 2.6310 2.6310 2.7594 2.7594 3.1250 3.1250 3.8885 3.8885 4.1309 4.1309 4.5897 4.5897 4.7605 4.7605 5.5514 5.5514 5.6504 5.6504 5.8729 5.8729 6.4393 6.4393 6.8530 6.8530 7.3598 7.3598 7.9359 7.9359 9.6327 9.6327 9.8809 9.8809 10.0094 10.0094 10.1905 10.1905 10.7199 10.7199 10.7555 10.7555 k = 0.3617-0.0000 0.1953 ( 11984 PWs) bands (ev): -48.9737 -48.9737 -48.9725 -48.9725 -25.7013 -25.7013 -25.6942 -25.6942 -25.1039 -25.1039 -25.0960 -25.0960 -24.9517 -24.9517 -24.9430 -24.9430 -7.2704 -7.2704 -7.1829 -7.1829 -4.4928 -4.4928 -3.5829 -3.5829 -2.0408 -2.0408 -1.9285 -1.9285 1.8829 1.8829 2.1763 2.1763 2.6042 2.6042 2.7098 2.7098 3.1420 3.1420 3.8502 3.8502 4.1844 4.1844 4.5904 4.5904 4.7442 4.7442 5.5033 5.5033 5.6209 5.6209 5.8149 5.8149 6.3992 6.3992 6.7990 6.7990 7.3731 7.3731 7.9176 7.9176 9.6755 9.6755 9.8978 9.8978 10.0087 10.0087 10.1854 10.1854 10.7228 10.7228 10.7514 10.7514 k = 0.3723-0.0000 0.1953 ( 11988 PWs) bands (ev): -48.9734 -48.9734 -48.9724 -48.9724 -25.7020 -25.7020 -25.6954 -25.6954 -25.1047 -25.1047 -25.0974 -25.0974 -24.9513 -24.9513 -24.9432 -24.9432 -7.2553 -7.2553 -7.1726 -7.1726 -4.4540 -4.4540 -3.6017 -3.6017 -2.0280 -2.0280 -1.9208 -1.9208 1.8924 1.8924 2.1878 2.1878 2.5768 2.5768 2.6626 2.6626 3.1619 3.1619 3.8113 3.8113 4.2392 4.2392 4.5943 4.5943 4.7310 4.7310 5.4565 5.4565 5.5905 5.5905 5.7570 5.7570 6.3637 6.3637 6.7447 6.7447 7.3887 7.3887 7.8984 7.8984 9.7175 9.7175 9.9153 9.9153 10.0084 10.0084 10.1793 10.1793 10.7246 10.7246 10.7465 10.7465 k = 0.3830-0.0000 0.1953 ( 11988 PWs) bands (ev): -48.9732 -48.9732 -48.9722 -48.9722 -25.7026 -25.7026 -25.6964 -25.6964 -25.1055 -25.1055 -25.0987 -25.0987 -24.9509 -24.9509 -24.9433 -24.9433 -7.2407 -7.2407 -7.1634 -7.1634 -4.4145 -4.4145 -3.6225 -3.6225 -2.0154 -2.0154 -1.9140 -1.9140 1.9027 1.9027 2.1967 2.1967 2.5503 2.5503 2.6186 2.6186 3.1833 3.1833 3.7723 3.7723 4.2950 4.2950 4.6010 4.6010 4.7209 4.7209 5.4111 5.4111 5.5592 5.5592 5.6993 5.6993 6.3330 6.3330 6.6912 6.6912 7.4059 7.4059 7.8784 7.8784 9.7584 9.7584 9.9334 9.9334 10.0086 10.0086 10.1720 10.1720 10.7246 10.7246 10.7409 10.7409 k = 0.3936-0.0000 0.1953 ( 12000 PWs) bands (ev): -48.9731 -48.9731 -48.9721 -48.9721 -25.7031 -25.7031 -25.6975 -25.6975 -25.1062 -25.1062 -25.0999 -25.0999 -24.9504 -24.9504 -24.9435 -24.9435 -7.2268 -7.2268 -7.1551 -7.1551 -4.3745 -4.3745 -3.6454 -3.6454 -2.0029 -2.0029 -1.9082 -1.9082 1.9138 1.9138 2.2026 2.2026 2.5256 2.5256 2.5781 2.5781 3.2053 3.2053 3.7335 3.7335 4.3519 4.3519 4.6104 4.6104 4.7138 4.7138 5.3674 5.3674 5.5267 5.5267 5.6421 5.6421 6.3071 6.3071 6.6392 6.6392 7.4241 7.4241 7.8577 7.8577 9.7980 9.7980 9.9520 9.9520 10.0096 10.0096 10.1636 10.1636 10.7221 10.7221 10.7346 10.7346 k = 0.4043-0.0000 0.1953 ( 11994 PWs) bands (ev): -48.9729 -48.9729 -48.9721 -48.9721 -25.7036 -25.7036 -25.6985 -25.6985 -25.1067 -25.1067 -25.1010 -25.1010 -24.9500 -24.9500 -24.9438 -24.9438 -7.2136 -7.2136 -7.1479 -7.1479 -4.3341 -4.3341 -3.6703 -3.6703 -1.9908 -1.9908 -1.9034 -1.9034 1.9256 1.9256 2.2049 2.2049 2.5032 2.5032 2.5420 2.5420 3.2273 3.2273 3.6953 3.6953 4.4096 4.4096 4.6221 4.6221 4.7096 4.7096 5.3253 5.3253 5.4933 5.4933 5.5856 5.5856 6.2859 6.2859 6.5894 6.5894 7.4431 7.4431 7.8363 7.8363 9.8361 9.8361 9.9707 9.9707 10.0116 10.0116 10.1543 10.1543 10.7170 10.7170 10.7276 10.7276 k = 0.4149-0.0000 0.1953 ( 11992 PWs) bands (ev): -48.9727 -48.9727 -48.9720 -48.9720 -25.7040 -25.7040 -25.6994 -25.6994 -25.1072 -25.1072 -25.1021 -25.1021 -24.9495 -24.9495 -24.9440 -24.9440 -7.2012 -7.2012 -7.1419 -7.1419 -4.2932 -4.2932 -3.6971 -3.6971 -1.9791 -1.9791 -1.8995 -1.8995 1.9383 1.9383 2.2031 2.2031 2.4835 2.4835 2.5107 2.5107 3.2490 3.2490 3.6580 3.6580 4.4679 4.4679 4.6356 4.6356 4.7079 4.7079 5.2850 5.2850 5.4592 5.4592 5.5304 5.5304 6.2693 6.2693 6.5421 6.5421 7.4627 7.4627 7.8144 7.8144 9.8723 9.8723 9.9889 9.9889 10.0149 10.0149 10.1441 10.1441 10.7099 10.7099 10.7194 10.7194 k = 0.4255-0.0000 0.1953 ( 11986 PWs) bands (ev): -48.9726 -48.9726 -48.9719 -48.9719 -25.7043 -25.7043 -25.7003 -25.7003 -25.1076 -25.1076 -25.1031 -25.1031 -24.9491 -24.9491 -24.9442 -24.9442 -7.1895 -7.1895 -7.1369 -7.1369 -4.2522 -4.2522 -3.7257 -3.7257 -1.9679 -1.9679 -1.8968 -1.8968 1.9518 1.9518 2.1968 2.1968 2.4666 2.4666 2.4848 2.4848 3.2702 3.2702 3.6220 3.6220 4.5265 4.5265 4.6506 4.6506 4.7086 4.7086 5.2462 5.2462 5.4247 5.4247 5.4771 5.4771 6.2572 6.2572 6.4977 6.4977 7.4828 7.4828 7.7921 7.7921 9.9062 9.9062 10.0054 10.0054 10.0208 10.0208 10.1332 10.1332 10.7013 10.7013 10.7101 10.7101 k = 0.4362-0.0000 0.1953 ( 11992 PWs) bands (ev): -48.9724 -48.9724 -48.9719 -48.9719 -25.7046 -25.7046 -25.7011 -25.7011 -25.1079 -25.1079 -25.1040 -25.1040 -24.9487 -24.9487 -24.9445 -24.9445 -7.1788 -7.1788 -7.1331 -7.1331 -4.2110 -4.2110 -3.7560 -3.7560 -1.9571 -1.9571 -1.8952 -1.8952 1.9661 1.9661 2.1862 2.1862 2.4526 2.4526 2.4642 2.4642 3.2909 3.2909 3.5875 3.5875 4.5849 4.5849 4.6664 4.6664 4.7115 4.7115 5.2085 5.2085 5.3901 5.3901 5.4271 5.4271 6.2493 6.2493 6.4565 6.4565 7.5033 7.5033 7.7694 7.7694 9.9372 9.9372 10.0175 10.0175 10.0316 10.0316 10.1218 10.1218 10.6919 10.6919 10.6999 10.6999 k = 0.4468-0.0000 0.1953 ( 11996 PWs) bands (ev): -48.9723 -48.9723 -48.9718 -48.9718 -25.7048 -25.7048 -25.7018 -25.7018 -25.1081 -25.1081 -25.1049 -25.1049 -24.9482 -24.9482 -24.9447 -24.9447 -7.1690 -7.1690 -7.1305 -7.1305 -4.1698 -4.1698 -3.7880 -3.7880 -1.9470 -1.9470 -1.8946 -1.8946 1.9814 1.9814 2.1716 2.1716 2.4414 2.4414 2.4486 2.4486 3.3114 3.3114 3.5548 3.5548 4.6414 4.6414 4.6830 4.6830 4.7169 4.7169 5.1711 5.1711 5.3557 5.3557 5.3825 5.3825 6.2456 6.2456 6.4187 6.4187 7.5241 7.5241 7.7466 7.7466 9.9647 9.9647 10.0265 10.0265 10.0454 10.0454 10.1101 10.1101 10.6824 10.6824 10.6895 10.6895 k = 0.4574-0.0000 0.1953 ( 11988 PWs) bands (ev): -48.9722 -48.9722 -48.9718 -48.9718 -25.7048 -25.7048 -25.7025 -25.7025 -25.1082 -25.1082 -25.1056 -25.1056 -24.9478 -24.9478 -24.9450 -24.9450 -7.1602 -7.1602 -7.1291 -7.1291 -4.1287 -4.1287 -3.8216 -3.8216 -1.9377 -1.9377 -1.8952 -1.8952 1.9976 1.9976 2.1540 2.1540 2.4327 2.4327 2.4373 2.4373 3.3318 3.3318 3.5238 3.5238 4.6852 4.6852 4.7034 4.7034 4.7309 4.7309 5.1325 5.1325 5.3226 5.3226 5.3451 5.3451 6.2458 6.2458 6.3844 6.3844 7.5452 7.5452 7.7236 7.7236 9.9879 9.9879 10.0359 10.0359 10.0583 10.0583 10.0985 10.0985 10.6733 10.6733 10.6794 10.6794 k = 0.4681-0.0000 0.1953 ( 11992 PWs) bands (ev): -48.9721 -48.9721 -48.9718 -48.9718 -25.7048 -25.7048 -25.7031 -25.7031 -25.1082 -25.1082 -25.1063 -25.1063 -24.9474 -24.9474 -24.9453 -24.9453 -7.1523 -7.1523 -7.1289 -7.1289 -4.0879 -4.0879 -3.8565 -3.8565 -1.9290 -1.9290 -1.8969 -1.8969 2.0148 2.0148 2.1344 2.1344 2.4264 2.4264 2.4294 2.4294 3.3523 3.3523 3.4947 3.4947 4.7036 4.7036 4.7171 4.7171 4.7749 4.7749 5.0910 5.0910 5.2942 5.2942 5.3150 5.3150 6.2498 6.2498 6.3539 6.3539 7.5666 7.5666 7.7007 7.7007 10.0067 10.0067 10.0461 10.0461 10.0686 10.0686 10.0872 10.0872 10.6655 10.6655 10.6704 10.6704 k = 0.4787-0.0000 0.1953 ( 11998 PWs) bands (ev): -48.9720 -48.9720 -48.9718 -48.9718 -25.7048 -25.7048 -25.7036 -25.7036 -25.1081 -25.1081 -25.1068 -25.1068 -24.9470 -24.9470 -24.9456 -24.9456 -7.1456 -7.1456 -7.1299 -7.1299 -4.0475 -4.0475 -3.8927 -3.8927 -1.9212 -1.9212 -1.8997 -1.8997 2.0331 2.0331 2.1138 2.1138 2.4223 2.4223 2.4241 2.4241 3.3733 3.3733 3.4674 3.4674 4.7144 4.7144 4.7226 4.7226 4.8306 4.8306 5.0454 5.0454 5.2744 5.2744 5.2913 5.2913 6.2577 6.2577 6.3271 6.3271 7.5883 7.5883 7.6778 7.6778 10.0218 10.0218 10.0547 10.0547 10.0748 10.0748 10.0783 10.0783 10.6596 10.6596 10.6632 10.6632 k = 0.4894-0.0000 0.1953 ( 12004 PWs) bands (ev): -48.9719 -48.9719 -48.9718 -48.9718 -25.7046 -25.7046 -25.7040 -25.7040 -25.1080 -25.1080 -25.1073 -25.1073 -24.9467 -24.9467 -24.9460 -24.9460 -7.1400 -7.1400 -7.1321 -7.1321 -4.0076 -4.0076 -3.9301 -3.9301 -1.9144 -1.9144 -1.9035 -1.9035 2.0522 2.0522 2.0929 2.0929 2.4201 2.4201 2.4210 2.4210 3.3950 3.3950 3.4418 3.4418 4.7213 4.7213 4.7251 4.7251 4.8872 4.8872 4.9957 4.9957 5.2647 5.2647 5.2743 5.2743 6.2694 6.2694 6.3041 6.3041 7.6103 7.6103 7.6551 7.6551 10.0345 10.0345 10.0547 10.0547 10.0746 10.0746 10.0788 10.0788 10.6563 10.6563 10.6581 10.6581 k = 0.5000-0.0000 0.1953 ( 12004 PWs) bands (ev): -48.9719 -48.9719 -48.9719 -48.9719 -25.7043 -25.7043 -25.7043 -25.7043 -25.1077 -25.1077 -25.1077 -25.1077 -24.9463 -24.9463 -24.9463 -24.9463 -7.1354 -7.1354 -7.1354 -7.1354 -3.9684 -3.9684 -3.9684 -3.9684 -1.9084 -1.9084 -1.9084 -1.9084 2.0723 2.0723 2.0723 2.0723 2.4197 2.4197 2.4197 2.4197 3.4177 3.4177 3.4177 3.4177 4.7248 4.7248 4.7248 4.7248 4.9427 4.9427 4.9427 4.9427 5.2650 5.2650 5.2650 5.2650 6.2848 6.2848 6.2848 6.2848 7.6326 7.6326 7.6326 7.6326 10.0458 10.0458 10.0458 10.0458 10.0777 10.0777 10.0777 10.0777 10.6558 10.6558 10.6558 10.6558 Writing output data file TiS3.save init_run : 0.60s CPU 0.71s WALL ( 1 calls) electrons : 659.92s CPU 667.10s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 659.92s CPU 667.09s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.00s WALL ( 1 calls) newd : 0.11s CPU 0.13s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.12s CPU 0.27s WALL ( 290 calls) cegterg : 629.41s CPU 634.63s WALL ( 591 calls) Called by sum_band: Called by *egterg: h_psi : 362.43s CPU 366.54s WALL ( 10493 calls) s_psi : 40.20s CPU 40.23s WALL ( 10493 calls) g_psi : 1.65s CPU 1.61s WALL ( 9612 calls) cdiaghg : 132.76s CPU 134.23s WALL ( 9902 calls) cegterg:over : 41.42s CPU 41.66s WALL ( 9612 calls) cegterg:upda : 37.89s CPU 37.69s WALL ( 9612 calls) cegterg:last : 23.19s CPU 23.23s WALL ( 1950 calls) cdiaghg:chol : 7.72s CPU 7.87s WALL ( 9902 calls) cdiaghg:inve : 5.72s CPU 5.70s WALL ( 9902 calls) cdiaghg:para : 9.88s CPU 9.91s WALL ( 19804 calls) Called by h_psi: h_psi:vloc : 284.95s CPU 288.55s WALL ( 10493 calls) h_psi:vnl : 75.92s CPU 76.43s WALL ( 10493 calls) add_vuspsi : 41.86s CPU 42.00s WALL ( 10493 calls) General routines calbec : 33.99s CPU 34.39s WALL ( 10493 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 270.35s CPU 273.65s WALL ( 1716468 calls) davcio : 0.40s CPU 0.72s WALL ( 580 calls) Parallel routines fft_scatter : 92.56s CPU 95.48s WALL ( 1716483 calls) PWSCF : 11m37.01s CPU 12m 4.72s WALL This run was terminated on: 21:26:44 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=