Program PWSCF v.5.4.0 starts on 12Feb2017 at 2: 4:59 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 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: ./MgCuBi.save/ file Bi.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5D 5D renormalized file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 61 31 9 1911 695 107 Max 62 32 11 1915 719 111 Sum 2221 1147 337 68873 25509 3943 bravais-lattice index = 14 lattice parameter (alat) = 8.3769 a.u. unit-cell volume = 415.6534 (a.u.)^3 number of atoms/cell = 3 number of atomic types = 3 number of electrons = 36.00 number of Kohn-Sham states= 44 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 457.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.376876 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Bi read from file: /users/gautes/Pseudo/Bi.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 2a6cbf750f457e6adc9554330ec86bb0 Pseudo is Ultrasoft + core correction, Zval = 15.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1283 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 Mg read from file: /users/gautes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1129 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Bi 15.00 208.98040 Bi( 1.00) Mg 10.00 24.30500 Mg( 1.00) Cu 11.00 63.54600 Cu( 1.00) 6 Sym. Ops. (no inversion) found 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 = 2 120 deg rotation - cryst. axis [0,0,1] cryst. s( 2) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 2) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 3) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 3) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 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 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 5) = ( 0.5000000 0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s( 6) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_3v (3m) there are 6 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3s_v -3s_v G_4 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6 1.00 -1.00 -1.00 1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3s_v -3s_v G_4 0.00 0.00 0.00 0.00 0.00 0.00 G_5 0.00 0.00 0.00 0.00 1.00 -1.00 G_6 0.00 0.00 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 2C3 2 3 120 deg rotation - cryst. axis [0,0,1] -2C3 -2 -3 120 deg rotation - cryst. axis [0,0,1] E 3s_v 4 5 -6 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 6 -4 -5 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 337 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029674 k( 2) = ( 0.0098039 -0.0056603 0.0080049), wk = 0.0029674 k( 3) = ( 0.0196078 -0.0113206 0.0160097), wk = 0.0029674 k( 4) = ( 0.0294118 -0.0169809 0.0240146), wk = 0.0029674 k( 5) = ( 0.0392157 -0.0226412 0.0320195), wk = 0.0029674 k( 6) = ( 0.0490196 -0.0283015 0.0400243), wk = 0.0029674 k( 7) = ( 0.0588235 -0.0339618 0.0480292), wk = 0.0029674 k( 8) = ( 0.0686275 -0.0396221 0.0560341), wk = 0.0029674 k( 9) = ( 0.0784314 -0.0452824 0.0640389), wk = 0.0029674 k( 10) = ( 0.0882353 -0.0509427 0.0720438), wk = 0.0029674 k( 11) = ( 0.0980392 -0.0566030 0.0800487), wk = 0.0029674 k( 12) = ( 0.1078431 -0.0622633 0.0880536), wk = 0.0029674 k( 13) = ( 0.1176471 -0.0679236 0.0960584), wk = 0.0029674 k( 14) = ( 0.1274510 -0.0735839 0.1040633), wk = 0.0029674 k( 15) = ( 0.1372549 -0.0792442 0.1120682), wk = 0.0029674 k( 16) = ( 0.1470588 -0.0849044 0.1200730), wk = 0.0029674 k( 17) = ( 0.1568627 -0.0905648 0.1280779), wk = 0.0029674 k( 18) = ( 0.1666667 -0.0962250 0.1360828), wk = 0.0029674 k( 19) = ( 0.1764706 -0.1018853 0.1440876), wk = 0.0029674 k( 20) = ( 0.1862745 -0.1075456 0.1520925), wk = 0.0029674 k( 21) = ( 0.1960784 -0.1132059 0.1600974), wk = 0.0029674 k( 22) = ( 0.2058823 -0.1188662 0.1681022), wk = 0.0029674 k( 23) = ( 0.2156863 -0.1245265 0.1761071), wk = 0.0029674 k( 24) = ( 0.2254902 -0.1301868 0.1841120), wk = 0.0029674 k( 25) = ( 0.2352941 -0.1358471 0.1921168), wk = 0.0029674 k( 26) = ( 0.2450980 -0.1415074 0.2001217), wk = 0.0029674 k( 27) = ( 0.2549020 -0.1471677 0.2081266), wk = 0.0029674 k( 28) = ( 0.2647059 -0.1528280 0.2161314), wk = 0.0029674 k( 29) = ( 0.2745098 -0.1584883 0.2241363), wk = 0.0029674 k( 30) = ( 0.2843137 -0.1641486 0.2321412), wk = 0.0029674 k( 31) = ( 0.2941177 -0.1698089 0.2401461), wk = 0.0029674 k( 32) = ( 0.3039216 -0.1754692 0.2481509), wk = 0.0029674 k( 33) = ( 0.3137255 -0.1811295 0.2561558), wk = 0.0029674 k( 34) = ( 0.3235294 -0.1867898 0.2641607), wk = 0.0029674 k( 35) = ( 0.3333333 -0.1924501 0.2721655), wk = 0.0029674 k( 36) = ( 0.3431373 -0.1981104 0.2801704), wk = 0.0029674 k( 37) = ( 0.3529412 -0.2037707 0.2881753), wk = 0.0029674 k( 38) = ( 0.3627451 -0.2094310 0.2961801), wk = 0.0029674 k( 39) = ( 0.3725490 -0.2150913 0.3041850), wk = 0.0029674 k( 40) = ( 0.3823529 -0.2207516 0.3121899), wk = 0.0029674 k( 41) = ( 0.3921569 -0.2264119 0.3201947), wk = 0.0029674 k( 42) = ( 0.4019608 -0.2320722 0.3281996), wk = 0.0029674 k( 43) = ( 0.4117647 -0.2377325 0.3362045), wk = 0.0029674 k( 44) = ( 0.4215686 -0.2433928 0.3442093), wk = 0.0029674 k( 45) = ( 0.4313726 -0.2490531 0.3522142), wk = 0.0029674 k( 46) = ( 0.4411765 -0.2547134 0.3602191), wk = 0.0029674 k( 47) = ( 0.4509804 -0.2603736 0.3682239), wk = 0.0029674 k( 48) = ( 0.4607843 -0.2660339 0.3762288), wk = 0.0029674 k( 49) = ( 0.4705882 -0.2716942 0.3842337), wk = 0.0029674 k( 50) = ( 0.4803922 -0.2773545 0.3922386), wk = 0.0029674 k( 51) = ( 0.4901961 -0.2830148 0.4002434), wk = 0.0029674 k( 52) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0029674 k( 53) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0029674 k( 54) = ( 0.5000000 -0.2775723 0.4160992), wk = 0.0029674 k( 55) = ( 0.5000000 -0.2664694 0.4239501), wk = 0.0029674 k( 56) = ( 0.5000000 -0.2553665 0.4318011), wk = 0.0029674 k( 57) = ( 0.5000000 -0.2442636 0.4396520), wk = 0.0029674 k( 58) = ( 0.5000000 -0.2331607 0.4475029), wk = 0.0029674 k( 59) = ( 0.5000000 -0.2220578 0.4553539), wk = 0.0029674 k( 60) = ( 0.5000000 -0.2109549 0.4632048), wk = 0.0029674 k( 61) = ( 0.5000000 -0.1998520 0.4710557), wk = 0.0029674 k( 62) = ( 0.5000000 -0.1887491 0.4789066), wk = 0.0029674 k( 63) = ( 0.5000000 -0.1776462 0.4867576), wk = 0.0029674 k( 64) = ( 0.5000000 -0.1665433 0.4946085), wk = 0.0029674 k( 65) = ( 0.5000000 -0.1554405 0.5024594), wk = 0.0029674 k( 66) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0029674 k( 67) = ( 0.5000000 -0.1332347 0.5181613), wk = 0.0029674 k( 68) = ( 0.5000000 -0.1221318 0.5260122), wk = 0.0029674 k( 69) = ( 0.5000000 -0.1110289 0.5338631), wk = 0.0029674 k( 70) = ( 0.5000000 -0.0999260 0.5417141), wk = 0.0029674 k( 71) = ( 0.5000000 -0.0888231 0.5495650), wk = 0.0029674 k( 72) = ( 0.5000000 -0.0777202 0.5574159), wk = 0.0029674 k( 73) = ( 0.5000000 -0.0666173 0.5652669), wk = 0.0029674 k( 74) = ( 0.5000000 -0.0555144 0.5731178), wk = 0.0029674 k( 75) = ( 0.5000000 -0.0444116 0.5809687), wk = 0.0029674 k( 76) = ( 0.5000000 -0.0333087 0.5888197), wk = 0.0029674 k( 77) = ( 0.5000000 -0.0222058 0.5966706), wk = 0.0029674 k( 78) = ( 0.5000000 -0.0111029 0.6045215), wk = 0.0029674 k( 79) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0029674 k( 80) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0029674 k( 81) = ( 0.4930556 0.0120281 0.6123724), wk = 0.0029674 k( 82) = ( 0.4861111 0.0240563 0.6123724), wk = 0.0029674 k( 83) = ( 0.4791667 0.0360844 0.6123724), wk = 0.0029674 k( 84) = ( 0.4722222 0.0481125 0.6123724), wk = 0.0029674 k( 85) = ( 0.4652778 0.0601406 0.6123724), wk = 0.0029674 k( 86) = ( 0.4583333 0.0721688 0.6123724), wk = 0.0029674 k( 87) = ( 0.4513889 0.0841969 0.6123724), wk = 0.0029674 k( 88) = ( 0.4444444 0.0962251 0.6123724), wk = 0.0029674 k( 89) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0029674 k( 90) = ( 0.4305556 0.1202813 0.6123724), wk = 0.0029674 k( 91) = ( 0.4236111 0.1323094 0.6123724), wk = 0.0029674 k( 92) = ( 0.4166667 0.1443376 0.6123724), wk = 0.0029674 k( 93) = ( 0.4097222 0.1563657 0.6123724), wk = 0.0029674 k( 94) = ( 0.4027778 0.1683938 0.6123724), wk = 0.0029674 k( 95) = ( 0.3958333 0.1804220 0.6123724), wk = 0.0029674 k( 96) = ( 0.3888889 0.1924501 0.6123724), wk = 0.0029674 k( 97) = ( 0.3819444 0.2044782 0.6123724), wk = 0.0029674 k( 98) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0029674 k( 99) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0029674 k( 100) = ( 0.3680556 0.2124970 0.6010322), wk = 0.0029674 k( 101) = ( 0.3611111 0.2084876 0.5896920), wk = 0.0029674 k( 102) = ( 0.3541667 0.2044782 0.5783517), wk = 0.0029674 k( 103) = ( 0.3472222 0.2004688 0.5670115), wk = 0.0029674 k( 104) = ( 0.3402778 0.1964595 0.5556713), wk = 0.0029674 k( 105) = ( 0.3333333 0.1924501 0.5443311), wk = 0.0029674 k( 106) = ( 0.3263889 0.1884407 0.5329908), wk = 0.0029674 k( 107) = ( 0.3194444 0.1844313 0.5216506), wk = 0.0029674 k( 108) = ( 0.3125000 0.1804220 0.5103104), wk = 0.0029674 k( 109) = ( 0.3055556 0.1764126 0.4989701), wk = 0.0029674 k( 110) = ( 0.2986111 0.1724032 0.4876299), wk = 0.0029674 k( 111) = ( 0.2916667 0.1683938 0.4762897), wk = 0.0029674 k( 112) = ( 0.2847222 0.1643845 0.4649494), wk = 0.0029674 k( 113) = ( 0.2777778 0.1603751 0.4536092), wk = 0.0029674 k( 114) = ( 0.2708333 0.1563657 0.4422690), wk = 0.0029674 k( 115) = ( 0.2638889 0.1523563 0.4309288), wk = 0.0029674 k( 116) = ( 0.2569444 0.1483469 0.4195885), wk = 0.0029674 k( 117) = ( 0.2500000 0.1443376 0.4082483), wk = 0.0029674 k( 118) = ( 0.2430556 0.1403282 0.3969081), wk = 0.0029674 k( 119) = ( 0.2361111 0.1363188 0.3855678), wk = 0.0029674 k( 120) = ( 0.2291667 0.1323094 0.3742276), wk = 0.0029674 k( 121) = ( 0.2222222 0.1283001 0.3628874), wk = 0.0029674 k( 122) = ( 0.2152778 0.1242907 0.3515471), wk = 0.0029674 k( 123) = ( 0.2083333 0.1202813 0.3402069), wk = 0.0029674 k( 124) = ( 0.2013889 0.1162719 0.3288667), wk = 0.0029674 k( 125) = ( 0.1944444 0.1122625 0.3175265), wk = 0.0029674 k( 126) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0029674 k( 127) = ( 0.1805556 0.1042438 0.2948460), wk = 0.0029674 k( 128) = ( 0.1736111 0.1002344 0.2835058), wk = 0.0029674 k( 129) = ( 0.1666667 0.0962250 0.2721655), wk = 0.0029674 k( 130) = ( 0.1597222 0.0922157 0.2608253), wk = 0.0029674 k( 131) = ( 0.1527778 0.0882063 0.2494851), wk = 0.0029674 k( 132) = ( 0.1458333 0.0841969 0.2381448), wk = 0.0029674 k( 133) = ( 0.1388889 0.0801875 0.2268046), wk = 0.0029674 k( 134) = ( 0.1319444 0.0761782 0.2154644), wk = 0.0029674 k( 135) = ( 0.1250000 0.0721688 0.2041241), wk = 0.0029674 k( 136) = ( 0.1180556 0.0681594 0.1927839), wk = 0.0029674 k( 137) = ( 0.1111111 0.0641500 0.1814437), wk = 0.0029674 k( 138) = ( 0.1041667 0.0601407 0.1701034), wk = 0.0029674 k( 139) = ( 0.0972222 0.0561313 0.1587632), wk = 0.0029674 k( 140) = ( 0.0902778 0.0521219 0.1474230), wk = 0.0029674 k( 141) = ( 0.0833333 0.0481125 0.1360828), wk = 0.0029674 k( 142) = ( 0.0763889 0.0441031 0.1247425), wk = 0.0029674 k( 143) = ( 0.0694444 0.0400938 0.1134023), wk = 0.0029674 k( 144) = ( 0.0625000 0.0360844 0.1020621), wk = 0.0029674 k( 145) = ( 0.0555556 0.0320750 0.0907218), wk = 0.0029674 k( 146) = ( 0.0486111 0.0280656 0.0793816), wk = 0.0029674 k( 147) = ( 0.0416667 0.0240563 0.0680414), wk = 0.0029674 k( 148) = ( 0.0347222 0.0200469 0.0567011), wk = 0.0029674 k( 149) = ( 0.0277778 0.0160375 0.0453609), wk = 0.0029674 k( 150) = ( 0.0208333 0.0120281 0.0340207), wk = 0.0029674 k( 151) = ( 0.0138889 0.0080188 0.0226805), wk = 0.0029674 k( 152) = ( 0.0069444 0.0040094 0.0113402), wk = 0.0029674 k( 153) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029674 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029674 k( 155) = ( 0.0113636 0.0065608 0.0046392), wk = 0.0029674 k( 156) = ( 0.0227273 0.0131216 0.0092784), wk = 0.0029674 k( 157) = ( 0.0340909 0.0196824 0.0139176), wk = 0.0029674 k( 158) = ( 0.0454546 0.0262432 0.0185567), wk = 0.0029674 k( 159) = ( 0.0568182 0.0328040 0.0231959), wk = 0.0029674 k( 160) = ( 0.0681818 0.0393648 0.0278351), wk = 0.0029674 k( 161) = ( 0.0795455 0.0459256 0.0324743), wk = 0.0029674 k( 162) = ( 0.0909091 0.0524864 0.0371135), wk = 0.0029674 k( 163) = ( 0.1022727 0.0590472 0.0417527), wk = 0.0029674 k( 164) = ( 0.1136364 0.0656080 0.0463918), wk = 0.0029674 k( 165) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0029674 k( 166) = ( 0.1363636 0.0787296 0.0556702), wk = 0.0029674 k( 167) = ( 0.1477273 0.0852904 0.0603094), wk = 0.0029674 k( 168) = ( 0.1590909 0.0918512 0.0649486), wk = 0.0029674 k( 169) = ( 0.1704546 0.0984120 0.0695878), wk = 0.0029674 k( 170) = ( 0.1818182 0.1049728 0.0742270), wk = 0.0029674 k( 171) = ( 0.1931818 0.1115336 0.0788661), wk = 0.0029674 k( 172) = ( 0.2045454 0.1180944 0.0835053), wk = 0.0029674 k( 173) = ( 0.2159091 0.1246552 0.0881445), wk = 0.0029674 k( 174) = ( 0.2272727 0.1312160 0.0927837), wk = 0.0029674 k( 175) = ( 0.2386364 0.1377768 0.0974229), wk = 0.0029674 k( 176) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0029674 k( 177) = ( 0.2613636 0.1508984 0.1067013), wk = 0.0029674 k( 178) = ( 0.2727273 0.1574592 0.1113404), wk = 0.0029674 k( 179) = ( 0.2840909 0.1640200 0.1159796), wk = 0.0029674 k( 180) = ( 0.2954545 0.1705808 0.1206188), wk = 0.0029674 k( 181) = ( 0.3068182 0.1771416 0.1252580), wk = 0.0029674 k( 182) = ( 0.3181818 0.1837024 0.1298972), wk = 0.0029674 k( 183) = ( 0.3295455 0.1902632 0.1345364), wk = 0.0029674 k( 184) = ( 0.3409091 0.1968240 0.1391756), wk = 0.0029674 k( 185) = ( 0.3522727 0.2033848 0.1438147), wk = 0.0029674 k( 186) = ( 0.3636364 0.2099456 0.1484539), wk = 0.0029674 k( 187) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0029674 k( 188) = ( 0.3863636 0.2230672 0.1577323), wk = 0.0029674 k( 189) = ( 0.3977273 0.2296279 0.1623715), wk = 0.0029674 k( 190) = ( 0.4090909 0.2361887 0.1670107), wk = 0.0029674 k( 191) = ( 0.4204545 0.2427495 0.1716499), wk = 0.0029674 k( 192) = ( 0.4318182 0.2493103 0.1762890), wk = 0.0029674 k( 193) = ( 0.4431818 0.2558711 0.1809282), wk = 0.0029674 k( 194) = ( 0.4545455 0.2624319 0.1855674), wk = 0.0029674 k( 195) = ( 0.4659091 0.2689927 0.1902066), wk = 0.0029674 k( 196) = ( 0.4772727 0.2755535 0.1948458), wk = 0.0029674 k( 197) = ( 0.4886364 0.2821143 0.1994850), wk = 0.0029674 k( 198) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0029674 k( 199) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0029674 k( 200) = ( 0.5040323 0.2770350 0.2107088), wk = 0.0029674 k( 201) = ( 0.5080645 0.2653949 0.2172934), wk = 0.0029674 k( 202) = ( 0.5120968 0.2537548 0.2238781), wk = 0.0029674 k( 203) = ( 0.5161290 0.2421146 0.2304627), wk = 0.0029674 k( 204) = ( 0.5201613 0.2304745 0.2370474), wk = 0.0029674 k( 205) = ( 0.5241936 0.2188344 0.2436320), wk = 0.0029674 k( 206) = ( 0.5282258 0.2071943 0.2502167), wk = 0.0029674 k( 207) = ( 0.5322581 0.1955541 0.2568013), wk = 0.0029674 k( 208) = ( 0.5362903 0.1839140 0.2633860), wk = 0.0029674 k( 209) = ( 0.5403226 0.1722739 0.2699706), wk = 0.0029674 k( 210) = ( 0.5443548 0.1606337 0.2765553), wk = 0.0029674 k( 211) = ( 0.5483871 0.1489936 0.2831399), wk = 0.0029674 k( 212) = ( 0.5524193 0.1373535 0.2897246), wk = 0.0029674 k( 213) = ( 0.5564516 0.1257134 0.2963092), wk = 0.0029674 k( 214) = ( 0.5604839 0.1140732 0.3028939), wk = 0.0029674 k( 215) = ( 0.5645161 0.1024331 0.3094785), wk = 0.0029674 k( 216) = ( 0.5685484 0.0907930 0.3160632), wk = 0.0029674 k( 217) = ( 0.5725807 0.0791529 0.3226478), wk = 0.0029674 k( 218) = ( 0.5766129 0.0675127 0.3292325), wk = 0.0029674 k( 219) = ( 0.5806452 0.0558726 0.3358171), wk = 0.0029674 k( 220) = ( 0.5846774 0.0442325 0.3424018), wk = 0.0029674 k( 221) = ( 0.5887097 0.0325924 0.3489864), wk = 0.0029674 k( 222) = ( 0.5927419 0.0209522 0.3555711), wk = 0.0029674 k( 223) = ( 0.5967742 0.0093121 0.3621557), wk = 0.0029674 k( 224) = ( 0.6008064 -0.0023280 0.3687404), wk = 0.0029674 k( 225) = ( 0.6048387 -0.0139682 0.3753250), wk = 0.0029674 k( 226) = ( 0.6088710 -0.0256083 0.3819097), wk = 0.0029674 k( 227) = ( 0.6129032 -0.0372484 0.3884943), wk = 0.0029674 k( 228) = ( 0.6169355 -0.0488885 0.3950790), wk = 0.0029674 k( 229) = ( 0.6209677 -0.0605287 0.4016636), wk = 0.0029674 k( 230) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0029674 k( 231) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0029674 k( 232) = ( 0.6180556 -0.0681594 0.4195885), wk = 0.0029674 k( 233) = ( 0.6111111 -0.0641500 0.4309288), wk = 0.0029674 k( 234) = ( 0.6041667 -0.0601407 0.4422690), wk = 0.0029674 k( 235) = ( 0.5972222 -0.0561313 0.4536092), wk = 0.0029674 k( 236) = ( 0.5902778 -0.0521219 0.4649494), wk = 0.0029674 k( 237) = ( 0.5833333 -0.0481125 0.4762897), wk = 0.0029674 k( 238) = ( 0.5763889 -0.0441031 0.4876299), wk = 0.0029674 k( 239) = ( 0.5694444 -0.0400938 0.4989701), wk = 0.0029674 k( 240) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0029674 k( 241) = ( 0.5555556 -0.0320750 0.5216506), wk = 0.0029674 k( 242) = ( 0.5486111 -0.0280656 0.5329908), wk = 0.0029674 k( 243) = ( 0.5416667 -0.0240563 0.5443310), wk = 0.0029674 k( 244) = ( 0.5347222 -0.0200469 0.5556713), wk = 0.0029674 k( 245) = ( 0.5277778 -0.0160375 0.5670115), wk = 0.0029674 k( 246) = ( 0.5208333 -0.0120281 0.5783518), wk = 0.0029674 k( 247) = ( 0.5138889 -0.0080188 0.5896920), wk = 0.0029674 k( 248) = ( 0.5069444 -0.0040094 0.6010322), wk = 0.0029674 k( 249) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0029674 k( 250) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0029674 k( 251) = ( 0.5000000 0.0080187 0.6010322), wk = 0.0029674 k( 252) = ( 0.5000000 0.0160375 0.5896920), wk = 0.0029674 k( 253) = ( 0.5000000 0.0240563 0.5783518), wk = 0.0029674 k( 254) = ( 0.5000000 0.0320750 0.5670115), wk = 0.0029674 k( 255) = ( 0.5000000 0.0400938 0.5556713), wk = 0.0029674 k( 256) = ( 0.5000000 0.0481125 0.5443310), wk = 0.0029674 k( 257) = ( 0.5000000 0.0561313 0.5329908), wk = 0.0029674 k( 258) = ( 0.5000000 0.0641500 0.5216506), wk = 0.0029674 k( 259) = ( 0.5000000 0.0721688 0.5103104), wk = 0.0029674 k( 260) = ( 0.5000000 0.0801875 0.4989701), wk = 0.0029674 k( 261) = ( 0.5000000 0.0882063 0.4876299), wk = 0.0029674 k( 262) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0029674 k( 263) = ( 0.5000000 0.1042438 0.4649494), wk = 0.0029674 k( 264) = ( 0.5000000 0.1122625 0.4536092), wk = 0.0029674 k( 265) = ( 0.5000000 0.1202813 0.4422690), wk = 0.0029674 k( 266) = ( 0.5000000 0.1283001 0.4309288), wk = 0.0029674 k( 267) = ( 0.5000000 0.1363188 0.4195885), wk = 0.0029674 k( 268) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0029674 k( 269) = ( 0.5000000 0.1523563 0.3969081), wk = 0.0029674 k( 270) = ( 0.5000000 0.1603751 0.3855678), wk = 0.0029674 k( 271) = ( 0.5000000 0.1683938 0.3742276), wk = 0.0029674 k( 272) = ( 0.5000000 0.1764126 0.3628874), wk = 0.0029674 k( 273) = ( 0.5000000 0.1844313 0.3515471), wk = 0.0029674 k( 274) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0029674 k( 275) = ( 0.5000000 0.2004688 0.3288667), wk = 0.0029674 k( 276) = ( 0.5000000 0.2084876 0.3175264), wk = 0.0029674 k( 277) = ( 0.5000000 0.2165064 0.3061862), wk = 0.0029674 k( 278) = ( 0.5000000 0.2245251 0.2948460), wk = 0.0029674 k( 279) = ( 0.5000000 0.2325439 0.2835058), wk = 0.0029674 k( 280) = ( 0.5000000 0.2405626 0.2721655), wk = 0.0029674 k( 281) = ( 0.5000000 0.2485814 0.2608253), wk = 0.0029674 k( 282) = ( 0.5000000 0.2566001 0.2494851), wk = 0.0029674 k( 283) = ( 0.5000000 0.2646189 0.2381448), wk = 0.0029674 k( 284) = ( 0.5000000 0.2726376 0.2268046), wk = 0.0029674 k( 285) = ( 0.5000000 0.2806564 0.2154644), wk = 0.0029674 k( 286) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0029674 k( 287) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0029674 k( 288) = ( 0.4959677 0.2863471 0.2172935), wk = 0.0029674 k( 289) = ( 0.4919355 0.2840191 0.2304627), wk = 0.0029674 k( 290) = ( 0.4879032 0.2816911 0.2436320), wk = 0.0029674 k( 291) = ( 0.4838710 0.2793630 0.2568013), wk = 0.0029674 k( 292) = ( 0.4798387 0.2770350 0.2699706), wk = 0.0029674 k( 293) = ( 0.4758064 0.2747070 0.2831399), wk = 0.0029674 k( 294) = ( 0.4717742 0.2723790 0.2963092), wk = 0.0029674 k( 295) = ( 0.4677419 0.2700509 0.3094785), wk = 0.0029674 k( 296) = ( 0.4637097 0.2677229 0.3226478), wk = 0.0029674 k( 297) = ( 0.4596774 0.2653949 0.3358171), wk = 0.0029674 k( 298) = ( 0.4556452 0.2630669 0.3489864), wk = 0.0029674 k( 299) = ( 0.4516129 0.2607388 0.3621557), wk = 0.0029674 k( 300) = ( 0.4475807 0.2584108 0.3753250), wk = 0.0029674 k( 301) = ( 0.4435484 0.2560828 0.3884943), wk = 0.0029674 k( 302) = ( 0.4395161 0.2537548 0.4016636), wk = 0.0029674 k( 303) = ( 0.4354839 0.2514267 0.4148329), wk = 0.0029674 k( 304) = ( 0.4314516 0.2490987 0.4280022), wk = 0.0029674 k( 305) = ( 0.4274193 0.2467707 0.4411715), wk = 0.0029674 k( 306) = ( 0.4233871 0.2444427 0.4543408), wk = 0.0029674 k( 307) = ( 0.4193548 0.2421146 0.4675101), wk = 0.0029674 k( 308) = ( 0.4153226 0.2397866 0.4806794), wk = 0.0029674 k( 309) = ( 0.4112903 0.2374586 0.4938487), wk = 0.0029674 k( 310) = ( 0.4072581 0.2351306 0.5070180), wk = 0.0029674 k( 311) = ( 0.4032258 0.2328025 0.5201873), wk = 0.0029674 k( 312) = ( 0.3991936 0.2304745 0.5333566), wk = 0.0029674 k( 313) = ( 0.3951613 0.2281465 0.5465259), wk = 0.0029674 k( 314) = ( 0.3911290 0.2258185 0.5596952), wk = 0.0029674 k( 315) = ( 0.3870968 0.2234904 0.5728645), wk = 0.0029674 k( 316) = ( 0.3830645 0.2211624 0.5860338), wk = 0.0029674 k( 317) = ( 0.3790323 0.2188344 0.5992031), wk = 0.0029674 k( 318) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0029674 k( 319) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0029674 k( 320) = ( 0.6180556 -0.0841969 0.4082483), wk = 0.0029674 k( 321) = ( 0.6111111 -0.0962250 0.4082483), wk = 0.0029674 k( 322) = ( 0.6041667 -0.1082532 0.4082483), wk = 0.0029674 k( 323) = ( 0.5972222 -0.1202813 0.4082483), wk = 0.0029674 k( 324) = ( 0.5902778 -0.1323094 0.4082483), wk = 0.0029674 k( 325) = ( 0.5833333 -0.1443376 0.4082483), wk = 0.0029674 k( 326) = ( 0.5763889 -0.1563657 0.4082483), wk = 0.0029674 k( 327) = ( 0.5694444 -0.1683938 0.4082483), wk = 0.0029674 k( 328) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0029674 k( 329) = ( 0.5555556 -0.1924501 0.4082483), wk = 0.0029674 k( 330) = ( 0.5486111 -0.2044782 0.4082483), wk = 0.0029674 k( 331) = ( 0.5416667 -0.2165064 0.4082483), wk = 0.0029674 k( 332) = ( 0.5347222 -0.2285345 0.4082483), wk = 0.0029674 k( 333) = ( 0.5277778 -0.2405626 0.4082483), wk = 0.0029674 k( 334) = ( 0.5208333 -0.2525907 0.4082483), wk = 0.0029674 k( 335) = ( 0.5138889 -0.2646189 0.4082483), wk = 0.0029674 k( 336) = ( 0.5069444 -0.2766470 0.4082483), wk = 0.0029674 k( 337) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0029674 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029674 k( 2) = ( 0.0098039 -0.0000000 0.0098039), wk = 0.0029674 k( 3) = ( 0.0196078 -0.0000000 0.0196078), wk = 0.0029674 k( 4) = ( 0.0294118 0.0000000 0.0294118), wk = 0.0029674 k( 5) = ( 0.0392157 0.0000000 0.0392157), wk = 0.0029674 k( 6) = ( 0.0490196 0.0000000 0.0490196), wk = 0.0029674 k( 7) = ( 0.0588235 -0.0000000 0.0588235), wk = 0.0029674 k( 8) = ( 0.0686275 0.0000000 0.0686275), wk = 0.0029674 k( 9) = ( 0.0784314 0.0000000 0.0784314), wk = 0.0029674 k( 10) = ( 0.0882353 -0.0000000 0.0882353), wk = 0.0029674 k( 11) = ( 0.0980392 0.0000000 0.0980392), wk = 0.0029674 k( 12) = ( 0.1078431 -0.0000000 0.1078431), wk = 0.0029674 k( 13) = ( 0.1176471 -0.0000000 0.1176471), wk = 0.0029674 k( 14) = ( 0.1274510 -0.0000000 0.1274510), wk = 0.0029674 k( 15) = ( 0.1372549 0.0000000 0.1372549), wk = 0.0029674 k( 16) = ( 0.1470588 0.0000000 0.1470588), wk = 0.0029674 k( 17) = ( 0.1568627 0.0000000 0.1568628), wk = 0.0029674 k( 18) = ( 0.1666667 -0.0000000 0.1666667), wk = 0.0029674 k( 19) = ( 0.1764706 -0.0000000 0.1764706), wk = 0.0029674 k( 20) = ( 0.1862745 0.0000000 0.1862745), wk = 0.0029674 k( 21) = ( 0.1960784 0.0000000 0.1960784), wk = 0.0029674 k( 22) = ( 0.2058823 0.0000000 0.2058824), wk = 0.0029674 k( 23) = ( 0.2156863 -0.0000000 0.2156863), wk = 0.0029674 k( 24) = ( 0.2254902 0.0000000 0.2254902), wk = 0.0029674 k( 25) = ( 0.2352941 -0.0000000 0.2352941), wk = 0.0029674 k( 26) = ( 0.2450980 -0.0000000 0.2450980), wk = 0.0029674 k( 27) = ( 0.2549020 -0.0000000 0.2549020), wk = 0.0029674 k( 28) = ( 0.2647059 0.0000000 0.2647059), wk = 0.0029674 k( 29) = ( 0.2745098 0.0000000 0.2745098), wk = 0.0029674 k( 30) = ( 0.2843137 0.0000000 0.2843137), wk = 0.0029674 k( 31) = ( 0.2941177 -0.0000000 0.2941177), wk = 0.0029674 k( 32) = ( 0.3039216 0.0000000 0.3039216), wk = 0.0029674 k( 33) = ( 0.3137255 0.0000000 0.3137255), wk = 0.0029674 k( 34) = ( 0.3235294 -0.0000000 0.3235294), wk = 0.0029674 k( 35) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0029674 k( 36) = ( 0.3431373 -0.0000000 0.3431373), wk = 0.0029674 k( 37) = ( 0.3529412 -0.0000000 0.3529412), wk = 0.0029674 k( 38) = ( 0.3627451 0.0000000 0.3627451), wk = 0.0029674 k( 39) = ( 0.3725490 0.0000000 0.3725490), wk = 0.0029674 k( 40) = ( 0.3823529 -0.0000000 0.3823529), wk = 0.0029674 k( 41) = ( 0.3921569 0.0000000 0.3921569), wk = 0.0029674 k( 42) = ( 0.4019608 -0.0000000 0.4019608), wk = 0.0029674 k( 43) = ( 0.4117647 -0.0000000 0.4117647), wk = 0.0029674 k( 44) = ( 0.4215686 -0.0000000 0.4215686), wk = 0.0029674 k( 45) = ( 0.4313726 0.0000000 0.4313726), wk = 0.0029674 k( 46) = ( 0.4411765 -0.0000000 0.4411765), wk = 0.0029674 k( 47) = ( 0.4509804 0.0000000 0.4509804), wk = 0.0029674 k( 48) = ( 0.4607843 -0.0000000 0.4607843), wk = 0.0029674 k( 49) = ( 0.4705882 -0.0000000 0.4705882), wk = 0.0029674 k( 50) = ( 0.4803922 -0.0000000 0.4803922), wk = 0.0029674 k( 51) = ( 0.4901961 -0.0000000 0.4901961), wk = 0.0029674 k( 52) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0029674 k( 53) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0029674 k( 54) = ( 0.5000000 0.0096154 0.5096154), wk = 0.0029674 k( 55) = ( 0.5000000 0.0192308 0.5192308), wk = 0.0029674 k( 56) = ( 0.5000000 0.0288461 0.5288462), wk = 0.0029674 k( 57) = ( 0.5000000 0.0384615 0.5384615), wk = 0.0029674 k( 58) = ( 0.5000000 0.0480769 0.5480769), wk = 0.0029674 k( 59) = ( 0.5000000 0.0576923 0.5576923), wk = 0.0029674 k( 60) = ( 0.5000000 0.0673077 0.5673077), wk = 0.0029674 k( 61) = ( 0.5000000 0.0769231 0.5769231), wk = 0.0029674 k( 62) = ( 0.5000000 0.0865385 0.5865385), wk = 0.0029674 k( 63) = ( 0.5000000 0.0961538 0.5961538), wk = 0.0029674 k( 64) = ( 0.5000000 0.1057692 0.6057692), wk = 0.0029674 k( 65) = ( 0.5000000 0.1153846 0.6153846), wk = 0.0029674 k( 66) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0029674 k( 67) = ( 0.5000000 0.1346154 0.6346154), wk = 0.0029674 k( 68) = ( 0.5000000 0.1442308 0.6442308), wk = 0.0029674 k( 69) = ( 0.5000000 0.1538461 0.6538462), wk = 0.0029674 k( 70) = ( 0.5000000 0.1634615 0.6634615), wk = 0.0029674 k( 71) = ( 0.5000000 0.1730769 0.6730769), wk = 0.0029674 k( 72) = ( 0.5000000 0.1826923 0.6826923), wk = 0.0029674 k( 73) = ( 0.5000000 0.1923077 0.6923077), wk = 0.0029674 k( 74) = ( 0.5000000 0.2019231 0.7019231), wk = 0.0029674 k( 75) = ( 0.5000000 0.2115385 0.7115385), wk = 0.0029674 k( 76) = ( 0.5000000 0.2211538 0.7211538), wk = 0.0029674 k( 77) = ( 0.5000000 0.2307692 0.7307692), wk = 0.0029674 k( 78) = ( 0.5000000 0.2403846 0.7403846), wk = 0.0029674 k( 79) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0029674 k( 80) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0029674 k( 81) = ( 0.4930556 0.2569444 0.7500000), wk = 0.0029674 k( 82) = ( 0.4861111 0.2638889 0.7500000), wk = 0.0029674 k( 83) = ( 0.4791667 0.2708333 0.7500000), wk = 0.0029674 k( 84) = ( 0.4722222 0.2777778 0.7500000), wk = 0.0029674 k( 85) = ( 0.4652778 0.2847222 0.7500000), wk = 0.0029674 k( 86) = ( 0.4583333 0.2916667 0.7500000), wk = 0.0029674 k( 87) = ( 0.4513889 0.2986111 0.7500000), wk = 0.0029674 k( 88) = ( 0.4444444 0.3055556 0.7500000), wk = 0.0029674 k( 89) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0029674 k( 90) = ( 0.4305556 0.3194444 0.7500000), wk = 0.0029674 k( 91) = ( 0.4236111 0.3263889 0.7500000), wk = 0.0029674 k( 92) = ( 0.4166667 0.3333333 0.7500000), wk = 0.0029674 k( 93) = ( 0.4097222 0.3402778 0.7500000), wk = 0.0029674 k( 94) = ( 0.4027778 0.3472222 0.7500000), wk = 0.0029674 k( 95) = ( 0.3958333 0.3541667 0.7500000), wk = 0.0029674 k( 96) = ( 0.3888889 0.3611111 0.7500000), wk = 0.0029674 k( 97) = ( 0.3819444 0.3680556 0.7500000), wk = 0.0029674 k( 98) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0029674 k( 99) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0029674 k( 100) = ( 0.3680556 0.3680556 0.7361111), wk = 0.0029674 k( 101) = ( 0.3611111 0.3611111 0.7222222), wk = 0.0029674 k( 102) = ( 0.3541667 0.3541667 0.7083333), wk = 0.0029674 k( 103) = ( 0.3472222 0.3472222 0.6944444), wk = 0.0029674 k( 104) = ( 0.3402778 0.3402778 0.6805556), wk = 0.0029674 k( 105) = ( 0.3333333 0.3333333 0.6666667), wk = 0.0029674 k( 106) = ( 0.3263889 0.3263889 0.6527778), wk = 0.0029674 k( 107) = ( 0.3194444 0.3194444 0.6388889), wk = 0.0029674 k( 108) = ( 0.3125000 0.3125000 0.6250000), wk = 0.0029674 k( 109) = ( 0.3055556 0.3055556 0.6111111), wk = 0.0029674 k( 110) = ( 0.2986111 0.2986111 0.5972222), wk = 0.0029674 k( 111) = ( 0.2916667 0.2916667 0.5833333), wk = 0.0029674 k( 112) = ( 0.2847222 0.2847222 0.5694444), wk = 0.0029674 k( 113) = ( 0.2777778 0.2777778 0.5555556), wk = 0.0029674 k( 114) = ( 0.2708333 0.2708333 0.5416667), wk = 0.0029674 k( 115) = ( 0.2638889 0.2638889 0.5277778), wk = 0.0029674 k( 116) = ( 0.2569444 0.2569444 0.5138889), wk = 0.0029674 k( 117) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0029674 k( 118) = ( 0.2430556 0.2430556 0.4861111), wk = 0.0029674 k( 119) = ( 0.2361111 0.2361111 0.4722222), wk = 0.0029674 k( 120) = ( 0.2291667 0.2291667 0.4583333), wk = 0.0029674 k( 121) = ( 0.2222222 0.2222222 0.4444444), wk = 0.0029674 k( 122) = ( 0.2152778 0.2152778 0.4305556), wk = 0.0029674 k( 123) = ( 0.2083333 0.2083333 0.4166667), wk = 0.0029674 k( 124) = ( 0.2013889 0.2013889 0.4027778), wk = 0.0029674 k( 125) = ( 0.1944444 0.1944444 0.3888889), wk = 0.0029674 k( 126) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0029674 k( 127) = ( 0.1805556 0.1805556 0.3611111), wk = 0.0029674 k( 128) = ( 0.1736111 0.1736111 0.3472222), wk = 0.0029674 k( 129) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0029674 k( 130) = ( 0.1597222 0.1597222 0.3194444), wk = 0.0029674 k( 131) = ( 0.1527778 0.1527778 0.3055556), wk = 0.0029674 k( 132) = ( 0.1458333 0.1458333 0.2916667), wk = 0.0029674 k( 133) = ( 0.1388889 0.1388889 0.2777778), wk = 0.0029674 k( 134) = ( 0.1319444 0.1319444 0.2638889), wk = 0.0029674 k( 135) = ( 0.1250000 0.1250000 0.2500000), wk = 0.0029674 k( 136) = ( 0.1180556 0.1180556 0.2361111), wk = 0.0029674 k( 137) = ( 0.1111111 0.1111111 0.2222222), wk = 0.0029674 k( 138) = ( 0.1041667 0.1041667 0.2083333), wk = 0.0029674 k( 139) = ( 0.0972222 0.0972222 0.1944444), wk = 0.0029674 k( 140) = ( 0.0902778 0.0902778 0.1805556), wk = 0.0029674 k( 141) = ( 0.0833333 0.0833333 0.1666667), wk = 0.0029674 k( 142) = ( 0.0763889 0.0763889 0.1527778), wk = 0.0029674 k( 143) = ( 0.0694444 0.0694444 0.1388889), wk = 0.0029674 k( 144) = ( 0.0625000 0.0625000 0.1250000), wk = 0.0029674 k( 145) = ( 0.0555556 0.0555556 0.1111111), wk = 0.0029674 k( 146) = ( 0.0486111 0.0486111 0.0972222), wk = 0.0029674 k( 147) = ( 0.0416667 0.0416667 0.0833333), wk = 0.0029674 k( 148) = ( 0.0347222 0.0347222 0.0694444), wk = 0.0029674 k( 149) = ( 0.0277778 0.0277778 0.0555556), wk = 0.0029674 k( 150) = ( 0.0208333 0.0208333 0.0416667), wk = 0.0029674 k( 151) = ( 0.0138889 0.0138889 0.0277778), wk = 0.0029674 k( 152) = ( 0.0069444 0.0069444 0.0138889), wk = 0.0029674 k( 153) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029674 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029674 k( 155) = ( 0.0113636 0.0113636 0.0113636), wk = 0.0029674 k( 156) = ( 0.0227273 0.0227273 0.0227273), wk = 0.0029674 k( 157) = ( 0.0340909 0.0340909 0.0340909), wk = 0.0029674 k( 158) = ( 0.0454546 0.0454546 0.0454546), wk = 0.0029674 k( 159) = ( 0.0568182 0.0568182 0.0568182), wk = 0.0029674 k( 160) = ( 0.0681818 0.0681818 0.0681818), wk = 0.0029674 k( 161) = ( 0.0795455 0.0795455 0.0795455), wk = 0.0029674 k( 162) = ( 0.0909091 0.0909091 0.0909091), wk = 0.0029674 k( 163) = ( 0.1022727 0.1022727 0.1022727), wk = 0.0029674 k( 164) = ( 0.1136364 0.1136364 0.1136364), wk = 0.0029674 k( 165) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0029674 k( 166) = ( 0.1363636 0.1363636 0.1363636), wk = 0.0029674 k( 167) = ( 0.1477273 0.1477273 0.1477273), wk = 0.0029674 k( 168) = ( 0.1590909 0.1590909 0.1590909), wk = 0.0029674 k( 169) = ( 0.1704546 0.1704546 0.1704546), wk = 0.0029674 k( 170) = ( 0.1818182 0.1818182 0.1818182), wk = 0.0029674 k( 171) = ( 0.1931818 0.1931818 0.1931818), wk = 0.0029674 k( 172) = ( 0.2045454 0.2045455 0.2045455), wk = 0.0029674 k( 173) = ( 0.2159091 0.2159091 0.2159091), wk = 0.0029674 k( 174) = ( 0.2272727 0.2272727 0.2272727), wk = 0.0029674 k( 175) = ( 0.2386364 0.2386364 0.2386364), wk = 0.0029674 k( 176) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029674 k( 177) = ( 0.2613636 0.2613636 0.2613636), wk = 0.0029674 k( 178) = ( 0.2727273 0.2727273 0.2727273), wk = 0.0029674 k( 179) = ( 0.2840909 0.2840909 0.2840909), wk = 0.0029674 k( 180) = ( 0.2954545 0.2954545 0.2954546), wk = 0.0029674 k( 181) = ( 0.3068182 0.3068182 0.3068182), wk = 0.0029674 k( 182) = ( 0.3181818 0.3181818 0.3181818), wk = 0.0029674 k( 183) = ( 0.3295455 0.3295455 0.3295455), wk = 0.0029674 k( 184) = ( 0.3409091 0.3409091 0.3409091), wk = 0.0029674 k( 185) = ( 0.3522727 0.3522727 0.3522727), wk = 0.0029674 k( 186) = ( 0.3636364 0.3636364 0.3636364), wk = 0.0029674 k( 187) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0029674 k( 188) = ( 0.3863636 0.3863636 0.3863636), wk = 0.0029674 k( 189) = ( 0.3977273 0.3977273 0.3977273), wk = 0.0029674 k( 190) = ( 0.4090909 0.4090909 0.4090909), wk = 0.0029674 k( 191) = ( 0.4204545 0.4204545 0.4204545), wk = 0.0029674 k( 192) = ( 0.4318182 0.4318182 0.4318182), wk = 0.0029674 k( 193) = ( 0.4431818 0.4431818 0.4431818), wk = 0.0029674 k( 194) = ( 0.4545455 0.4545455 0.4545455), wk = 0.0029674 k( 195) = ( 0.4659091 0.4659091 0.4659091), wk = 0.0029674 k( 196) = ( 0.4772727 0.4772727 0.4772727), wk = 0.0029674 k( 197) = ( 0.4886364 0.4886364 0.4886364), wk = 0.0029674 k( 198) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029674 k( 199) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029674 k( 200) = ( 0.5040323 0.4919355 0.5040323), wk = 0.0029674 k( 201) = ( 0.5080645 0.4838710 0.5080645), wk = 0.0029674 k( 202) = ( 0.5120968 0.4758065 0.5120968), wk = 0.0029674 k( 203) = ( 0.5161290 0.4677419 0.5161290), wk = 0.0029674 k( 204) = ( 0.5201613 0.4596774 0.5201613), wk = 0.0029674 k( 205) = ( 0.5241936 0.4516129 0.5241936), wk = 0.0029674 k( 206) = ( 0.5282258 0.4435484 0.5282258), wk = 0.0029674 k( 207) = ( 0.5322581 0.4354839 0.5322581), wk = 0.0029674 k( 208) = ( 0.5362903 0.4274193 0.5362903), wk = 0.0029674 k( 209) = ( 0.5403226 0.4193548 0.5403226), wk = 0.0029674 k( 210) = ( 0.5443548 0.4112903 0.5443548), wk = 0.0029674 k( 211) = ( 0.5483871 0.4032258 0.5483871), wk = 0.0029674 k( 212) = ( 0.5524193 0.3951613 0.5524193), wk = 0.0029674 k( 213) = ( 0.5564516 0.3870968 0.5564516), wk = 0.0029674 k( 214) = ( 0.5604839 0.3790323 0.5604839), wk = 0.0029674 k( 215) = ( 0.5645161 0.3709677 0.5645161), wk = 0.0029674 k( 216) = ( 0.5685484 0.3629032 0.5685484), wk = 0.0029674 k( 217) = ( 0.5725807 0.3548387 0.5725807), wk = 0.0029674 k( 218) = ( 0.5766129 0.3467742 0.5766129), wk = 0.0029674 k( 219) = ( 0.5806452 0.3387097 0.5806452), wk = 0.0029674 k( 220) = ( 0.5846774 0.3306452 0.5846774), wk = 0.0029674 k( 221) = ( 0.5887097 0.3225807 0.5887097), wk = 0.0029674 k( 222) = ( 0.5927419 0.3145161 0.5927419), wk = 0.0029674 k( 223) = ( 0.5967742 0.3064516 0.5967742), wk = 0.0029674 k( 224) = ( 0.6008064 0.2983871 0.6008064), wk = 0.0029674 k( 225) = ( 0.6048387 0.2903226 0.6048387), wk = 0.0029674 k( 226) = ( 0.6088710 0.2822581 0.6088710), wk = 0.0029674 k( 227) = ( 0.6129032 0.2741936 0.6129032), wk = 0.0029674 k( 228) = ( 0.6169355 0.2661290 0.6169355), wk = 0.0029674 k( 229) = ( 0.6209677 0.2580645 0.6209677), wk = 0.0029674 k( 230) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0029674 k( 231) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0029674 k( 232) = ( 0.6180556 0.2500000 0.6319444), wk = 0.0029674 k( 233) = ( 0.6111111 0.2500000 0.6388889), wk = 0.0029674 k( 234) = ( 0.6041667 0.2500000 0.6458333), wk = 0.0029674 k( 235) = ( 0.5972222 0.2500000 0.6527778), wk = 0.0029674 k( 236) = ( 0.5902778 0.2500000 0.6597222), wk = 0.0029674 k( 237) = ( 0.5833333 0.2500000 0.6666667), wk = 0.0029674 k( 238) = ( 0.5763889 0.2500000 0.6736111), wk = 0.0029674 k( 239) = ( 0.5694444 0.2500000 0.6805556), wk = 0.0029674 k( 240) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0029674 k( 241) = ( 0.5555556 0.2500000 0.6944444), wk = 0.0029674 k( 242) = ( 0.5486111 0.2500000 0.7013889), wk = 0.0029674 k( 243) = ( 0.5416667 0.2500000 0.7083333), wk = 0.0029674 k( 244) = ( 0.5347222 0.2500000 0.7152778), wk = 0.0029674 k( 245) = ( 0.5277778 0.2500000 0.7222222), wk = 0.0029674 k( 246) = ( 0.5208333 0.2500000 0.7291667), wk = 0.0029674 k( 247) = ( 0.5138889 0.2500000 0.7361111), wk = 0.0029674 k( 248) = ( 0.5069444 0.2500000 0.7430556), wk = 0.0029674 k( 249) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0029674 k( 250) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0029674 k( 251) = ( 0.5000000 0.2569444 0.7430556), wk = 0.0029674 k( 252) = ( 0.5000000 0.2638889 0.7361111), wk = 0.0029674 k( 253) = ( 0.5000000 0.2708333 0.7291667), wk = 0.0029674 k( 254) = ( 0.5000000 0.2777778 0.7222222), wk = 0.0029674 k( 255) = ( 0.5000000 0.2847222 0.7152778), wk = 0.0029674 k( 256) = ( 0.5000000 0.2916667 0.7083333), wk = 0.0029674 k( 257) = ( 0.5000000 0.2986111 0.7013889), wk = 0.0029674 k( 258) = ( 0.5000000 0.3055556 0.6944444), wk = 0.0029674 k( 259) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0029674 k( 260) = ( 0.5000000 0.3194444 0.6805556), wk = 0.0029674 k( 261) = ( 0.5000000 0.3263889 0.6736111), wk = 0.0029674 k( 262) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0029674 k( 263) = ( 0.5000000 0.3402778 0.6597222), wk = 0.0029674 k( 264) = ( 0.5000000 0.3472222 0.6527778), wk = 0.0029674 k( 265) = ( 0.5000000 0.3541667 0.6458333), wk = 0.0029674 k( 266) = ( 0.5000000 0.3611111 0.6388889), wk = 0.0029674 k( 267) = ( 0.5000000 0.3680556 0.6319444), wk = 0.0029674 k( 268) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0029674 k( 269) = ( 0.5000000 0.3819444 0.6180556), wk = 0.0029674 k( 270) = ( 0.5000000 0.3888889 0.6111111), wk = 0.0029674 k( 271) = ( 0.5000000 0.3958333 0.6041667), wk = 0.0029674 k( 272) = ( 0.5000000 0.4027778 0.5972222), wk = 0.0029674 k( 273) = ( 0.5000000 0.4097222 0.5902778), wk = 0.0029674 k( 274) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0029674 k( 275) = ( 0.5000000 0.4236111 0.5763889), wk = 0.0029674 k( 276) = ( 0.5000000 0.4305556 0.5694444), wk = 0.0029674 k( 277) = ( 0.5000000 0.4375000 0.5625000), wk = 0.0029674 k( 278) = ( 0.5000000 0.4444444 0.5555556), wk = 0.0029674 k( 279) = ( 0.5000000 0.4513889 0.5486111), wk = 0.0029674 k( 280) = ( 0.5000000 0.4583333 0.5416667), wk = 0.0029674 k( 281) = ( 0.5000000 0.4652778 0.5347222), wk = 0.0029674 k( 282) = ( 0.5000000 0.4722222 0.5277778), wk = 0.0029674 k( 283) = ( 0.5000000 0.4791667 0.5208333), wk = 0.0029674 k( 284) = ( 0.5000000 0.4861111 0.5138889), wk = 0.0029674 k( 285) = ( 0.5000000 0.4930556 0.5069444), wk = 0.0029674 k( 286) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029674 k( 287) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029674 k( 288) = ( 0.4959677 0.4959677 0.5080645), wk = 0.0029674 k( 289) = ( 0.4919355 0.4919355 0.5161290), wk = 0.0029674 k( 290) = ( 0.4879032 0.4879032 0.5241936), wk = 0.0029674 k( 291) = ( 0.4838710 0.4838710 0.5322581), wk = 0.0029674 k( 292) = ( 0.4798387 0.4798387 0.5403226), wk = 0.0029674 k( 293) = ( 0.4758064 0.4758064 0.5483871), wk = 0.0029674 k( 294) = ( 0.4717742 0.4717742 0.5564516), wk = 0.0029674 k( 295) = ( 0.4677419 0.4677419 0.5645161), wk = 0.0029674 k( 296) = ( 0.4637097 0.4637097 0.5725807), wk = 0.0029674 k( 297) = ( 0.4596774 0.4596774 0.5806452), wk = 0.0029674 k( 298) = ( 0.4556452 0.4556452 0.5887097), wk = 0.0029674 k( 299) = ( 0.4516129 0.4516129 0.5967742), wk = 0.0029674 k( 300) = ( 0.4475807 0.4475807 0.6048387), wk = 0.0029674 k( 301) = ( 0.4435484 0.4435484 0.6129032), wk = 0.0029674 k( 302) = ( 0.4395161 0.4395161 0.6209677), wk = 0.0029674 k( 303) = ( 0.4354839 0.4354839 0.6290323), wk = 0.0029674 k( 304) = ( 0.4314516 0.4314516 0.6370968), wk = 0.0029674 k( 305) = ( 0.4274193 0.4274193 0.6451613), wk = 0.0029674 k( 306) = ( 0.4233871 0.4233871 0.6532258), wk = 0.0029674 k( 307) = ( 0.4193548 0.4193548 0.6612903), wk = 0.0029674 k( 308) = ( 0.4153226 0.4153226 0.6693548), wk = 0.0029674 k( 309) = ( 0.4112903 0.4112903 0.6774193), wk = 0.0029674 k( 310) = ( 0.4072581 0.4072581 0.6854839), wk = 0.0029674 k( 311) = ( 0.4032258 0.4032258 0.6935484), wk = 0.0029674 k( 312) = ( 0.3991936 0.3991936 0.7016129), wk = 0.0029674 k( 313) = ( 0.3951613 0.3951613 0.7096774), wk = 0.0029674 k( 314) = ( 0.3911290 0.3911290 0.7177419), wk = 0.0029674 k( 315) = ( 0.3870968 0.3870968 0.7258064), wk = 0.0029674 k( 316) = ( 0.3830645 0.3830645 0.7338710), wk = 0.0029674 k( 317) = ( 0.3790323 0.3790323 0.7419355), wk = 0.0029674 k( 318) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0029674 k( 319) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0029674 k( 320) = ( 0.6180556 0.2361111 0.6180556), wk = 0.0029674 k( 321) = ( 0.6111111 0.2222222 0.6111111), wk = 0.0029674 k( 322) = ( 0.6041667 0.2083333 0.6041667), wk = 0.0029674 k( 323) = ( 0.5972222 0.1944444 0.5972222), wk = 0.0029674 k( 324) = ( 0.5902778 0.1805556 0.5902778), wk = 0.0029674 k( 325) = ( 0.5833333 0.1666667 0.5833333), wk = 0.0029674 k( 326) = ( 0.5763889 0.1527778 0.5763889), wk = 0.0029674 k( 327) = ( 0.5694444 0.1388889 0.5694444), wk = 0.0029674 k( 328) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0029674 k( 329) = ( 0.5555556 0.1111111 0.5555556), wk = 0.0029674 k( 330) = ( 0.5486111 0.0972222 0.5486111), wk = 0.0029674 k( 331) = ( 0.5416667 0.0833333 0.5416667), wk = 0.0029674 k( 332) = ( 0.5347222 0.0694444 0.5347222), wk = 0.0029674 k( 333) = ( 0.5277778 0.0555556 0.5277778), wk = 0.0029674 k( 334) = ( 0.5208333 0.0416667 0.5208333), wk = 0.0029674 k( 335) = ( 0.5138889 0.0277778 0.5138889), wk = 0.0029674 k( 336) = ( 0.5069444 0.0138889 0.5069444), wk = 0.0029674 k( 337) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0029674 Dense grid: 68873 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 25509 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.12 Mb ( 184, 44) NL pseudopotentials 0.12 Mb ( 92, 82) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1914) G-vector shells 0.00 Mb ( 476) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.49 Mb ( 184, 176) Each subspace H/S matrix 0.03 Mb ( 44, 44) Each matrix 0.11 Mb ( 82, 2, 44) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./MgCuBi.save/charge-density.dat Starting wfc are 46 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.0 secs Computing kpt #: 2 total cpu time spent up to now is 3.4 secs Computing kpt #: 3 total cpu time spent up to now is 3.8 secs Computing kpt #: 4 total cpu time spent up to now is 4.1 secs Computing kpt #: 5 total cpu time spent up to now is 4.5 secs Computing kpt #: 6 total cpu time spent up to now is 4.9 secs Computing kpt #: 7 total cpu time spent up to now is 5.3 secs Computing kpt #: 8 total cpu time spent up to now is 5.6 secs Computing kpt #: 9 total cpu time spent up to now is 6.0 secs Computing kpt #: 10 total cpu time spent up to now is 6.5 secs Computing kpt #: 11 total cpu time spent up to now is 6.9 secs Computing kpt #: 12 total cpu time spent up to now is 7.3 secs Computing kpt #: 13 total cpu time spent up to now is 7.7 secs Computing kpt #: 14 total cpu time spent up to now is 8.1 secs Computing kpt #: 15 total cpu time spent up to now is 8.5 secs Computing kpt #: 16 total cpu time spent up to now is 8.9 secs Computing kpt #: 17 total cpu time spent up to now is 9.3 secs Computing kpt #: 18 total cpu time spent up to now is 9.7 secs Computing kpt #: 19 total cpu time spent up to now is 10.2 secs Computing kpt #: 20 total cpu time spent up to now is 10.5 secs Computing kpt #: 21 total cpu time spent up to now is 10.9 secs Computing kpt #: 22 total cpu time spent up to now is 11.4 secs Computing kpt #: 23 total cpu time spent up to now is 11.8 secs Computing kpt #: 24 total cpu time spent up to now is 12.2 secs Computing kpt #: 25 total cpu time spent up to now is 12.6 secs Computing kpt #: 26 total cpu time spent up to now is 13.0 secs Computing kpt #: 27 total cpu time spent up to now is 13.5 secs Computing kpt #: 28 total cpu time spent up to now is 13.9 secs Computing kpt #: 29 total cpu time spent up to now is 14.4 secs Computing kpt #: 30 total cpu time spent up to now is 14.8 secs Computing kpt #: 31 total cpu time spent up to now is 15.2 secs Computing kpt #: 32 total cpu time spent up to now is 15.6 secs Computing kpt #: 33 total cpu time spent up to now is 16.1 secs Computing kpt #: 34 total cpu time spent up to now is 16.6 secs Computing kpt #: 35 total cpu time spent up to now is 17.1 secs Computing kpt #: 36 total cpu time spent up to now is 17.6 secs Computing kpt #: 37 total cpu time spent up to now is 18.1 secs Computing kpt #: 38 total cpu time spent up to now is 18.5 secs Computing kpt #: 39 total cpu time spent up to now is 18.9 secs Computing kpt #: 40 total cpu time spent up to now is 19.4 secs Computing kpt #: 41 total cpu time spent up to now is 19.8 secs Computing kpt #: 42 total cpu time spent up to now is 20.5 secs Computing kpt #: 43 total cpu time spent up to now is 20.9 secs Computing kpt #: 44 total cpu time spent up to now is 21.3 secs Computing kpt #: 45 total cpu time spent up to now is 21.7 secs Computing kpt #: 46 total cpu time spent up to now is 22.1 secs Computing kpt #: 47 total cpu time spent up to now is 22.6 secs Computing kpt #: 48 total cpu time spent up to now is 23.0 secs Computing kpt #: 49 total cpu time spent up to now is 23.4 secs Computing kpt #: 50 total cpu time spent up to now is 23.8 secs Computing kpt #: 51 total cpu time spent up to now is 24.2 secs Computing kpt #: 52 total cpu time spent up to now is 24.6 secs Computing kpt #: 53 total cpu time spent up to now is 25.0 secs Computing kpt #: 54 total cpu time spent up to now is 25.4 secs Computing kpt #: 55 total cpu time spent up to now is 25.8 secs Computing kpt #: 56 total cpu time spent up to now is 26.2 secs Computing kpt #: 57 total cpu time spent up to now is 26.7 secs Computing kpt #: 58 total cpu time spent up to now is 27.1 secs Computing kpt #: 59 total cpu time spent up to now is 27.5 secs Computing kpt #: 60 total cpu time spent up to now is 27.9 secs Computing kpt #: 61 total cpu time spent up to now is 28.3 secs Computing kpt #: 62 total cpu time spent up to now is 28.8 secs Computing kpt #: 63 total cpu time spent up to now is 29.3 secs Computing kpt #: 64 total cpu time spent up to now is 29.7 secs Computing kpt #: 65 total cpu time spent up to now is 30.1 secs Computing kpt #: 66 total cpu time spent up to now is 30.6 secs Computing kpt #: 67 total cpu time spent up to now is 31.0 secs Computing kpt #: 68 total cpu time spent up to now is 31.4 secs Computing kpt #: 69 total cpu time spent up to now is 31.8 secs Computing kpt #: 70 total cpu time spent up to now is 32.2 secs Computing kpt #: 71 total cpu time spent up to now is 32.6 secs Computing kpt #: 72 total cpu time spent up to now is 33.0 secs Computing kpt #: 73 total cpu time spent up to now is 33.4 secs Computing kpt #: 74 total cpu time spent up to now is 33.8 secs Computing kpt #: 75 total cpu time spent up to now is 34.1 secs Computing kpt #: 76 total cpu time spent up to now is 34.5 secs Computing kpt #: 77 total cpu time spent up to now is 34.9 secs Computing kpt #: 78 total cpu time spent up to now is 35.3 secs Computing kpt #: 79 total cpu time spent up to now is 35.6 secs Computing kpt #: 80 total cpu time spent up to now is 36.0 secs Computing kpt #: 81 total cpu time spent up to now is 36.4 secs Computing kpt #: 82 total cpu time spent up to now is 36.7 secs Computing kpt #: 83 total cpu time spent up to now is 37.1 secs Computing kpt #: 84 total cpu time spent up to now is 37.5 secs Computing kpt #: 85 total cpu time spent up to now is 37.9 secs Computing kpt #: 86 total cpu time spent up to now is 38.3 secs Computing kpt #: 87 total cpu time spent up to now is 38.7 secs Computing kpt #: 88 total cpu time spent up to now is 39.1 secs Computing kpt #: 89 total cpu time spent up to now is 39.5 secs Computing kpt #: 90 total cpu time spent up to now is 39.9 secs Computing kpt #: 91 total cpu time spent up to now is 40.4 secs Computing kpt #: 92 total cpu time spent up to now is 40.8 secs Computing kpt #: 93 total cpu time spent up to now is 41.2 secs Computing kpt #: 94 total cpu time spent up to now is 41.6 secs Computing kpt #: 95 total cpu time spent up to now is 42.0 secs Computing kpt #: 96 total cpu time spent up to now is 42.4 secs Computing kpt #: 97 total cpu time spent up to now is 42.8 secs Computing kpt #: 98 total cpu time spent up to now is 43.2 secs Computing kpt #: 99 total cpu time spent up to now is 43.6 secs Computing kpt #: 100 total cpu time spent up to now is 44.0 secs Computing kpt #: 101 total cpu time spent up to now is 44.4 secs Computing kpt #: 102 total cpu time spent up to now is 44.8 secs Computing kpt #: 103 total cpu time spent up to now is 45.1 secs Computing kpt #: 104 total cpu time spent up to now is 45.5 secs Computing kpt #: 105 total cpu time spent up to now is 45.9 secs Computing kpt #: 106 total cpu time spent up to now is 46.3 secs Computing kpt #: 107 total cpu time spent up to now is 46.7 secs Computing kpt #: 108 total cpu time spent up to now is 47.1 secs Computing kpt #: 109 total cpu time spent up to now is 47.5 secs Computing kpt #: 110 total cpu time spent up to now is 47.9 secs Computing kpt #: 111 total cpu time spent up to now is 48.3 secs Computing kpt #: 112 total cpu time spent up to now is 48.7 secs Computing kpt #: 113 total cpu time spent up to now is 49.1 secs Computing kpt #: 114 total cpu time spent up to now is 49.5 secs Computing kpt #: 115 total cpu time spent up to now is 49.9 secs Computing kpt #: 116 total cpu time spent up to now is 50.3 secs Computing kpt #: 117 total cpu time spent up to now is 50.7 secs Computing kpt #: 118 total cpu time spent up to now is 51.0 secs Computing kpt #: 119 total cpu time spent up to now is 51.4 secs Computing kpt #: 120 total cpu time spent up to now is 51.8 secs Computing kpt #: 121 total cpu time spent up to now is 52.2 secs Computing kpt #: 122 total cpu time spent up to now is 52.7 secs Computing kpt #: 123 total cpu time spent up to now is 53.1 secs Computing kpt #: 124 total cpu time spent up to now is 53.5 secs Computing kpt #: 125 total cpu time spent up to now is 53.9 secs Computing kpt #: 126 total cpu time spent up to now is 54.2 secs Computing kpt #: 127 total cpu time spent up to now is 54.7 secs Computing kpt #: 128 total cpu time spent up to now is 55.1 secs Computing kpt #: 129 total cpu time spent up to now is 55.5 secs Computing kpt #: 130 total cpu time spent up to now is 55.9 secs Computing kpt #: 131 total cpu time spent up to now is 56.3 secs Computing kpt #: 132 total cpu time spent up to now is 56.7 secs Computing kpt #: 133 total cpu time spent up to now is 57.1 secs Computing kpt #: 134 total cpu time spent up to now is 57.5 secs Computing kpt #: 135 total cpu time spent up to now is 57.9 secs Computing kpt #: 136 total cpu time spent up to now is 58.3 secs Computing kpt #: 137 total cpu time spent up to now is 58.7 secs Computing kpt #: 138 total cpu time spent up to now is 59.1 secs Computing kpt #: 139 total cpu time spent up to now is 59.5 secs Computing kpt #: 140 total cpu time spent up to now is 60.0 secs Computing kpt #: 141 total cpu time spent up to now is 60.3 secs Computing kpt #: 142 total cpu time spent up to now is 60.8 secs Computing kpt #: 143 total cpu time spent up to now is 61.2 secs Computing kpt #: 144 total cpu time spent up to now is 61.5 secs Computing kpt #: 145 total cpu time spent up to now is 61.9 secs Computing kpt #: 146 total cpu time spent up to now is 62.3 secs Computing kpt #: 147 total cpu time spent up to now is 62.7 secs Computing kpt #: 148 total cpu time spent up to now is 63.1 secs Computing kpt #: 149 total cpu time spent up to now is 63.5 secs Computing kpt #: 150 total cpu time spent up to now is 63.9 secs Computing kpt #: 151 total cpu time spent up to now is 64.3 secs Computing kpt #: 152 total cpu time spent up to now is 64.6 secs Computing kpt #: 153 total cpu time spent up to now is 65.0 secs Computing kpt #: 154 total cpu time spent up to now is 65.4 secs Computing kpt #: 155 total cpu time spent up to now is 65.8 secs Computing kpt #: 156 total cpu time spent up to now is 66.2 secs Computing kpt #: 157 total cpu time spent up to now is 66.6 secs Computing kpt #: 158 total cpu time spent up to now is 66.9 secs Computing kpt #: 159 total cpu time spent up to now is 67.3 secs Computing kpt #: 160 total cpu time spent up to now is 67.7 secs Computing kpt #: 161 total cpu time spent up to now is 68.1 secs Computing kpt #: 162 total cpu time spent up to now is 68.4 secs Computing kpt #: 163 total cpu time spent up to now is 68.8 secs Computing kpt #: 164 total cpu time spent up to now is 69.2 secs Computing kpt #: 165 total cpu time spent up to now is 69.6 secs Computing kpt #: 166 total cpu time spent up to now is 70.0 secs Computing kpt #: 167 total cpu time spent up to now is 70.4 secs Computing kpt #: 168 total cpu time spent up to now is 70.8 secs Computing kpt #: 169 total cpu time spent up to now is 71.1 secs Computing kpt #: 170 total cpu time spent up to now is 71.5 secs Computing kpt #: 171 total cpu time spent up to now is 72.7 secs Computing kpt #: 172 total cpu time spent up to now is 73.1 secs Computing kpt #: 173 total cpu time spent up to now is 73.5 secs Computing kpt #: 174 total cpu time spent up to now is 73.9 secs Computing kpt #: 175 total cpu time spent up to now is 74.3 secs Computing kpt #: 176 total cpu time spent up to now is 74.7 secs Computing kpt #: 177 total cpu time spent up to now is 75.2 secs Computing kpt #: 178 total cpu time spent up to now is 75.5 secs Computing kpt #: 179 total cpu time spent up to now is 75.9 secs Computing kpt #: 180 total cpu time spent up to now is 76.3 secs Computing kpt #: 181 total cpu time spent up to now is 76.7 secs Computing kpt #: 182 total cpu time spent up to now is 77.1 secs Computing kpt #: 183 total cpu time spent up to now is 77.5 secs Computing kpt #: 184 total cpu time spent up to now is 77.9 secs Computing kpt #: 185 total cpu time spent up to now is 78.3 secs Computing kpt #: 186 total cpu time spent up to now is 78.6 secs Computing kpt #: 187 total cpu time spent up to now is 79.0 secs Computing kpt #: 188 total cpu time spent up to now is 79.4 secs Computing kpt #: 189 total cpu time spent up to now is 79.8 secs Computing kpt #: 190 total cpu time spent up to now is 80.1 secs Computing kpt #: 191 total cpu time spent up to now is 80.5 secs Computing kpt #: 192 total cpu time spent up to now is 80.9 secs Computing kpt #: 193 total cpu time spent up to now is 81.2 secs Computing kpt #: 194 total cpu time spent up to now is 81.5 secs Computing kpt #: 195 total cpu time spent up to now is 81.9 secs Computing kpt #: 196 total cpu time spent up to now is 82.3 secs Computing kpt #: 197 total cpu time spent up to now is 82.7 secs Computing kpt #: 198 total cpu time spent up to now is 83.1 secs Computing kpt #: 199 total cpu time spent up to now is 83.4 secs Computing kpt #: 200 total cpu time spent up to now is 83.8 secs Computing kpt #: 201 total cpu time spent up to now is 84.1 secs Computing kpt #: 202 total cpu time spent up to now is 84.5 secs Computing kpt #: 203 total cpu time spent up to now is 84.9 secs Computing kpt #: 204 total cpu time spent up to now is 85.3 secs Computing kpt #: 205 total cpu time spent up to now is 85.6 secs Computing kpt #: 206 total cpu time spent up to now is 86.0 secs Computing kpt #: 207 total cpu time spent up to now is 86.3 secs Computing kpt #: 208 total cpu time spent up to now is 86.7 secs Computing kpt #: 209 total cpu time spent up to now is 87.1 secs Computing kpt #: 210 total cpu time spent up to now is 87.5 secs Computing kpt #: 211 total cpu time spent up to now is 87.9 secs Computing kpt #: 212 total cpu time spent up to now is 88.4 secs Computing kpt #: 213 total cpu time spent up to now is 88.8 secs Computing kpt #: 214 total cpu time spent up to now is 89.1 secs Computing kpt #: 215 total cpu time spent up to now is 89.5 secs Computing kpt #: 216 total cpu time spent up to now is 89.9 secs Computing kpt #: 217 total cpu time spent up to now is 90.3 secs Computing kpt #: 218 total cpu time spent up to now is 90.7 secs Computing kpt #: 219 total cpu time spent up to now is 91.5 secs Computing kpt #: 220 total cpu time spent up to now is 91.9 secs Computing kpt #: 221 total cpu time spent up to now is 92.3 secs Computing kpt #: 222 total cpu time spent up to now is 92.7 secs Computing kpt #: 223 total cpu time spent up to now is 93.2 secs Computing kpt #: 224 total cpu time spent up to now is 93.6 secs Computing kpt #: 225 total cpu time spent up to now is 94.0 secs Computing kpt #: 226 total cpu time spent up to now is 94.4 secs Computing kpt #: 227 total cpu time spent up to now is 94.8 secs Computing kpt #: 228 total cpu time spent up to now is 95.2 secs Computing kpt #: 229 total cpu time spent up to now is 95.6 secs Computing kpt #: 230 total cpu time spent up to now is 96.0 secs Computing kpt #: 231 total cpu time spent up to now is 96.3 secs Computing kpt #: 232 total cpu time spent up to now is 96.7 secs Computing kpt #: 233 total cpu time spent up to now is 97.2 secs Computing kpt #: 234 total cpu time spent up to now is 97.6 secs Computing kpt #: 235 total cpu time spent up to now is 98.0 secs Computing kpt #: 236 total cpu time spent up to now is 98.4 secs Computing kpt #: 237 total cpu time spent up to now is 98.8 secs Computing kpt #: 238 total cpu time spent up to now is 99.2 secs Computing kpt #: 239 total cpu time spent up to now is 99.6 secs Computing kpt #: 240 total cpu time spent up to now is 100.0 secs Computing kpt #: 241 total cpu time spent up to now is 100.3 secs Computing kpt #: 242 total cpu time spent up to now is 100.7 secs Computing kpt #: 243 total cpu time spent up to now is 101.1 secs Computing kpt #: 244 total cpu time spent up to now is 101.6 secs Computing kpt #: 245 total cpu time spent up to now is 101.9 secs Computing kpt #: 246 total cpu time spent up to now is 102.3 secs Computing kpt #: 247 total cpu time spent up to now is 102.7 secs Computing kpt #: 248 total cpu time spent up to now is 103.1 secs Computing kpt #: 249 total cpu time spent up to now is 103.4 secs Computing kpt #: 250 total cpu time spent up to now is 103.8 secs Computing kpt #: 251 total cpu time spent up to now is 104.1 secs Computing kpt #: 252 total cpu time spent up to now is 104.5 secs Computing kpt #: 253 total cpu time spent up to now is 104.9 secs Computing kpt #: 254 total cpu time spent up to now is 105.3 secs Computing kpt #: 255 total cpu time spent up to now is 105.7 secs Computing kpt #: 256 total cpu time spent up to now is 106.1 secs Computing kpt #: 257 total cpu time spent up to now is 106.4 secs Computing kpt #: 258 total cpu time spent up to now is 107.0 secs Computing kpt #: 259 total cpu time spent up to now is 107.4 secs Computing kpt #: 260 total cpu time spent up to now is 107.7 secs Computing kpt #: 261 total cpu time spent up to now is 108.2 secs Computing kpt #: 262 total cpu time spent up to now is 108.5 secs Computing kpt #: 263 total cpu time spent up to now is 108.9 secs Computing kpt #: 264 total cpu time spent up to now is 109.3 secs Computing kpt #: 265 total cpu time spent up to now is 109.7 secs Computing kpt #: 266 total cpu time spent up to now is 110.2 secs Computing kpt #: 267 total cpu time spent up to now is 110.6 secs Computing kpt #: 268 total cpu time spent up to now is 111.0 secs Computing kpt #: 269 total cpu time spent up to now is 111.4 secs Computing kpt #: 270 total cpu time spent up to now is 111.8 secs Computing kpt #: 271 total cpu time spent up to now is 112.2 secs Computing kpt #: 272 total cpu time spent up to now is 112.6 secs Computing kpt #: 273 total cpu time spent up to now is 113.0 secs Computing kpt #: 274 total cpu time spent up to now is 113.4 secs Computing kpt #: 275 total cpu time spent up to now is 113.8 secs Computing kpt #: 276 total cpu time spent up to now is 114.2 secs Computing kpt #: 277 total cpu time spent up to now is 114.6 secs Computing kpt #: 278 total cpu time spent up to now is 114.9 secs Computing kpt #: 279 total cpu time spent up to now is 115.3 secs Computing kpt #: 280 total cpu time spent up to now is 115.7 secs Computing kpt #: 281 total cpu time spent up to now is 116.0 secs Computing kpt #: 282 total cpu time spent up to now is 116.5 secs Computing kpt #: 283 total cpu time spent up to now is 116.9 secs Computing kpt #: 284 total cpu time spent up to now is 117.2 secs Computing kpt #: 285 total cpu time spent up to now is 117.6 secs Computing kpt #: 286 total cpu time spent up to now is 117.9 secs Computing kpt #: 287 total cpu time spent up to now is 118.3 secs Computing kpt #: 288 total cpu time spent up to now is 118.6 secs Computing kpt #: 289 total cpu time spent up to now is 119.0 secs Computing kpt #: 290 total cpu time spent up to now is 119.4 secs Computing kpt #: 291 total cpu time spent up to now is 119.7 secs Computing kpt #: 292 total cpu time spent up to now is 120.1 secs Computing kpt #: 293 total cpu time spent up to now is 120.5 secs Computing kpt #: 294 total cpu time spent up to now is 120.8 secs Computing kpt #: 295 total cpu time spent up to now is 121.2 secs Computing kpt #: 296 total cpu time spent up to now is 121.6 secs Computing kpt #: 297 total cpu time spent up to now is 121.9 secs Computing kpt #: 298 total cpu time spent up to now is 122.3 secs Computing kpt #: 299 total cpu time spent up to now is 122.7 secs Computing kpt #: 300 total cpu time spent up to now is 123.1 secs Computing kpt #: 301 total cpu time spent up to now is 123.6 secs Computing kpt #: 302 total cpu time spent up to now is 124.0 secs Computing kpt #: 303 total cpu time spent up to now is 124.3 secs Computing kpt #: 304 total cpu time spent up to now is 124.7 secs Computing kpt #: 305 total cpu time spent up to now is 125.1 secs Computing kpt #: 306 total cpu time spent up to now is 125.5 secs Computing kpt #: 307 total cpu time spent up to now is 126.8 secs Computing kpt #: 308 total cpu time spent up to now is 127.2 secs Computing kpt #: 309 total cpu time spent up to now is 127.6 secs Computing kpt #: 310 total cpu time spent up to now is 128.0 secs Computing kpt #: 311 total cpu time spent up to now is 128.4 secs Computing kpt #: 312 total cpu time spent up to now is 128.8 secs Computing kpt #: 313 total cpu time spent up to now is 129.2 secs Computing kpt #: 314 total cpu time spent up to now is 129.6 secs Computing kpt #: 315 total cpu time spent up to now is 130.0 secs Computing kpt #: 316 total cpu time spent up to now is 130.4 secs Computing kpt #: 317 total cpu time spent up to now is 130.8 secs Computing kpt #: 318 total cpu time spent up to now is 131.2 secs Computing kpt #: 319 total cpu time spent up to now is 131.6 secs Computing kpt #: 320 total cpu time spent up to now is 132.0 secs Computing kpt #: 321 total cpu time spent up to now is 132.4 secs Computing kpt #: 322 total cpu time spent up to now is 132.8 secs Computing kpt #: 323 total cpu time spent up to now is 133.2 secs Computing kpt #: 324 total cpu time spent up to now is 133.6 secs Computing kpt #: 325 total cpu time spent up to now is 134.0 secs Computing kpt #: 326 total cpu time spent up to now is 134.4 secs Computing kpt #: 327 total cpu time spent up to now is 134.8 secs Computing kpt #: 328 total cpu time spent up to now is 135.2 secs Computing kpt #: 329 total cpu time spent up to now is 135.6 secs Computing kpt #: 330 total cpu time spent up to now is 135.9 secs Computing kpt #: 331 total cpu time spent up to now is 136.4 secs Computing kpt #: 332 total cpu time spent up to now is 136.8 secs Computing kpt #: 333 total cpu time spent up to now is 137.2 secs Computing kpt #: 334 total cpu time spent up to now is 137.6 secs Computing kpt #: 335 total cpu time spent up to now is 138.0 secs Computing kpt #: 336 total cpu time spent up to now is 138.4 secs Computing kpt #: 337 total cpu time spent up to now is 138.8 secs ethr = 2.78E-08, avg # of iterations = 14.8 total cpu time spent up to now is 138.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4584 -10.4584 -10.4533 -10.4533 -10.4533 -10.4533 -1.6468 -1.6468 6.4165 6.4165 6.6664 6.6664 6.6664 6.6664 7.3120 7.3120 7.3120 7.3120 10.1717 10.1717 10.2473 10.2473 12.0883 12.0883 12.0883 12.0883 13.6827 13.6827 13.6959 13.6959 13.6959 13.6959 k = 0.0098-0.0057 0.0080 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4584 -10.4584 -10.4533 -10.4533 -10.4533 -10.4533 -1.6457 -1.6457 6.4158 6.4158 6.6651 6.6651 6.6671 6.6671 7.3110 7.3110 7.3129 7.3129 10.1307 10.1307 10.2804 10.2804 12.0754 12.0754 12.0914 12.0914 13.6807 13.6807 13.7029 13.7029 13.7058 13.7058 k = 0.0196-0.0113 0.0160 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4583 -10.4583 -10.4533 -10.4533 -10.4533 -10.4533 -1.6425 -1.6425 6.4139 6.4139 6.6626 6.6626 6.6678 6.6678 7.3097 7.3097 7.3135 7.3135 10.0608 10.0608 10.3265 10.3265 12.0382 12.0382 12.1014 12.1014 13.6579 13.6579 13.7298 13.7298 13.7453 13.7453 k = 0.0294-0.0170 0.0240 ( 3151 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4095 -32.4095 -13.4208 -13.4208 -13.4207 -13.4207 -10.4584 -10.4584 -10.4534 -10.4534 -10.4533 -10.4533 -1.6371 -1.6371 6.4106 6.4106 6.6587 6.6587 6.6687 6.6687 7.3082 7.3082 7.3141 7.3141 9.9834 9.9834 10.3638 10.3638 11.9801 11.9801 12.1191 12.1191 13.6193 13.6193 13.7716 13.7716 13.8112 13.8112 k = 0.0392-0.0226 0.0320 ( 3163 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4209 -13.4208 -13.4208 -10.4585 -10.4585 -10.4535 -10.4535 -10.4534 -10.4534 -1.6297 -1.6297 6.4058 6.4058 6.6536 6.6536 6.6700 6.6700 7.3064 7.3064 7.3145 7.3145 9.9022 9.9022 10.3886 10.3886 11.9053 11.9053 12.1459 12.1459 13.5676 13.5676 13.8280 13.8280 13.8972 13.8972 k = 0.0490-0.0283 0.0400 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4210 -13.4210 -13.4209 -13.4209 -10.4586 -10.4586 -10.4536 -10.4536 -10.4534 -10.4534 -1.6200 -1.6200 6.3993 6.3993 6.6474 6.6474 6.6717 6.6717 7.3043 7.3043 7.3148 7.3148 9.8187 9.8187 10.3994 10.3994 11.8182 11.8182 12.1828 12.1828 13.5050 13.5050 13.8976 13.8976 13.9989 13.9989 k = 0.0588-0.0340 0.0480 ( 3175 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4209 -13.4208 -13.4208 -10.4584 -10.4584 -10.4536 -10.4536 -10.4533 -10.4533 -1.6083 -1.6083 6.3907 6.3907 6.6405 6.6405 6.6737 6.6737 7.3020 7.3020 7.3151 7.3151 9.7340 9.7340 10.3956 10.3956 11.7220 11.7220 12.2302 12.2302 13.4339 13.4339 13.9787 13.9787 14.1127 14.1127 k = 0.0686-0.0396 0.0560 ( 3175 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4209 -13.4208 -13.4208 -10.4583 -10.4583 -10.4535 -10.4535 -10.4532 -10.4532 -1.5945 -1.5945 6.3799 6.3799 6.6332 6.6332 6.6761 6.6761 7.2993 7.2993 7.3153 7.3153 9.6490 9.6490 10.3777 10.3777 11.6195 11.6195 12.2876 12.2876 13.3565 13.3565 14.0696 14.0696 14.2358 14.2358 k = 0.0784-0.0453 0.0640 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4209 -13.4208 -13.4208 -10.4583 -10.4583 -10.4535 -10.4535 -10.4531 -10.4531 -1.5786 -1.5786 6.3664 6.3664 6.6258 6.6258 6.6789 6.6789 7.2962 7.2962 7.3156 7.3156 9.5642 9.5642 10.3468 10.3468 11.5128 11.5128 12.3531 12.3531 13.2752 13.2752 14.1690 14.1690 14.3660 14.3660 k = 0.0882-0.0509 0.0720 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4209 -13.4207 -13.4207 -10.4581 -10.4581 -10.4535 -10.4535 -10.4530 -10.4530 -1.5607 -1.5607 6.3500 6.3500 6.6188 6.6188 6.6821 6.6821 7.2929 7.2929 7.3158 7.3158 9.4801 9.4801 10.3045 10.3045 11.4033 11.4033 12.4237 12.4237 13.1929 13.1929 14.2753 14.2753 14.5017 14.5017 k = 0.0980-0.0566 0.0800 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4208 -13.4208 -13.4206 -13.4206 -10.4580 -10.4580 -10.4534 -10.4534 -10.4528 -10.4528 -1.5407 -1.5407 6.3304 6.3304 6.6124 6.6124 6.6857 6.6857 7.2892 7.2892 7.3161 7.3161 9.3971 9.3971 10.2525 10.2525 11.2922 11.2922 12.4940 12.4940 13.1142 13.1142 14.3874 14.3874 14.6417 14.6417 k = 0.1078-0.0623 0.0881 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4207 -13.4207 -13.4204 -13.4204 -10.4578 -10.4578 -10.4532 -10.4532 -10.4526 -10.4526 -1.5188 -1.5188 6.3075 6.3075 6.6070 6.6070 6.6896 6.6896 7.2851 7.2851 7.3163 7.3163 9.3154 9.3154 10.1924 10.1924 11.1803 11.1803 12.5543 12.5543 13.0474 13.0474 14.5040 14.5040 14.7847 14.7847 k = 0.1176-0.0679 0.0961 ( 3195 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4208 -13.4208 -13.4205 -13.4205 -10.4578 -10.4578 -10.4534 -10.4534 -10.4524 -10.4524 -1.4949 -1.4949 6.2812 6.2812 6.6025 6.6025 6.6940 6.6940 7.2807 7.2807 7.3167 7.3167 9.2351 9.2351 10.1259 10.1259 11.0681 11.0681 12.5872 12.5872 13.0079 13.0079 14.6236 14.6236 14.9298 14.9298 k = 0.1275-0.0736 0.1041 ( 3195 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4097 -32.4097 -13.4207 -13.4207 -13.4203 -13.4203 -10.4577 -10.4577 -10.4533 -10.4533 -10.4522 -10.4522 -1.4691 -1.4691 6.2517 6.2517 6.5992 6.5992 6.6988 6.6988 7.2760 7.2760 7.3171 7.3171 9.1564 9.1564 10.0544 10.0544 10.9563 10.9563 12.5748 12.5748 13.0115 13.0115 14.7429 14.7429 15.0610 15.0610 k = 0.1373-0.0792 0.1121 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4097 -32.4097 -13.4207 -13.4207 -13.4201 -13.4201 -10.4576 -10.4576 -10.4531 -10.4531 -10.4519 -10.4519 -1.4414 -1.4414 6.2190 6.2190 6.5970 6.5970 6.7040 6.7040 7.2709 7.2709 7.3175 7.3175 9.0793 9.0793 9.9789 9.9789 10.8451 10.8451 12.5200 12.5200 13.0522 13.0522 14.8426 14.8426 14.9924 14.9924 k = 0.1471-0.0849 0.1201 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4097 -32.4097 -13.4206 -13.4206 -13.4199 -13.4199 -10.4574 -10.4574 -10.4530 -10.4530 -10.4515 -10.4515 -1.4119 -1.4119 6.1833 6.1833 6.5958 6.5958 6.7096 6.7096 7.2655 7.2655 7.3180 7.3180 9.0039 9.0039 9.9004 9.9004 10.7349 10.7349 12.4406 12.4406 13.1086 13.1086 14.8313 14.8313 15.0418 15.0418 k = 0.1569-0.0906 0.1281 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4097 -32.4097 -13.4205 -13.4205 -13.4196 -13.4196 -10.4573 -10.4573 -10.4528 -10.4528 -10.4510 -10.4510 -1.3807 -1.3807 6.1449 6.1449 6.5957 6.5957 6.7157 6.7157 7.2598 7.2598 7.3186 7.3186 8.9301 8.9301 9.8198 9.8198 10.6259 10.6259 12.3491 12.3491 13.1638 13.1638 14.7734 14.7734 15.1619 15.1619 k = 0.1667-0.0962 0.1361 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4097 -32.4097 -13.4205 -13.4205 -13.4195 -13.4195 -10.4573 -10.4573 -10.4528 -10.4528 -10.4507 -10.4507 -1.3477 -1.3477 6.1040 6.1040 6.5965 6.5965 6.7222 6.7222 7.2537 7.2537 7.3193 7.3193 8.8578 8.8578 9.7377 9.7377 10.5183 10.5183 12.2514 12.2514 13.2072 13.2072 14.7334 14.7334 15.2923 15.2923 k = 0.1765-0.1019 0.1441 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4097 -32.4097 -13.4204 -13.4204 -13.4193 -13.4193 -10.4572 -10.4572 -10.4526 -10.4526 -10.4502 -10.4502 -1.3131 -1.3131 6.0608 6.0608 6.5982 6.5982 6.7291 6.7291 7.2473 7.2473 7.3200 7.3200 8.7871 8.7871 9.6545 9.6545 10.4122 10.4122 12.1508 12.1508 13.2323 13.2323 14.7219 14.7219 15.4261 15.4261 k = 0.1863-0.1075 0.1521 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4203 -13.4203 -13.4192 -13.4192 -10.4572 -10.4572 -10.4527 -10.4527 -10.4497 -10.4497 -1.2769 -1.2769 6.0156 6.0156 6.6007 6.6007 6.7365 6.7365 7.2406 7.2406 7.3208 7.3208 8.7177 8.7177 9.5709 9.5709 10.3079 10.3079 12.0487 12.0487 13.2359 13.2359 14.7413 14.7413 15.5618 15.5618 k = 0.1961-0.1132 0.1601 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4202 -13.4202 -13.4191 -13.4191 -10.4571 -10.4571 -10.4526 -10.4526 -10.4492 -10.4492 -1.2393 -1.2393 5.9686 5.9686 6.6040 6.6040 6.7443 6.7443 7.2335 7.2335 7.3216 7.3216 8.6497 8.6497 9.4871 9.4871 10.2052 10.2052 11.9463 11.9463 13.2187 13.2187 14.7905 14.7905 15.6989 15.6989 k = 0.2059-0.1189 0.1681 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4201 -13.4201 -13.4189 -13.4189 -10.4571 -10.4571 -10.4525 -10.4525 -10.4487 -10.4487 -1.2002 -1.2002 5.9201 5.9201 6.6080 6.6080 6.7526 6.7526 7.2262 7.2262 7.3225 7.3225 8.5830 8.5830 9.4035 9.4035 10.1045 10.1045 11.8444 11.8444 13.1841 13.1841 14.8652 14.8652 15.8373 15.8373 k = 0.2157-0.1245 0.1761 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4201 -13.4201 -13.4188 -13.4188 -10.4571 -10.4571 -10.4525 -10.4525 -10.4482 -10.4482 -1.1598 -1.1598 5.8703 5.8703 6.6128 6.6128 6.7613 6.7613 7.2186 7.2186 7.3235 7.3235 8.5174 8.5174 9.3202 9.3202 10.0057 10.0057 11.7436 11.7436 13.1364 13.1364 14.9605 14.9605 15.9769 15.9769 k = 0.2255-0.1302 0.1841 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4200 -13.4200 -13.4186 -13.4186 -10.4571 -10.4571 -10.4524 -10.4524 -10.4477 -10.4477 -1.1182 -1.1182 5.8194 5.8194 6.6182 6.6182 6.7705 6.7705 7.2107 7.2107 7.3246 7.3246 8.4529 8.4529 9.2375 9.2375 9.9090 9.9090 11.6444 11.6444 13.0800 13.0800 15.0713 15.0713 16.1177 16.1177 k = 0.2353-0.1358 0.1921 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4199 -13.4199 -13.4184 -13.4184 -10.4571 -10.4571 -10.4524 -10.4524 -10.4471 -10.4471 -1.0755 -1.0755 5.7677 5.7677 6.6242 6.6242 6.7800 6.7800 7.2025 7.2025 7.3257 7.3257 8.3896 8.3896 9.1556 9.1556 9.8144 9.8144 11.5472 11.5472 13.0183 13.0183 15.1934 15.1934 16.2600 16.2600 k = 0.2451-0.1415 0.2001 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4197 -13.4197 -13.4180 -13.4180 -10.4570 -10.4570 -10.4522 -10.4522 -10.4464 -10.4464 -1.0318 -1.0318 5.7152 5.7152 6.6309 6.6309 6.7900 6.7900 7.1941 7.1941 7.3268 7.3268 8.3272 8.3272 9.0747 9.0747 9.7219 9.7219 11.4526 11.4526 12.9540 12.9540 15.3237 15.3237 16.4040 16.4040 k = 0.2549-0.1472 0.2081 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4196 -13.4196 -13.4178 -13.4178 -10.4570 -10.4570 -10.4521 -10.4521 -10.4458 -10.4458 -0.9871 -0.9871 5.6623 5.6623 6.6382 6.6382 6.8003 6.8003 7.1854 7.1854 7.3280 7.3280 8.2660 8.2660 8.9948 8.9948 9.6317 9.6317 11.3609 11.3609 12.8889 12.8889 15.4596 15.4596 16.5499 16.5499 k = 0.2647-0.1528 0.2161 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4195 -13.4195 -13.4177 -13.4177 -10.4570 -10.4570 -10.4521 -10.4521 -10.4452 -10.4452 -0.9418 -0.9418 5.6092 5.6092 6.6461 6.6461 6.8110 6.8110 7.1766 7.1766 7.3292 7.3292 8.2058 8.2058 8.9160 8.9160 9.5437 9.5437 11.2723 11.2723 12.8244 12.8244 15.5990 15.5990 16.6981 16.6981 k = 0.2745-0.1585 0.2241 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4195 -13.4195 -13.4176 -13.4176 -10.4571 -10.4571 -10.4521 -10.4521 -10.4447 -10.4447 -0.8958 -0.8958 5.5559 5.5559 6.6545 6.6545 6.8219 6.8219 7.1675 7.1675 7.3305 7.3305 8.1469 8.1469 8.8386 8.8386 9.4580 9.4580 11.1872 11.1872 12.7612 12.7612 15.7404 15.7404 16.8489 16.8489 k = 0.2843-0.1641 0.2321 ( 3170 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4194 -13.4194 -13.4171 -13.4171 -10.4571 -10.4571 -10.4517 -10.4517 -10.4440 -10.4440 -0.8494 -0.8494 5.5028 5.5028 6.6635 6.6635 6.8330 6.8330 7.1584 7.1584 7.3318 7.3318 8.0892 8.0892 8.7626 8.7626 9.3748 9.3748 11.1058 11.1058 12.7000 12.7000 15.8827 15.8827 17.0025 17.0025 k = 0.2941-0.1698 0.2401 ( 3166 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4192 -13.4192 -13.4169 -13.4169 -10.4570 -10.4570 -10.4517 -10.4517 -10.4433 -10.4433 -0.8027 -0.8027 5.4499 5.4499 6.6731 6.6731 6.8442 6.8442 7.1493 7.1493 7.3331 7.3331 8.0330 8.0330 8.6881 8.6881 9.2939 9.2939 11.0283 11.0283 12.6412 12.6412 16.0248 16.0248 17.1592 17.1592 k = 0.3039-0.1755 0.2482 ( 3166 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4191 -13.4191 -13.4167 -13.4167 -10.4570 -10.4570 -10.4517 -10.4517 -10.4428 -10.4428 -0.7558 -0.7558 5.3974 5.3974 6.6832 6.6832 6.8553 6.8553 7.1403 7.1403 7.3344 7.3344 7.9784 7.9784 8.6152 8.6152 9.2156 9.2156 10.9548 10.9548 12.5850 12.5850 16.1660 16.1660 17.3193 17.3193 k = 0.3137-0.1811 0.2562 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4191 -13.4191 -13.4167 -13.4167 -10.4571 -10.4571 -10.4517 -10.4517 -10.4423 -10.4423 -0.7090 -0.7090 5.3456 5.3456 6.6937 6.6937 6.8661 6.8661 7.1315 7.1315 7.3358 7.3358 7.9255 7.9255 8.5440 8.5440 9.1398 9.1398 10.8854 10.8854 12.5317 12.5317 16.3056 16.3056 17.4827 17.4827 k = 0.3235-0.1868 0.2642 ( 3166 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4189 -13.4189 -13.4165 -13.4165 -10.4570 -10.4570 -10.4517 -10.4517 -10.4417 -10.4417 -0.6625 -0.6625 5.2946 5.2946 6.7047 6.7047 6.8764 6.8764 7.1233 7.1233 7.3373 7.3373 7.8747 7.8747 8.4746 8.4746 9.0666 9.0666 10.8202 10.8202 12.4812 12.4812 16.4432 16.4432 17.6497 17.6497 k = 0.3333-0.1925 0.2722 ( 3158 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4188 -13.4188 -13.4162 -13.4162 -10.4570 -10.4570 -10.4515 -10.4515 -10.4410 -10.4410 -0.6165 -0.6165 5.2446 5.2446 6.7161 6.7161 6.8858 6.8858 7.1158 7.1158 7.3387 7.3387 7.8262 7.8262 8.4071 8.4071 8.9961 8.9961 10.7592 10.7592 12.4337 12.4337 16.5783 16.5783 17.8200 17.8200 k = 0.3431-0.1981 0.2802 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4189 -13.4189 -13.4164 -13.4164 -10.4572 -10.4572 -10.4518 -10.4518 -10.4407 -10.4407 -0.5711 -0.5711 5.1958 5.1958 6.7278 6.7278 6.8938 6.8938 7.1096 7.1096 7.3402 7.3402 7.7801 7.7801 8.3415 8.3415 8.9284 8.9284 10.7024 10.7024 12.3892 12.3892 16.7105 16.7105 17.9933 17.9933 k = 0.3529-0.2038 0.2882 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4190 -13.4190 -13.4164 -13.4164 -10.4574 -10.4574 -10.4519 -10.4519 -10.4404 -10.4404 -0.5267 -0.5267 5.1483 5.1483 6.7398 6.7398 6.9000 6.9000 7.1052 7.1052 7.3417 7.3417 7.7368 7.7368 8.2780 8.2780 8.8635 8.8635 10.6497 10.6497 12.3476 12.3476 16.8397 16.8397 18.1668 18.1668 k = 0.3627-0.2094 0.2962 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4189 -13.4189 -13.4163 -13.4163 -10.4574 -10.4574 -10.4519 -10.4519 -10.4399 -10.4399 -0.4834 -0.4834 5.1024 5.1024 6.7519 6.7519 6.9039 6.9039 7.1031 7.1031 7.3434 7.3434 7.6963 7.6963 8.2168 8.2168 8.8016 8.8016 10.6010 10.6010 12.3089 12.3089 16.9655 16.9655 18.3039 18.3039 k = 0.3725-0.2151 0.3042 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4189 -13.4189 -13.4161 -13.4161 -10.4574 -10.4574 -10.4519 -10.4519 -10.4394 -10.4394 -0.4415 -0.4415 5.0583 5.0583 6.7641 6.7641 6.9050 6.9050 7.1036 7.1036 7.3450 7.3450 7.6590 7.6590 8.1578 8.1578 8.7427 8.7427 10.5564 10.5564 12.2731 12.2731 17.0875 17.0875 18.4266 18.4266 k = 0.3824-0.2208 0.3122 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4187 -13.4187 -13.4160 -13.4160 -10.4573 -10.4573 -10.4518 -10.4518 -10.4389 -10.4389 -0.4013 -0.4013 5.0161 5.0161 6.7762 6.7762 6.9033 6.9033 7.1070 7.1070 7.3468 7.3468 7.6249 7.6249 8.1012 8.1012 8.6871 8.6871 10.5156 10.5156 12.2402 12.2402 17.2056 17.2056 18.5481 18.5481 k = 0.3922-0.2264 0.3202 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4187 -13.4187 -13.4159 -13.4159 -10.4573 -10.4573 -10.4518 -10.4518 -10.4386 -10.4386 -0.3630 -0.3630 4.9762 4.9762 6.7881 6.7881 6.8990 6.8990 7.1132 7.1132 7.3488 7.3488 7.5940 7.5940 8.0472 8.0472 8.6348 8.6348 10.4786 10.4786 12.2101 12.2101 17.3192 17.3192 18.6687 18.6687 k = 0.4020-0.2321 0.3282 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4186 -13.4186 -13.4158 -13.4158 -10.4573 -10.4573 -10.4518 -10.4518 -10.4382 -10.4382 -0.3269 -0.3269 4.9387 4.9387 6.7993 6.7993 6.8929 6.8929 7.1216 7.1216 7.3509 7.3509 7.5664 7.5664 7.9959 7.9959 8.5860 8.5860 10.4452 10.4452 12.1828 12.1828 17.4279 17.4279 18.7881 18.7881 k = 0.4118-0.2377 0.3362 ( 3198 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4186 -13.4186 -13.4159 -13.4159 -10.4574 -10.4574 -10.4520 -10.4520 -10.4380 -10.4380 -0.2933 -0.2933 4.9039 4.9039 6.8096 6.8096 6.8857 6.8857 7.1318 7.1318 7.3532 7.3532 7.5421 7.5421 7.9474 7.9474 8.5409 8.5409 10.4154 10.4154 12.1582 12.1582 17.5309 17.5309 18.9056 18.9056 k = 0.4216-0.2434 0.3442 ( 3198 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4186 -13.4186 -13.4158 -13.4158 -10.4574 -10.4574 -10.4520 -10.4520 -10.4377 -10.4377 -0.2623 -0.2623 4.8720 4.8720 6.8183 6.8183 6.8786 6.8786 7.1432 7.1432 7.3559 7.3559 7.5209 7.5209 7.9020 7.9020 8.4997 8.4997 10.3891 10.3891 12.1363 12.1363 17.6277 17.6277 19.0206 19.0206 k = 0.4314-0.2491 0.3522 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4185 -13.4156 -13.4156 -10.4574 -10.4574 -10.4519 -10.4519 -10.4374 -10.4374 -0.2343 -0.2343 4.8432 4.8432 6.8242 6.8242 6.8733 6.8733 7.1551 7.1551 7.3589 7.3589 7.5027 7.5027 7.8599 7.8599 8.4626 8.4626 10.3661 10.3661 12.1171 12.1171 17.7171 17.7171 19.1319 19.1319 k = 0.4412-0.2547 0.3602 ( 3214 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4099 -13.4187 -13.4187 -13.4158 -13.4158 -10.4576 -10.4576 -10.4522 -10.4522 -10.4373 -10.4373 -0.2095 -0.2095 4.8178 4.8178 6.8261 6.8261 6.8713 6.8713 7.1669 7.1669 7.3623 7.3623 7.4872 7.4872 7.8216 7.8216 8.4298 8.4298 10.3463 10.3463 12.1005 12.1005 17.7982 17.7982 19.2380 19.2380 k = 0.4510-0.2604 0.3682 ( 3214 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4099 -13.4187 -13.4187 -13.4158 -13.4158 -10.4576 -10.4576 -10.4522 -10.4522 -10.4371 -10.4371 -0.1881 -0.1881 4.7958 4.7958 6.8241 6.8241 6.8729 6.8729 7.1782 7.1782 7.3661 7.3661 7.4743 7.4743 7.7874 7.7874 8.4016 8.4016 10.3298 10.3298 12.0865 12.0865 17.8700 17.8700 19.3371 19.3371 k = 0.4608-0.2660 0.3762 ( 3214 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4099 -13.4186 -13.4186 -13.4157 -13.4157 -10.4576 -10.4576 -10.4522 -10.4522 -10.4369 -10.4369 -0.1703 -0.1703 4.7776 4.7776 6.8199 6.8199 6.8764 6.8764 7.1883 7.1883 7.3703 7.3703 7.4638 7.4638 7.7579 7.7579 8.3781 8.3781 10.3164 10.3164 12.0751 12.0751 17.9310 17.9310 19.4263 19.4263 k = 0.4706-0.2717 0.3842 ( 3214 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4099 -13.4186 -13.4186 -13.4157 -13.4157 -10.4576 -10.4576 -10.4522 -10.4522 -10.4368 -10.4368 -0.1563 -0.1563 4.7633 4.7633 6.8155 6.8155 6.8802 6.8802 7.1967 7.1967 7.3745 7.3745 7.4554 7.4554 7.7338 7.7338 8.3596 8.3596 10.3060 10.3060 12.0662 12.0662 17.9801 17.9801 19.5023 19.5023 k = 0.4804-0.2774 0.3922 ( 3226 PWs) bands (ev): -65.7563 -65.7562 -32.6979 -32.6979 -32.4100 -32.4100 -32.4099 -32.4099 -13.4187 -13.4187 -13.4158 -13.4158 -10.4578 -10.4578 -10.4523 -10.4523 -10.4368 -10.4368 -0.1462 -0.1462 4.7530 4.7530 6.8118 6.8118 6.8834 6.8834 7.2030 7.2030 7.3784 7.3784 7.4492 7.4492 7.7158 7.7158 8.3462 8.3462 10.2986 10.2986 12.0599 12.0599 18.0161 18.0161 19.5610 19.5610 k = 0.4902-0.2830 0.4002 ( 3226 PWs) bands (ev): -65.7562 -65.7562 -32.6979 -32.6979 -32.4101 -32.4101 -32.4099 -32.4099 -13.4186 -13.4186 -13.4159 -13.4159 -10.4577 -10.4577 -10.4524 -10.4524 -10.4368 -10.4368 -0.1401 -0.1401 4.7467 4.7467 6.8094 6.8094 6.8855 6.8855 7.2069 7.2069 7.3812 7.3812 7.4453 7.4453 7.7046 7.7046 8.3381 8.3381 10.2942 10.2942 12.0562 12.0562 18.0382 18.0382 19.5985 19.5985 k = 0.5000-0.2887 0.4082 ( 3218 PWs) bands (ev): -65.7562 -65.7562 -32.6979 -32.6979 -32.4101 -32.4101 -32.4099 -32.4099 -13.4185 -13.4185 -13.4158 -13.4158 -10.4576 -10.4576 -10.4523 -10.4523 -10.4367 -10.4367 -0.1381 -0.1381 4.7446 4.7446 6.8086 6.8086 6.8862 6.8862 7.2083 7.2083 7.3823 7.3823 7.4439 7.4439 7.7009 7.7009 8.3354 8.3354 10.2927 10.2927 12.0549 12.0549 18.0456 18.0456 19.6115 19.6115 k = 0.5000-0.2887 0.4082 ( 3218 PWs) bands (ev): -65.7562 -65.7562 -32.6979 -32.6979 -32.4101 -32.4101 -32.4099 -32.4099 -13.4185 -13.4185 -13.4158 -13.4158 -10.4576 -10.4576 -10.4523 -10.4523 -10.4367 -10.4367 -0.1381 -0.1381 4.7446 4.7446 6.8086 6.8086 6.8862 6.8862 7.2083 7.2083 7.3823 7.3823 7.4439 7.4439 7.7009 7.7009 8.3354 8.3354 10.2927 10.2927 12.0549 12.0549 18.0456 18.0456 19.6115 19.6115 k = 0.5000-0.2776 0.4161 ( 3226 PWs) bands (ev): -65.7562 -65.7562 -32.6979 -32.6979 -32.4101 -32.4101 -32.4099 -32.4099 -13.4187 -13.4186 -13.4159 -13.4159 -10.4577 -10.4576 -10.4524 -10.4524 -10.4368 -10.4367 -0.1381 -0.1378 4.7401 4.7514 6.8063 6.8083 6.8823 6.8895 7.2055 7.2104 7.3769 7.3853 7.4322 7.4503 7.6931 7.7108 8.3305 8.3338 10.2992 10.3028 12.0511 12.0711 18.0193 18.0512 19.5753 19.5855 k = 0.5000-0.2665 0.4240 ( 3218 PWs) bands (ev): -65.7562 -65.7562 -32.6979 -32.6979 -32.4101 -32.4101 -32.4099 -32.4099 -13.4186 -13.4184 -13.4159 -13.4158 -10.4576 -10.4574 -10.4524 -10.4523 -10.4368 -10.4367 -0.1379 -0.1374 4.7379 4.7605 6.8016 6.8058 6.8780 6.8921 7.2020 7.2119 7.3664 7.3870 7.4181 7.4508 7.6875 7.7219 8.3193 8.3261 10.3222 10.3294 12.0598 12.0994 17.9730 18.0346 19.4872 19.5125 k = 0.5000-0.2554 0.4318 ( 3210 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4183 -13.4158 -13.4157 -10.4574 -10.4572 -10.4523 -10.4522 -10.4369 -10.4368 -0.1376 -0.1368 4.7379 4.7719 6.7943 6.8008 6.8734 6.8936 7.1979 7.2126 7.3472 7.3880 7.4068 7.4463 7.6837 7.7325 8.3025 8.3133 10.3609 10.3717 12.0808 12.1397 17.9063 17.9936 19.3683 19.4181 k = 0.5000-0.2443 0.4397 ( 3206 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4182 -13.4158 -13.4157 -10.4574 -10.4570 -10.4522 -10.4521 -10.4369 -10.4368 -0.1370 -0.1361 4.7400 4.7857 6.7843 6.7931 6.8684 6.8938 7.1930 7.2120 7.3196 7.3884 7.3998 7.4382 7.6804 7.7411 8.2810 8.2969 10.4144 10.4288 12.1142 12.1914 17.8189 17.9257 19.2345 19.3224 k = 0.5000-0.2332 0.4475 ( 3202 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4181 -13.4158 -13.4156 -10.4573 -10.4568 -10.4521 -10.4520 -10.4371 -10.4369 -0.1363 -0.1351 4.7442 4.8018 6.7717 6.7826 6.8631 6.8924 7.1873 7.2090 7.2887 7.3879 7.3953 7.4283 7.6768 7.7462 8.2564 8.2784 10.4814 10.4994 12.1595 12.2542 17.7108 17.8298 19.0941 19.2374 k = 0.5000-0.2221 0.4554 ( 3202 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4181 -13.4158 -13.4156 -10.4572 -10.4567 -10.4521 -10.4519 -10.4372 -10.4370 -0.1354 -0.1340 4.7504 4.8204 6.7564 6.7684 6.8573 6.8891 7.1809 7.2003 7.2611 7.3858 7.3920 7.4182 7.6718 7.7468 8.2300 8.2594 10.5607 10.5824 12.2165 12.3276 17.5827 17.7066 18.9498 19.1684 k = 0.5000-0.2110 0.4632 ( 3206 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4181 -13.4159 -13.4157 -10.4572 -10.4565 -10.4521 -10.4519 -10.4375 -10.4372 -0.1344 -0.1328 4.7585 4.8413 6.7386 6.7499 6.8508 6.8838 7.1736 7.1814 7.2440 7.3811 7.3890 7.4101 7.6649 7.7425 8.2032 8.2414 10.6511 10.6765 12.2846 12.4110 17.4364 17.5592 18.8012 19.1151 k = 0.5000-0.1999 0.4711 ( 3202 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4180 -13.4159 -13.4156 -10.4570 -10.4563 -10.4519 -10.4518 -10.4377 -10.4374 -0.1332 -0.1314 4.7684 4.8647 6.7183 6.7262 6.8435 6.8762 7.1554 7.1657 7.2367 7.3730 7.3862 7.4054 7.6557 7.7331 8.1774 8.2253 10.7515 10.7805 12.3634 12.5038 17.2744 17.3921 18.6462 19.0715 k = 0.5000-0.1887 0.4789 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4184 -13.4178 -13.4159 -13.4157 -10.4569 -10.4560 -10.4518 -10.4517 -10.4380 -10.4376 -0.1320 -0.1299 4.7801 4.8904 6.6958 6.6962 6.8351 6.8665 7.1293 7.1571 7.2336 7.3629 7.3832 7.4033 7.6442 7.7191 8.1534 8.2117 10.8610 10.8935 12.4522 12.6057 17.0993 17.2097 18.4829 18.9941 k = 0.5000-0.1776 0.4868 ( 3192 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4183 -13.4177 -13.4158 -13.4156 -10.4567 -10.4557 -10.4516 -10.4515 -10.4382 -10.4378 -0.1306 -0.1283 4.7934 4.9185 6.6595 6.6711 6.8256 6.8549 7.1067 7.1480 7.2321 7.3523 7.3798 7.4025 7.6305 7.7012 8.1320 8.2008 10.9785 11.0146 12.5504 12.7160 16.9139 17.0161 18.3104 18.8003 k = 0.5000-0.1665 0.4946 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4182 -13.4175 -13.4158 -13.4155 -10.4565 -10.4553 -10.4513 -10.4513 -10.4384 -10.4380 -0.1292 -0.1267 4.8081 4.9490 6.6161 6.6445 6.8150 6.8420 7.0886 7.1387 7.2312 7.3421 7.3761 7.4024 7.6151 7.6805 8.1134 8.1924 11.1035 11.1431 12.6575 12.8342 16.7208 16.8146 18.1289 18.5755 k = 0.5000-0.1554 0.5025 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4182 -13.4174 -13.4158 -13.4156 -10.4564 -10.4550 -10.4512 -10.4512 -10.4388 -10.4383 -0.1277 -0.1250 4.8240 4.9818 6.5665 6.6163 6.8032 6.8284 7.0748 7.1295 7.2306 7.3327 7.3719 7.4026 7.5986 7.6581 8.0977 8.1861 11.2352 11.2782 12.7728 12.9598 16.5221 16.6075 17.9397 18.3466 k = 0.5000-0.1443 0.5103 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4182 -13.4174 -13.4159 -13.4156 -10.4563 -10.4548 -10.4510 -10.4509 -10.4391 -10.4386 -0.1261 -0.1233 4.8411 5.0170 6.5118 6.5867 6.7903 6.8143 7.0646 7.1205 7.2301 7.3242 7.3672 7.4031 7.5817 7.6351 8.0848 8.1816 11.3731 11.4195 12.8956 13.0925 16.3194 16.3968 17.7442 18.1172 k = 0.5000-0.1332 0.5182 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4172 -13.4159 -13.4156 -10.4561 -10.4545 -10.4508 -10.4506 -10.4395 -10.4389 -0.1246 -0.1216 4.8590 5.0545 6.4529 6.5562 6.7765 6.8000 7.0572 7.1119 7.2297 7.3166 7.3618 7.4037 7.5652 7.6122 8.0742 8.1783 11.5167 11.5666 13.0253 13.2317 16.1144 16.1839 17.5441 17.8884 k = 0.5000-0.1221 0.5260 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4171 -13.4159 -13.4156 -10.4560 -10.4542 -10.4507 -10.4504 -10.4399 -10.4393 -0.1231 -0.1199 4.8775 5.0942 6.3910 6.5251 6.7619 6.7858 7.0518 7.1040 7.2292 7.3099 7.3559 7.4045 7.5496 7.5902 8.0658 8.1759 11.6655 11.7189 13.1613 13.3772 15.9082 15.9698 17.3408 17.6608 k = 0.5000-0.1110 0.5339 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4171 -13.4160 -13.4157 -10.4560 -10.4541 -10.4505 -10.4501 -10.4403 -10.4397 -0.1216 -0.1183 4.8964 5.1362 6.3268 6.4940 6.7469 6.7718 7.0480 7.0969 7.2288 7.3039 7.3495 7.4054 7.5355 7.5696 8.0591 8.1743 11.8192 11.8761 13.3028 13.5285 15.7021 15.7553 17.1356 17.4348 k = 0.5000-0.0999 0.5417 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4170 -13.4160 -13.4157 -10.4560 -10.4539 -10.4502 -10.4497 -10.4407 -10.4400 -0.1202 -0.1167 4.9152 5.1804 6.2611 6.4633 6.7319 6.7582 7.0453 7.0905 7.2283 7.2985 7.3427 7.4064 7.5232 7.5506 8.0539 8.1731 11.9774 12.0381 13.4487 13.6853 15.4972 15.5412 16.9296 17.2108 k = 0.5000-0.0888 0.5496 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4169 -13.4161 -13.4158 -10.4559 -10.4537 -10.4499 -10.4493 -10.4412 -10.4404 -0.1189 -0.1153 4.9338 5.2268 6.1944 6.4336 6.7171 6.7453 7.0433 7.0849 7.2278 7.2939 7.3359 7.4076 7.5126 7.5335 8.0497 8.1723 12.1397 12.2043 13.5980 13.8472 15.2950 15.3279 16.7237 16.9888 k = 0.5000-0.0777 0.5574 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4168 -13.4160 -13.4158 -10.4558 -10.4535 -10.4496 -10.4489 -10.4416 -10.4407 -0.1176 -0.1139 4.9516 5.2753 6.1272 6.4054 6.7030 6.7331 7.0420 7.0802 7.2272 7.2898 7.3292 7.4089 7.5038 7.5184 8.0465 8.1718 12.3057 12.3747 13.7483 14.0139 15.0976 15.1160 16.5187 16.7691 k = 0.5000-0.0666 0.5653 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4167 -13.4161 -13.4158 -10.4558 -10.4534 -10.4493 -10.4485 -10.4420 -10.4411 -0.1165 -0.1127 4.9682 5.3257 6.0600 6.3793 6.6900 6.7221 7.0410 7.0762 7.2267 7.2863 7.3230 7.4103 7.4967 7.5051 8.0441 8.1714 12.4750 12.5489 13.8952 14.1848 14.9062 14.9096 16.3153 16.5518 k = 0.5000-0.0555 0.5731 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4179 -13.4167 -13.4161 -13.4159 -10.4558 -10.4533 -10.4491 -10.4481 -10.4425 -10.4414 -0.1155 -0.1117 4.9834 5.3782 5.9929 6.3560 6.6784 6.7123 7.0404 7.0729 7.2261 7.2834 7.3174 7.4118 7.4910 7.4938 8.0422 8.1711 12.6471 12.7267 14.0269 14.3578 14.7008 14.7428 16.1146 16.3372 k = 0.5000-0.0444 0.5810 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4180 -13.4167 -13.4161 -13.4159 -10.4557 -10.4532 -10.4489 -10.4477 -10.4430 -10.4418 -0.1147 -0.1108 4.9965 5.4325 5.9265 6.3359 6.6685 6.7039 7.0400 7.0702 7.2256 7.2809 7.3126 7.4133 7.4844 7.4867 8.0408 8.1709 12.8210 12.9077 14.1081 14.4615 14.5712 14.6322 15.9176 16.1254 k = 0.5000-0.0333 0.5888 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4166 -13.4161 -13.4160 -10.4557 -10.4531 -10.4486 -10.4473 -10.4434 -10.4421 -0.1141 -0.1101 5.0072 5.4886 5.8608 6.3196 6.6605 6.6972 7.0397 7.0682 7.2251 7.2791 7.3088 7.4148 7.4769 7.4835 8.0398 8.1708 12.9952 13.0915 14.0786 14.2791 14.6379 14.7347 15.7264 15.9164 k = 0.5000-0.0222 0.5967 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4178 -13.4164 -13.4161 -13.4160 -10.4557 -10.4531 -10.4483 -10.4468 -10.4438 -10.4423 -0.1136 -0.1096 5.0151 5.5461 5.7963 6.3076 6.6547 6.6924 7.0396 7.0668 7.2248 7.2777 7.3060 7.4161 7.4713 7.4813 8.0391 8.1707 13.1659 13.2768 13.9585 14.0818 14.7389 14.9211 15.5455 15.7106 k = 0.5000-0.0111 0.6045 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4180 -13.4166 -13.4163 -13.4161 -10.4559 -10.4532 -10.4483 -10.4467 -10.4441 -10.4425 -0.1133 -0.1093 5.0200 5.6044 5.7338 6.3003 6.6511 6.6894 7.0395 7.0660 7.2245 7.2769 7.3043 7.4169 7.4679 7.4800 8.0387 8.1707 13.3204 13.4588 13.8192 13.8917 14.8623 15.1127 15.3893 15.5080 k = 0.5000 0.0000 0.6124 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4180 -13.4166 -13.4163 -13.4161 -10.4559 -10.4532 -10.4482 -10.4466 -10.4443 -10.4425 -0.1132 -0.1092 5.0217 5.6497 5.6871 6.2978 6.6499 6.6884 7.0395 7.0657 7.2244 7.2766 7.3038 7.4172 7.4668 7.4795 8.0386 8.1707 13.4006 13.5823 13.7423 13.7656 14.9289 15.2998 15.3134 15.3173 k = 0.5000 0.0000 0.6124 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4180 -13.4166 -13.4163 -13.4161 -10.4559 -10.4532 -10.4482 -10.4466 -10.4443 -10.4425 -0.1132 -0.1092 5.0217 5.6497 5.6871 6.2978 6.6499 6.6884 7.0395 7.0657 7.2244 7.2766 7.3038 7.4172 7.4668 7.4795 8.0386 8.1707 13.4006 13.5823 13.7423 13.7656 14.9289 15.2998 15.3134 15.3173 k = 0.4931 0.0120 0.6124 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4165 -13.4162 -13.4161 -10.4558 -10.4531 -10.4482 -10.4465 -10.4442 -10.4425 -0.1137 -0.1096 5.0203 5.6208 5.7150 6.2983 6.6527 6.6905 7.0370 7.0675 7.2250 7.2741 7.3070 7.4188 7.4658 7.4817 8.0395 8.1728 13.3500 13.5023 13.7858 13.8435 14.8953 15.1737 15.3583 15.4531 k = 0.4861 0.0241 0.6124 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4165 -13.4162 -13.4160 -10.4557 -10.4531 -10.4483 -10.4467 -10.4440 -10.4424 -0.1150 -0.1110 5.0163 5.5809 5.7509 6.2992 6.6614 6.6967 7.0310 7.0716 7.2264 7.2696 7.3136 7.4237 7.4637 7.4875 8.0426 8.1792 13.2325 13.3634 13.8814 13.9763 14.8283 15.0552 15.4596 15.6002 k = 0.4792 0.0361 0.6124 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4180 -13.4167 -13.4162 -13.4161 -10.4558 -10.4532 -10.4485 -10.4470 -10.4438 -10.4424 -0.1170 -0.1130 5.0099 5.5421 5.7822 6.2995 6.6757 6.7069 7.0234 7.0762 7.2279 7.2664 7.3204 7.4315 7.4627 7.4958 8.0483 8.1902 13.0861 13.2106 13.9903 14.1195 14.7635 14.9516 15.5838 15.7503 k = 0.4722 0.0481 0.6124 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4181 -13.4168 -13.4162 -13.4161 -10.4558 -10.4533 -10.4486 -10.4472 -10.4437 -10.4423 -0.1195 -0.1155 5.0015 5.5053 5.8078 6.2989 6.6948 6.7207 7.0150 7.0802 7.2289 7.2658 7.3261 7.4383 7.4674 7.5064 8.0570 8.2061 12.9256 13.0504 14.0940 14.2669 14.7179 14.8623 15.7184 15.9032 k = 0.4653 0.0601 0.6124 ( 3189 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4169 -13.4161 -13.4160 -10.4558 -10.4533 -10.4488 -10.4475 -10.4434 -10.4422 -0.1224 -0.1185 4.9915 5.4707 5.8276 6.2969 6.7174 6.7377 7.0065 7.0833 7.2291 7.2682 7.3305 7.4396 7.4820 7.5192 8.0697 8.2271 12.7577 12.8855 14.1768 14.4163 14.7045 14.7882 15.8586 16.0586 k = 0.4583 0.0722 0.6124 ( 3185 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4169 -13.4161 -13.4160 -10.4557 -10.4533 -10.4489 -10.4477 -10.4431 -10.4420 -0.1257 -0.1219 4.9805 5.4384 5.8419 6.2936 6.7414 6.7573 6.9981 7.0852 7.2289 7.2730 7.3338 7.4374 7.5028 7.5350 8.0871 8.2533 12.5868 12.7181 14.2242 14.5612 14.7092 14.7605 16.0022 16.2166 k = 0.4514 0.0842 0.6124 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4170 -13.4161 -13.4160 -10.4558 -10.4534 -10.4491 -10.4480 -10.4429 -10.4419 -0.1291 -0.1254 4.9688 5.4086 5.8516 6.2891 6.7644 6.7797 6.9898 7.0860 7.2285 7.2790 7.3365 7.4339 7.5247 7.5550 8.1103 8.2849 12.4157 12.5500 14.2360 14.6224 14.7537 14.8344 16.1475 16.3768 k = 0.4444 0.0962 0.6124 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4171 -13.4161 -13.4159 -10.4557 -10.4535 -10.4493 -10.4482 -10.4426 -10.4417 -0.1326 -0.1289 4.9569 5.3811 5.8574 6.2839 6.7852 6.8036 6.9819 7.0858 7.2282 7.2852 7.3392 7.4301 7.5447 7.5793 8.1404 8.3217 12.2471 12.3834 14.2255 14.5839 14.8999 14.9475 16.2931 16.5390 k = 0.4375 0.1083 0.6124 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4172 -13.4161 -13.4159 -10.4557 -10.4536 -10.4495 -10.4484 -10.4424 -10.4415 -0.1361 -0.1325 4.9450 5.3562 5.8603 6.2781 6.8042 6.8271 6.9744 7.0848 7.2282 7.2908 7.3421 7.4261 7.5625 7.6058 8.1780 8.3632 12.0833 12.2203 14.2053 14.5416 15.0573 15.0794 16.4370 16.7028 k = 0.4306 0.1203 0.6124 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4172 -13.4160 -13.4159 -10.4556 -10.4537 -10.4497 -10.4486 -10.4421 -10.4413 -0.1395 -0.1359 4.9336 5.3339 5.8611 6.2722 6.8216 6.8489 6.9671 7.0833 7.2284 7.2954 7.3455 7.4221 7.5787 7.6315 8.2233 8.4083 11.9265 12.0627 14.1822 14.5036 15.2165 15.2222 16.5769 16.8674 k = 0.4236 0.1323 0.6124 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4173 -13.4159 -13.4158 -10.4556 -10.4538 -10.4498 -10.4487 -10.4419 -10.4412 -0.1426 -0.1391 4.9230 5.3140 5.8604 6.2663 6.8374 6.8682 6.9602 7.0814 7.2286 7.2986 7.3494 7.4182 7.5935 7.6546 8.2757 8.4556 11.7790 11.9129 14.1596 14.4706 15.3663 15.3805 16.7089 17.0314 k = 0.4167 0.1443 0.6124 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4173 -13.4158 -13.4157 -10.4555 -10.4539 -10.4499 -10.4488 -10.4416 -10.4409 -0.1455 -0.1420 4.9133 5.2968 5.8588 6.2608 6.8517 6.8848 6.9536 7.0794 7.2290 7.3008 7.3536 7.4144 7.6067 7.6741 8.3335 8.5031 11.6435 11.7730 14.1389 14.4426 15.5145 15.5423 16.8271 17.1908 k = 0.4097 0.1564 0.6124 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4174 -13.4159 -13.4158 -10.4554 -10.4541 -10.4500 -10.4490 -10.4416 -10.4409 -0.1480 -0.1446 4.9048 5.2822 5.8568 6.2558 6.8644 6.8986 6.9474 7.0774 7.2293 7.3021 7.3579 7.4109 7.6181 7.6900 8.3942 8.5482 11.5226 11.6458 14.1209 14.4192 15.6610 15.7033 16.9225 17.3302 k = 0.4028 0.1684 0.6124 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4175 -13.4159 -13.4158 -10.4554 -10.4543 -10.4502 -10.4492 -10.4415 -10.4408 -0.1502 -0.1468 4.8976 5.2702 5.8548 6.2516 6.8758 6.9094 6.9414 7.0755 7.2297 7.3028 7.3619 7.4075 7.6276 7.7022 8.4544 8.5879 11.4191 11.5341 14.1060 14.4004 15.8025 15.8612 16.9840 17.3749 k = 0.3958 0.1804 0.6124 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4177 -13.4159 -13.4158 -10.4555 -10.4546 -10.4502 -10.4493 -10.4414 -10.4408 -0.1519 -0.1486 4.8919 5.2609 5.8529 6.2481 6.8860 6.9170 6.9363 7.0739 7.2300 7.3031 7.3655 7.4046 7.6350 7.7113 8.5106 8.6192 11.3357 11.4413 14.0943 14.3859 15.9337 16.0122 17.0045 17.2791 k = 0.3889 0.1925 0.6124 ( 3192 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4177 -13.4159 -13.4158 -10.4553 -10.4547 -10.4503 -10.4493 -10.4414 -10.4408 -0.1532 -0.1499 4.8878 5.2542 5.8514 6.2456 6.8950 6.9198 6.9334 7.0727 7.2302 7.3032 7.3685 7.4021 7.6403 7.7175 8.5587 8.6396 11.2749 11.3710 14.0859 14.3756 16.0461 16.1482 16.9919 17.1527 k = 0.3819 0.2045 0.6124 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4549 -10.4503 -10.4494 -10.4414 -10.4408 -0.1539 -0.1506 4.8853 5.2502 5.8505 6.2440 6.9029 6.9169 6.9337 7.0719 7.2304 7.3033 7.3704 7.4005 7.6434 7.7210 8.5938 8.6482 11.2380 11.3268 14.0808 14.3695 16.1256 16.2518 16.9711 17.0453 k = 0.3750 0.2165 0.6124 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4550 -10.4504 -10.4494 -10.4414 -10.4408 -0.1542 -0.1509 4.8844 5.2489 5.8501 6.2435 6.9081 6.9130 6.9342 7.0716 7.2304 7.3033 7.3711 7.3999 7.6445 7.7222 8.6080 8.6490 11.2257 11.3116 14.0791 14.3675 16.1552 16.2930 16.9699 16.9924 k = 0.3750 0.2165 0.6124 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4550 -10.4504 -10.4494 -10.4414 -10.4408 -0.1542 -0.1509 4.8844 5.2489 5.8501 6.2435 6.9081 6.9130 6.9342 7.0716 7.2304 7.3033 7.3711 7.3999 7.6445 7.7222 8.6080 8.6490 11.2257 11.3116 14.0791 14.3675 16.1552 16.2930 16.9699 16.9924 k = 0.3681 0.2125 0.6010 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4183 -13.4179 -13.4160 -13.4158 -10.4552 -10.4548 -10.4502 -10.4491 -10.4418 -10.4412 -0.1615 -0.1582 4.8905 5.2982 5.7705 6.2140 6.9074 6.9119 6.9378 7.0622 7.2305 7.3062 7.3739 7.4077 7.6398 7.7203 8.6647 8.7038 11.2777 11.3626 14.2824 14.5925 16.0436 16.1635 16.8192 16.8435 k = 0.3611 0.2085 0.5897 ( 3196 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4160 -13.4157 -10.4551 -10.4546 -10.4499 -10.4487 -10.4423 -10.4416 -0.1703 -0.1670 4.8944 5.3484 5.6960 6.1918 6.9000 6.9152 6.9442 7.0550 7.2305 7.3084 7.3772 7.4175 7.6352 7.7196 8.7237 8.7612 11.3301 11.4135 14.4824 14.8223 15.9411 16.0354 16.6716 16.6974 k = 0.3542 0.2045 0.5784 ( 3196 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4182 -13.4179 -13.4160 -13.4157 -10.4551 -10.4545 -10.4497 -10.4483 -10.4427 -10.4421 -0.1808 -0.1775 4.8962 5.3981 5.6283 6.1772 6.8924 6.9176 6.9521 7.0502 7.2307 7.3100 7.3807 7.4291 7.6307 7.7202 8.7849 8.8211 11.3828 11.4647 14.6722 15.0560 15.8532 15.9091 16.5275 16.5544 k = 0.3472 0.2005 0.5670 ( 3196 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4182 -13.4180 -13.4161 -13.4157 -10.4551 -10.4544 -10.4495 -10.4480 -10.4432 -10.4426 -0.1930 -0.1897 4.8961 5.4411 5.5740 6.1702 6.8847 6.9190 6.9610 7.0481 7.2311 7.3111 7.3842 7.4424 7.6263 7.7224 8.8483 8.8831 11.4361 11.5163 14.8394 15.2914 15.7854 15.7907 16.3876 16.4149 k = 0.3403 0.1965 0.5557 ( 3204 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4099 -13.4183 -13.4181 -13.4162 -13.4158 -10.4551 -10.4543 -10.4494 -10.4478 -10.4437 -10.4431 -0.2070 -0.2038 4.8946 5.4500 5.5605 6.1708 6.8772 6.9190 6.9709 7.0487 7.2317 7.3120 7.3878 7.4573 7.6222 7.7264 8.9135 8.9473 11.4902 11.5685 14.9625 15.5185 15.6718 15.7721 16.2542 16.2798 k = 0.3333 0.1925 0.5443 ( 3198 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4183 -13.4181 -13.4162 -13.4157 -10.4551 -10.4542 -10.4491 -10.4473 -10.4441 -10.4435 -0.2230 -0.2199 4.8923 5.4146 5.5981 6.1784 6.8699 6.9177 6.9817 7.0520 7.2328 7.3127 7.3912 7.4736 7.6186 7.7323 8.9806 9.0135 11.5452 11.6214 15.0193 15.5276 15.7672 15.8136 16.1373 16.1524 k = 0.3264 0.1884 0.5330 ( 3198 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4183 -13.4182 -13.4162 -13.4156 -10.4551 -10.4541 -10.4489 -10.4470 -10.4445 -10.4440 -0.2410 -0.2381 4.8898 5.3707 5.6511 6.1924 6.8627 6.9152 6.9934 7.0579 7.2343 7.3134 7.3943 7.4912 7.6156 7.7403 9.0495 9.0817 11.6011 11.6749 15.0109 15.4126 15.8852 15.8873 16.0561 16.1258 k = 0.3194 0.1844 0.5217 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4183 -13.4182 -13.4162 -13.4156 -10.4550 -10.4540 -10.4488 -10.4467 -10.4449 -10.4444 -0.2611 -0.2583 4.8879 5.3293 5.7082 6.2119 6.8556 6.9115 7.0061 7.0661 7.2367 7.3142 7.3972 7.5098 7.6137 7.7508 9.1200 9.1516 11.6579 11.7293 14.9607 15.2961 15.8107 15.8445 16.1006 16.3150 k = 0.3125 0.1804 0.5103 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4182 -13.4181 -13.4161 -13.4155 -10.4549 -10.4538 -10.4486 -10.4464 -10.4451 -10.4447 -0.2833 -0.2806 4.8873 5.2928 5.7669 6.2360 6.8487 6.9070 7.0196 7.0762 7.2400 7.3154 7.3997 7.5290 7.6135 7.7638 9.1920 9.2232 11.7157 11.7844 14.8894 15.1810 15.6961 15.7336 16.2074 16.5276 k = 0.3056 0.1764 0.4990 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4099 -32.4099 -32.4098 -32.4098 -13.4183 -13.4183 -13.4162 -13.4155 -10.4549 -10.4538 -10.4486 -10.4463 -10.4454 -10.4450 -0.3077 -0.3051 4.8887 5.2621 5.8261 6.2638 6.8420 6.9018 7.0340 7.0876 7.2445 7.3169 7.4021 7.5480 7.6161 7.7796 9.2654 9.2963 11.7744 11.8401 14.8084 15.0678 15.5786 15.6161 16.2804 16.6446 k = 0.2986 0.1724 0.4876 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4184 -13.4183 -13.4163 -13.4156 -10.4549 -10.4538 -10.4487 -10.4464 -10.4457 -10.4453 -0.3341 -0.3317 4.8926 5.2374 5.8852 6.2944 6.8353 6.8961 7.0491 7.1000 7.2506 7.3189 7.4045 7.5648 7.6238 7.7985 9.3402 9.3709 11.8340 11.8963 14.7235 14.9568 15.4630 15.4996 16.2960 16.5950 k = 0.2917 0.1684 0.4763 ( 3192 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4185 -13.4185 -13.4164 -13.4157 -10.4550 -10.4538 -10.4489 -10.4467 -10.4459 -10.4453 -0.3626 -0.3604 4.8995 5.2188 5.9437 6.3267 6.8288 6.8899 7.0649 7.1126 7.2587 7.3214 7.4073 7.5776 7.6390 7.8206 9.4161 9.4468 11.8943 11.9529 14.6379 14.8482 15.3505 15.3858 16.2615 16.4982 k = 0.2847 0.1644 0.4649 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4184 -13.4184 -13.4163 -13.4156 -10.4548 -10.4536 -10.4490 -10.4470 -10.4459 -10.4451 -0.3931 -0.3911 4.9098 5.2063 6.0010 6.3600 6.8224 6.8835 7.0810 7.1248 7.2687 7.3246 7.4112 7.5869 7.6618 7.8461 9.4932 9.5239 11.9553 12.0097 14.5534 14.7422 15.2417 15.2753 16.1957 16.3936 k = 0.2778 0.1604 0.4536 ( 3166 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4098 -32.4097 -13.4184 -13.4184 -13.4162 -13.4155 -10.4547 -10.4535 -10.4491 -10.4473 -10.4458 -10.4449 -0.4255 -0.4237 4.9238 5.1999 6.0566 6.3934 6.8160 6.8768 7.0972 7.1362 7.2804 7.3284 7.4172 7.5952 7.6905 7.8755 9.5711 9.6021 12.0168 12.0663 14.4712 14.6389 15.1370 15.1684 16.1129 16.2886 k = 0.2708 0.1564 0.4423 ( 3166 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4185 -13.4185 -13.4163 -13.4155 -10.4547 -10.4535 -10.4494 -10.4477 -10.4458 -10.4448 -0.4597 -0.4581 4.9417 5.1993 6.1102 6.4261 6.8098 6.8700 7.1132 7.1462 7.2928 7.3327 7.4267 7.6045 7.7238 7.9088 9.6498 9.6812 12.0784 12.1224 14.3922 14.5386 15.0365 15.0653 16.0214 16.1850 k = 0.2639 0.1524 0.4309 ( 3168 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4186 -13.4186 -13.4164 -13.4157 -10.4547 -10.4536 -10.4498 -10.4482 -10.4458 -10.4448 -0.4956 -0.4942 4.9636 5.2046 6.1612 6.4576 6.8035 6.8629 7.1286 7.1549 7.3042 7.3373 7.4416 7.6163 7.7614 7.9464 9.7292 9.7610 12.1399 12.1775 14.3172 14.4414 14.9404 14.9664 15.9255 16.0839 k = 0.2569 0.1483 0.4196 ( 3160 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4098 -32.4097 -32.4097 -13.4186 -13.4186 -13.4164 -13.4156 -10.4547 -10.4535 -10.4501 -10.4485 -10.4458 -10.4447 -0.5330 -0.5318 4.9896 5.2155 6.2093 6.4873 6.7974 6.8557 7.1431 7.1623 7.3130 7.3421 7.4631 7.6315 7.8035 7.9887 9.8090 9.8415 12.2009 12.2310 14.2469 14.3479 14.8489 14.8717 15.8280 15.9856 k = 0.2500 0.1443 0.4082 ( 3164 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4188 -13.4187 -13.4165 -13.4158 -10.4547 -10.4536 -10.4505 -10.4490 -10.4458 -10.4447 -0.5719 -0.5708 5.0197 5.2317 6.2542 6.5148 6.7913 6.8483 7.1563 7.1688 7.3187 7.3466 7.4915 7.6506 7.8502 8.0360 9.8892 9.9224 12.2608 12.2822 14.1820 14.2583 14.7620 14.7816 15.7302 15.8905 k = 0.2431 0.1403 0.3969 ( 3162 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4098 -32.4097 -32.4097 -13.4188 -13.4188 -13.4166 -13.4158 -10.4547 -10.4536 -10.4508 -10.4494 -10.4459 -10.4447 -0.6120 -0.6110 5.0537 5.2530 6.2956 6.5400 6.7852 6.8409 7.1682 7.1744 7.3216 7.3507 7.5260 7.6739 7.9021 8.0886 9.9693 10.0035 12.3190 12.3304 14.1233 14.1733 14.6798 14.6963 15.6332 15.7988 k = 0.2361 0.1363 0.3856 ( 3164 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4098 -32.4097 -32.4097 -13.4189 -13.4189 -13.4167 -13.4160 -10.4547 -10.4536 -10.4512 -10.4499 -10.4460 -10.4448 -0.6531 -0.6523 5.0915 5.2791 6.3335 6.5626 6.7791 6.8333 7.1788 7.1796 7.3223 7.3539 7.5654 7.7015 7.9596 8.1468 10.0494 10.0847 12.3747 12.3747 14.0715 14.0935 14.6025 14.6162 15.5376 15.7107 k = 0.2292 0.1323 0.3742 ( 3164 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4098 -32.4097 -32.4097 -13.4190 -13.4190 -13.4168 -13.4161 -10.4547 -10.4537 -10.4516 -10.4503 -10.4460 -10.4449 -0.6951 -0.6944 5.1329 5.3097 6.3677 6.5826 6.7731 6.8257 7.1845 7.1881 7.3216 7.3562 7.6085 7.7331 8.0230 8.2107 10.1291 10.1656 12.4140 12.4269 14.0197 14.0271 14.5301 14.5418 15.4438 15.6264 k = 0.2222 0.1283 0.3629 ( 3168 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4098 -32.4097 -32.4097 -13.4192 -13.4191 -13.4169 -13.4163 -10.4547 -10.4537 -10.4520 -10.4508 -10.4462 -10.4451 -0.7378 -0.7373 5.1777 5.3444 6.3985 6.6001 6.7672 6.8181 7.1892 7.1964 7.3200 7.3575 7.6546 7.7685 8.0925 8.2804 10.2082 10.2462 12.4473 12.4743 13.9528 13.9906 14.4627 14.4736 15.3521 15.5463 k = 0.2153 0.1243 0.3515 ( 3160 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4192 -13.4192 -13.4169 -13.4163 -10.4546 -10.4537 -10.4523 -10.4511 -10.4462 -10.4451 -0.7811 -0.7806 5.2257 5.3829 6.4258 6.6150 6.7613 6.8104 7.1938 7.2037 7.3178 7.3580 7.7030 7.8071 8.1680 8.3559 10.2865 10.3261 12.4737 12.5159 13.8939 13.9621 14.4004 14.4124 15.2629 15.4706 k = 0.2083 0.1203 0.3402 ( 3164 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4194 -13.4193 -13.4171 -13.4165 -10.4546 -10.4538 -10.4527 -10.4516 -10.4464 -10.4454 -0.8246 -0.8243 5.2766 5.4248 6.4499 6.6276 6.7554 6.8029 7.1983 7.2103 7.3153 7.3577 7.7533 7.8489 8.2495 8.4370 10.3636 10.4051 12.4926 12.5499 13.8440 13.9412 14.3432 14.3593 15.1764 15.3998 k = 0.2014 0.1163 0.3289 ( 3164 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4195 -13.4194 -13.4172 -13.4167 -10.4546 -10.4538 -10.4530 -10.4520 -10.4466 -10.4456 -0.8684 -0.8681 5.3299 5.4697 6.4710 6.6380 6.7496 6.7954 7.2029 7.2163 7.3126 7.3568 7.8055 7.8935 8.3367 8.5235 10.4394 10.4829 12.5034 12.5751 13.8039 13.9266 14.2912 14.3159 15.0930 15.3341 k = 0.1944 0.1123 0.3175 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4098 -32.4097 -32.4097 -13.4196 -13.4195 -13.4176 -13.4170 -10.4547 -10.4539 -10.4534 -10.4524 -10.4470 -10.4461 -0.9121 -0.9118 5.3855 5.5173 6.4893 6.6462 6.7439 6.7881 7.2075 7.2219 7.3100 7.3555 7.8595 7.9408 8.4292 8.6151 10.5134 10.5593 12.5060 12.5903 13.7742 13.9159 14.2445 14.2840 15.0130 15.2741 k = 0.1875 0.1083 0.3062 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4197 -13.4196 -13.4177 -13.4172 -10.4546 -10.4539 -10.4537 -10.4527 -10.4472 -10.4463 -0.9556 -0.9554 5.4429 5.5669 6.5051 6.6524 6.7384 6.7809 7.2122 7.2272 7.3074 7.3538 7.9154 7.9910 8.5265 8.7112 10.5856 10.6339 12.5011 12.5950 13.7547 13.9064 14.2030 14.2656 14.9369 15.2205 k = 0.1806 0.1042 0.2948 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4198 -13.4197 -13.4179 -13.4174 -10.4546 -10.4541 -10.4539 -10.4531 -10.4475 -10.4466 -0.9988 -0.9987 5.5017 5.6184 6.5186 6.6568 6.7329 6.7741 7.2170 7.2323 7.3051 7.3518 7.9734 8.0439 8.6281 8.8116 10.6555 10.7066 12.4892 12.5893 13.7445 13.8953 14.1667 14.2616 14.8657 15.1740 k = 0.1736 0.1002 0.2835 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4199 -13.4198 -13.4180 -13.4176 -10.4546 -10.4543 -10.4539 -10.4534 -10.4478 -10.4470 -1.0415 -1.0414 5.5615 5.6711 6.5300 6.6595 6.7276 6.7675 7.2218 7.2372 7.3029 7.3497 8.0335 8.0998 8.7336 8.9156 10.7230 10.7771 12.4714 12.5741 13.7417 13.8815 14.1355 14.2705 14.8007 15.1352 k = 0.1667 0.0962 0.2722 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4200 -13.4199 -13.4183 -13.4179 -10.4547 -10.4546 -10.4540 -10.4539 -10.4481 -10.4474 -1.0835 -1.0834 5.6220 5.7247 6.5396 6.6607 6.7224 6.7613 7.2266 7.2419 7.3010 7.3475 8.0962 8.1586 8.8424 9.0227 10.7877 10.8451 12.4487 12.5506 13.7443 13.8652 14.1091 14.2881 14.7444 15.1051 k = 0.1597 0.0922 0.2608 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4202 -13.4201 -13.4185 -13.4181 -10.4551 -10.4546 -10.4543 -10.4541 -10.4485 -10.4478 -1.1248 -1.1247 5.6827 5.7787 6.5476 6.6605 6.7175 6.7553 7.2315 7.2466 7.2994 7.3453 8.1615 8.2207 8.9539 9.1324 10.8497 10.9105 12.4222 12.5205 13.7497 13.8477 14.0868 14.3070 14.7012 15.0842 k = 0.1528 0.0882 0.2495 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4203 -13.4202 -13.4187 -13.4183 -10.4553 -10.4546 -10.4545 -10.4541 -10.4488 -10.4481 -1.1651 -1.1651 5.7431 5.8326 6.5542 6.6592 6.7127 6.7497 7.2365 7.2512 7.2981 7.3431 8.2297 8.2860 9.0676 9.2441 10.9088 10.9731 12.3930 12.4856 13.7559 13.8300 14.0680 14.3177 14.6777 15.0732 k = 0.1458 0.0842 0.2381 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4203 -13.4201 -13.4189 -13.4186 -10.4556 -10.4550 -10.4544 -10.4540 -10.4492 -10.4485 -1.2044 -1.2044 5.8029 5.8860 6.5597 6.6569 6.7081 6.7443 7.2414 7.2557 7.2970 7.3409 8.3010 8.3547 9.1830 9.3571 10.9650 11.0329 12.3621 12.4475 13.7614 13.8132 14.0516 14.3118 14.6794 15.0720 k = 0.1389 0.0802 0.2268 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4204 -13.4202 -13.4191 -13.4188 -10.4558 -10.4553 -10.4544 -10.4540 -10.4495 -10.4489 -1.2426 -1.2426 5.8617 5.9386 6.5642 6.6539 6.7037 6.7392 7.2463 7.2602 7.2962 7.3389 8.3755 8.4268 9.2992 9.4707 11.0183 11.0898 12.3303 12.4075 13.7654 13.7978 14.0362 14.2881 14.7044 15.0799 k = 0.1319 0.0762 0.2155 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4204 -13.4203 -13.4193 -13.4190 -10.4561 -10.4556 -10.4543 -10.4540 -10.4499 -10.4493 -1.2795 -1.2794 5.9190 5.9898 6.5680 6.6504 6.6996 6.7342 7.2512 7.2646 7.2957 7.3369 8.4533 8.5024 9.4157 9.5841 11.0691 11.1439 12.2984 12.3668 13.7676 13.7840 14.0209 14.2522 14.7442 15.0950 k = 0.1250 0.0722 0.2041 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4096 -32.4096 -13.4204 -13.4203 -13.4193 -13.4191 -10.4563 -10.4558 -10.4542 -10.4540 -10.4501 -10.4496 -1.3150 -1.3150 5.9744 6.0392 6.5712 6.6467 6.6956 6.7293 7.2560 7.2689 7.2955 7.3350 8.5345 8.5815 9.5317 9.6962 11.1178 11.1955 12.2670 12.3265 13.7680 13.7717 14.0048 14.2097 14.7894 15.1140 k = 0.1181 0.0682 0.1928 ( 3181 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4096 -32.4096 -13.4205 -13.4204 -13.4195 -13.4193 -10.4565 -10.4561 -10.4541 -10.4540 -10.4505 -10.4500 -1.3491 -1.3490 6.0276 6.0866 6.5742 6.6429 6.6919 6.7246 7.2607 7.2731 7.2955 7.3333 8.6191 8.6640 9.6461 9.8061 11.1649 11.2448 12.2367 12.2874 13.7610 13.7669 13.9875 14.1645 14.8318 15.1315 k = 0.1111 0.0642 0.1814 ( 3181 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4206 -13.4205 -13.4197 -13.4195 -10.4567 -10.4564 -10.4541 -10.4540 -10.4508 -10.4503 -1.3816 -1.3816 6.0782 6.1314 6.5772 6.6393 6.6884 6.7198 7.2654 7.2772 7.2957 7.3316 8.7070 8.7498 9.7580 9.9124 11.2112 11.2923 12.2081 12.2502 13.7515 13.7646 13.9689 14.1186 14.8634 15.1396 k = 0.1042 0.0601 0.1701 ( 3181 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4207 -13.4205 -13.4198 -13.4196 -10.4569 -10.4567 -10.4541 -10.4540 -10.4511 -10.4507 -1.4125 -1.4125 6.1258 6.1733 6.5803 6.6360 6.6850 6.7152 7.2699 7.2812 7.2961 7.3300 8.7981 8.8387 9.8661 10.0136 11.2578 11.3387 12.1816 12.2156 13.7432 13.7613 13.9491 14.0733 14.8764 15.1275 k = 0.0972 0.0561 0.1588 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4208 -13.4206 -13.4200 -13.4198 -10.4572 -10.4569 -10.4541 -10.4540 -10.4514 -10.4510 -1.4418 -1.4417 6.1703 6.2121 6.5838 6.6333 6.6819 6.7106 7.2743 7.2850 7.2967 7.3286 8.8922 8.9304 9.9690 10.1080 11.3058 11.3848 12.1575 12.1840 13.7357 13.7572 13.9285 14.0292 14.8635 15.0845 k = 0.0903 0.0521 0.1474 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4208 -13.4206 -13.4202 -13.4201 -10.4573 -10.4571 -10.4540 -10.4540 -10.4518 -10.4514 -1.4693 -1.4692 6.2112 6.2474 6.5879 6.6314 6.6790 6.7062 7.2786 7.2887 7.2974 7.3272 8.9890 9.0247 10.0650 10.1937 11.3565 11.4315 12.1361 12.1559 13.7289 13.7525 13.9074 13.9868 14.8210 15.0061 k = 0.0833 0.0481 0.1361 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4208 -13.4207 -13.4203 -13.4202 -10.4575 -10.4574 -10.4540 -10.4539 -10.4521 -10.4517 -1.4949 -1.4949 6.2483 6.2791 6.5928 6.6304 6.6764 6.7018 7.2826 7.2922 7.2983 7.3259 9.0880 9.1210 10.1526 10.2690 11.4111 11.4799 12.1178 12.1317 13.7227 13.7472 13.8861 13.9464 14.7504 14.8973 k = 0.0764 0.0441 0.1247 ( 3181 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4207 -13.4204 -13.4203 -10.4577 -10.4576 -10.4539 -10.4539 -10.4523 -10.4520 -1.5187 -1.5187 6.2815 6.3069 6.5986 6.6304 6.6740 6.6976 7.2865 7.2954 7.2993 7.3246 9.1889 9.2190 10.2298 10.3322 11.4705 11.5310 12.1027 12.1117 13.7169 13.7415 13.8649 13.9081 14.6572 14.7685 k = 0.0694 0.0401 0.1134 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4208 -13.4206 -13.4205 -10.4579 -10.4578 -10.4539 -10.4539 -10.4526 -10.4523 -1.5406 -1.5406 6.3105 6.3308 6.6053 6.6316 6.6718 6.6935 7.2901 7.2984 7.3004 7.3235 9.2910 9.3181 10.2950 10.3822 11.5350 11.5855 12.0909 12.0959 13.7116 13.7355 13.8440 13.8721 14.5487 14.6293 k = 0.0625 0.0361 0.1021 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4208 -13.4207 -13.4206 -10.4581 -10.4580 -10.4539 -10.4539 -10.4528 -10.4526 -1.5605 -1.5605 6.3355 6.3510 6.6128 6.6340 6.6699 6.6896 7.2935 7.3012 7.3016 7.3223 9.3937 9.4176 10.3470 10.4184 11.6042 11.6439 12.0824 12.0843 13.7066 13.7295 13.8236 13.8387 14.4316 14.4869 k = 0.0556 0.0321 0.0907 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4208 -13.4207 -13.4207 -13.4207 -10.4581 -10.4581 -10.4537 -10.4537 -10.4529 -10.4527 -1.5785 -1.5785 6.3563 6.3676 6.6210 6.6375 6.6682 6.6859 7.2967 7.3028 7.3037 7.3212 9.4964 9.5169 10.3848 10.4409 11.6770 11.7060 12.0767 12.0769 13.7020 13.7234 13.8039 13.8081 14.3114 14.3465 k = 0.0486 0.0281 0.0794 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4208 -13.4208 -13.4207 -10.4582 -10.4582 -10.4537 -10.4537 -10.4531 -10.4529 -1.5944 -1.5944 6.3733 6.3811 6.6294 6.6418 6.6669 6.6824 7.2995 7.3041 7.3059 7.3201 9.5981 9.6151 10.4081 10.4501 11.7513 11.7708 12.0727 12.0744 13.6979 13.7175 13.7805 13.7848 14.1925 14.2120 k = 0.0417 0.0241 0.0680 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4209 -13.4209 -13.4208 -10.4584 -10.4583 -10.4537 -10.4537 -10.4532 -10.4531 -1.6082 -1.6082 6.3867 6.3917 6.6377 6.6468 6.6658 6.6792 7.3020 7.3055 7.3078 7.3190 9.6980 9.7115 10.4171 10.4470 11.8250 11.8364 12.0718 12.0743 13.6943 13.7119 13.7563 13.7667 14.0788 14.0867 k = 0.0347 0.0200 0.0567 ( 3165 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4209 -13.4208 -13.4207 -10.4584 -10.4584 -10.4536 -10.4536 -10.4533 -10.4531 -1.6200 -1.6200 6.3971 6.4000 6.6454 6.6519 6.6651 6.6763 7.3042 7.3069 7.3094 7.3179 9.7951 9.8052 10.4126 10.4324 11.8951 11.9006 12.0734 12.0762 13.6912 13.7067 13.7357 13.7496 13.9736 13.9737 k = 0.0278 0.0160 0.0454 ( 3159 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4208 -13.4208 -13.4207 -10.4585 -10.4584 -10.4535 -10.4535 -10.4533 -10.4532 -1.6296 -1.6296 6.4048 6.4063 6.6523 6.6567 6.6647 6.6736 7.3061 7.3083 7.3106 7.3168 9.8883 9.8953 10.3952 10.4073 11.9586 11.9604 12.0766 12.0792 13.6886 13.7020 13.7193 13.7338 13.8757 13.8804 k = 0.0208 0.0120 0.0340 ( 3153 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4095 -32.4095 -13.4208 -13.4208 -13.4207 -13.4207 -10.4584 -10.4584 -10.4534 -10.4534 -10.4533 -10.4533 -1.6371 -1.6371 6.4102 6.4108 6.6580 6.6609 6.6646 6.6713 7.3078 7.3096 7.3115 7.3156 9.9765 9.9807 10.3662 10.3726 12.0123 12.0126 12.0805 12.0827 13.6867 13.6979 13.7073 13.7198 13.7959 13.8023 k = 0.0139 0.0080 0.0227 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4583 -10.4583 -10.4534 -10.4533 -10.4533 -10.4533 -1.6425 -1.6425 6.4138 6.4140 6.6624 6.6641 6.6649 6.6694 7.3093 7.3107 7.3120 7.3145 10.0582 10.0601 10.3269 10.3295 12.0529 12.0538 12.0842 12.0858 13.6855 13.6939 13.6998 13.7079 13.7377 13.7428 k = 0.0069 0.0040 0.0113 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4584 -10.4584 -10.4533 -10.4533 -10.4533 -10.4533 -1.6457 -1.6457 6.4158 6.4158 6.6651 6.6655 6.6659 6.6677 7.3107 7.3115 7.3122 7.3133 10.1301 10.1306 10.2804 10.2809 12.0790 12.0797 12.0870 12.0878 13.6848 13.6881 13.6961 13.6993 13.7050 13.7057 k = 0.0000 0.0000 0.0000 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4584 -10.4584 -10.4533 -10.4533 -10.4533 -10.4533 -1.6468 -1.6468 6.4165 6.4165 6.6664 6.6664 6.6664 6.6664 7.3120 7.3120 7.3120 7.3120 10.1717 10.1717 10.2473 10.2473 12.0883 12.0883 12.0883 12.0883 13.6827 13.6827 13.6959 13.6959 13.6959 13.6959 k = 0.0000 0.0000 0.0000 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4584 -10.4584 -10.4533 -10.4533 -10.4533 -10.4533 -1.6468 -1.6468 6.4165 6.4165 6.6664 6.6664 6.6664 6.6664 7.3120 7.3120 7.3120 7.3120 10.1717 10.1717 10.2473 10.2473 12.0883 12.0883 12.0883 12.0883 13.6827 13.6827 13.6959 13.6959 13.6959 13.6959 k = 0.0114 0.0066 0.0046 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4584 -10.4584 -10.4533 -10.4533 -10.4533 -10.4533 -1.6457 -1.6457 6.4158 6.4158 6.6653 6.6656 6.6656 6.6678 7.3107 7.3118 7.3118 7.3133 10.1302 10.1302 10.2808 10.2808 12.0830 12.0830 12.0830 12.0843 13.6877 13.6877 13.6987 13.7009 13.7009 13.7033 k = 0.0227 0.0131 0.0093 ( 3143 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4095 -32.4095 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4583 -10.4583 -10.4534 -10.4534 -10.4533 -10.4533 -1.6425 -1.6425 6.4139 6.4139 6.6632 6.6632 6.6646 6.6695 7.3093 7.3113 7.3113 7.3146 10.0584 10.0584 10.3290 10.3290 12.0677 12.0677 12.0689 12.0714 13.6960 13.6960 13.7115 13.7207 13.7221 13.7221 k = 0.0341 0.0197 0.0139 ( 3152 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4095 -32.4095 -13.4208 -13.4208 -13.4207 -13.4207 -10.4584 -10.4584 -10.4535 -10.4535 -10.4533 -10.4532 -1.6371 -1.6371 6.4105 6.4105 6.6595 6.6595 6.6643 6.6716 7.3079 7.3104 7.3104 7.3158 9.9765 9.9765 10.3717 10.3717 12.0437 12.0437 12.0465 12.0501 13.7053 13.7053 13.7336 13.7474 13.7605 13.7605 k = 0.0455 0.0262 0.0186 ( 3152 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4095 -32.4095 -13.4207 -13.4207 -13.4207 -13.4207 -10.4584 -10.4584 -10.4535 -10.4535 -10.4532 -10.4531 -1.6295 -1.6295 6.4054 6.4054 6.6545 6.6545 6.6643 6.6741 7.3064 7.3092 7.3092 7.3170 9.8873 9.8873 10.4066 10.4066 12.0128 12.0128 12.0166 12.0211 13.7175 13.7175 13.7641 13.7823 13.8126 13.8126 k = 0.0568 0.0328 0.0232 ( 3158 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4208 -13.4208 -13.4208 -13.4207 -10.4583 -10.4583 -10.4535 -10.4535 -10.4532 -10.4531 -1.6199 -1.6199 6.3982 6.3982 6.6487 6.6487 6.6646 6.6768 7.3050 7.3076 7.3076 7.3182 9.7920 9.7920 10.4333 10.4333 11.9771 11.9771 11.9804 11.9856 13.7328 13.7328 13.8016 13.8240 13.8760 13.8760 k = 0.0682 0.0394 0.0278 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4209 -13.4209 -13.4208 -10.4583 -10.4583 -10.4537 -10.4537 -10.4533 -10.4531 -1.6081 -1.6081 6.3885 6.3885 6.6424 6.6424 6.6653 6.6799 7.3036 7.3057 7.3057 7.3194 9.6915 9.6915 10.4518 10.4518 11.9384 11.9384 11.9387 11.9445 13.7514 13.7514 13.8447 13.8712 13.9486 13.9486 k = 0.0795 0.0459 0.0325 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4096 -32.4096 -32.4096 -32.4096 -13.4209 -13.4208 -13.4208 -13.4208 -10.4582 -10.4582 -10.4537 -10.4537 -10.4531 -10.4529 -1.5942 -1.5942 6.3758 6.3758 6.6360 6.6360 6.6663 6.6833 7.3021 7.3035 7.3035 7.3205 9.5867 9.5867 10.4621 10.4621 11.8927 11.8985 11.8985 11.8988 13.7729 13.7729 13.8918 13.9223 14.0289 14.0289 k = 0.0909 0.0525 0.0371 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6975 -32.6975 -32.4097 -32.4097 -32.4096 -32.4096 -13.4208 -13.4207 -13.4207 -13.4207 -10.4580 -10.4580 -10.4537 -10.4537 -10.4529 -10.4527 -1.5782 -1.5782 6.3596 6.3596 6.6300 6.6300 6.6676 6.6869 7.3008 7.3011 7.3011 7.3217 9.4783 9.4783 10.4647 10.4647 11.8432 11.8496 11.8586 11.8586 13.7971 13.7971 13.9415 13.9759 14.1153 14.1153 k = 0.1023 0.0590 0.0418 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4208 -13.4206 -13.4206 -10.4580 -10.4580 -10.4538 -10.4538 -10.4528 -10.4525 -1.5603 -1.5603 6.3394 6.3394 6.6249 6.6249 6.6692 6.6908 7.2984 7.2984 7.2994 7.3228 9.3673 9.3673 10.4600 10.4600 11.7911 11.7976 11.8197 11.8197 13.8233 13.8233 13.9920 14.0301 14.2067 14.2067 k = 0.1136 0.0656 0.0464 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4207 -13.4205 -13.4205 -10.4578 -10.4578 -10.4539 -10.4539 -10.4525 -10.4523 -1.5403 -1.5403 6.3147 6.3147 6.6208 6.6208 6.6711 6.6949 7.2954 7.2954 7.2982 7.3240 9.2545 9.2545 10.4487 10.4487 11.7371 11.7436 11.7824 11.7824 13.8510 13.8510 14.0418 14.0836 14.3024 14.3024 k = 0.1250 0.0722 0.0510 ( 3185 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4208 -13.4204 -13.4204 -10.4576 -10.4576 -10.4540 -10.4540 -10.4523 -10.4520 -1.5184 -1.5184 6.2854 6.2854 6.6181 6.6181 6.6732 6.6992 7.2922 7.2922 7.2970 7.3252 9.1408 9.1408 10.4314 10.4314 11.6816 11.6881 11.7469 11.7469 13.8791 13.8791 14.0894 14.1345 14.4013 14.4013 k = 0.1364 0.0787 0.0557 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4210 -13.4208 -13.4203 -13.4203 -10.4575 -10.4575 -10.4542 -10.4542 -10.4521 -10.4518 -1.4945 -1.4945 6.2513 6.2513 6.6167 6.6167 6.6756 6.7036 7.2889 7.2889 7.2959 7.3264 9.0270 9.0270 10.4089 10.4089 11.6254 11.6317 11.7136 11.7136 13.9068 13.9068 14.1332 14.1813 14.5030 14.5030 k = 0.1477 0.0853 0.0603 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4210 -13.4208 -13.4202 -13.4202 -10.4573 -10.4573 -10.4542 -10.4542 -10.4518 -10.4515 -1.4689 -1.4689 6.2123 6.2123 6.6166 6.6166 6.6781 6.7082 7.2854 7.2854 7.2950 7.3277 8.9140 8.9140 10.3819 10.3819 11.5686 11.5749 11.6825 11.6825 13.9329 13.9329 14.1717 14.2222 14.6068 14.6068 k = 0.1591 0.0919 0.0649 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4209 -13.4207 -13.4198 -13.4198 -10.4570 -10.4570 -10.4541 -10.4541 -10.4513 -10.4510 -1.4414 -1.4414 6.1684 6.1684 6.6178 6.6178 6.6809 6.7129 7.2817 7.2817 7.2943 7.3291 8.8025 8.8025 10.3511 10.3511 11.5118 11.5179 11.6534 11.6534 13.9565 13.9565 14.2037 14.2559 14.7118 14.7118 k = 0.1705 0.0984 0.0696 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4208 -13.4206 -13.4196 -13.4196 -10.4568 -10.4568 -10.4541 -10.4541 -10.4510 -10.4506 -1.4122 -1.4122 6.1199 6.1199 6.6200 6.6200 6.6838 6.7177 7.2780 7.2780 7.2937 7.3306 8.6932 8.6932 10.3171 10.3171 11.4552 11.4612 11.6263 11.6263 13.9764 13.9765 14.2280 14.2812 14.8171 14.8171 k = 0.1818 0.1050 0.0742 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4207 -13.4205 -13.4193 -13.4193 -10.4566 -10.4566 -10.4540 -10.4540 -10.4506 -10.4502 -1.3814 -1.3814 6.0666 6.0666 6.6232 6.6232 6.6869 6.7224 7.2741 7.2741 7.2934 7.3321 8.5867 8.5867 10.2807 10.2807 11.3990 11.4048 11.6010 11.6010 13.9920 13.9920 14.2440 14.2972 14.9212 14.9212 k = 0.1932 0.1115 0.0789 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4097 -32.4097 -32.4096 -32.4096 -13.4207 -13.4205 -13.4192 -13.4192 -10.4565 -10.4565 -10.4540 -10.4540 -10.4502 -10.4498 -1.3490 -1.3490 6.0089 6.0089 6.6272 6.6272 6.6901 6.7271 7.2702 7.2702 7.2934 7.3338 8.4838 8.4838 10.2424 10.2424 11.3435 11.3492 11.5774 11.5774 14.0024 14.0024 14.2514 14.3037 15.0219 15.0219 k = 0.2045 0.1181 0.0835 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4207 -13.4205 -13.4190 -13.4190 -10.4564 -10.4564 -10.4538 -10.4538 -10.4499 -10.4495 -1.3151 -1.3151 5.9469 5.9469 6.6318 6.6318 6.6934 6.7318 7.2662 7.2662 7.2936 7.3355 8.3848 8.3848 10.2027 10.2027 11.2889 11.2943 11.5553 11.5553 14.0075 14.0075 14.2505 14.3011 15.1154 15.1154 k = 0.2159 0.1247 0.0881 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4206 -13.4204 -13.4188 -13.4188 -10.4564 -10.4564 -10.4537 -10.4537 -10.4495 -10.4491 -1.2799 -1.2799 5.8808 5.8808 6.6370 6.6370 6.6968 6.7364 7.2622 7.2622 7.2941 7.3374 8.2902 8.2902 10.1621 10.1621 11.2352 11.2405 11.5347 11.5347 14.0071 14.0071 14.2418 14.2900 15.1958 15.1958 k = 0.2273 0.1312 0.0928 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4206 -13.4203 -13.4186 -13.4186 -10.4563 -10.4563 -10.4535 -10.4535 -10.4491 -10.4487 -1.2434 -1.2434 5.8110 5.8110 6.6427 6.6427 6.7002 6.7408 7.2582 7.2582 7.2949 7.3394 8.2003 8.2003 10.1209 10.1209 11.1827 11.1879 11.5154 11.5154 14.0014 14.0014 14.2262 14.2716 15.2553 15.2553 k = 0.2386 0.1378 0.0974 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6976 -32.6976 -32.4098 -32.4098 -32.4097 -32.4097 -13.4205 -13.4203 -13.4184 -13.4184 -10.4563 -10.4563 -10.4533 -10.4533 -10.4488 -10.4483 -1.2058 -1.2058 5.7378 5.7378 6.6487 6.6487 6.7036 6.7450 7.2541 7.2541 7.2961 7.3415 8.1153 8.1153 10.0796 10.0796 11.1314 11.1365 11.4973 11.4973 13.9910 13.9910 14.2047 14.2471 15.2877 15.2877 k = 0.2500 0.1443 0.1021 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4205 -13.4203 -13.4182 -13.4182 -10.4564 -10.4564 -10.4531 -10.4531 -10.4484 -10.4480 -1.1672 -1.1672 5.6615 5.6615 6.6550 6.6550 6.7071 6.7491 7.2500 7.2500 7.2976 7.3438 8.0355 8.0355 10.0383 10.0383 11.0816 11.0865 11.4803 11.4803 13.9764 13.9764 14.1786 14.2178 15.2930 15.2930 k = 0.2614 0.1509 0.1067 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4204 -13.4202 -13.4180 -13.4180 -10.4564 -10.4564 -10.4528 -10.4528 -10.4480 -10.4476 -1.1277 -1.1277 5.5827 5.5827 6.6615 6.6615 6.7105 6.7529 7.2458 7.2458 7.2995 7.3461 7.9609 7.9609 9.9974 9.9974 11.0332 11.0380 11.4645 11.4645 13.9582 13.9582 14.1487 14.1847 15.2776 15.2776 k = 0.2727 0.1575 0.1113 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4205 -13.4203 -13.4179 -13.4179 -10.4566 -10.4566 -10.4526 -10.4526 -10.4478 -10.4474 -1.0876 -1.0876 5.5018 5.5018 6.6681 6.6681 6.7139 6.7564 7.2416 7.2416 7.3018 7.3485 7.8915 7.8915 9.9570 9.9570 10.9864 10.9910 11.4496 11.4496 13.9371 13.9371 14.1161 14.1491 15.2492 15.2492 k = 0.2841 0.1640 0.1160 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4205 -13.4202 -13.4177 -13.4177 -10.4566 -10.4566 -10.4523 -10.4523 -10.4474 -10.4469 -1.0469 -1.0469 5.4195 5.4195 6.6747 6.6747 6.7172 6.7596 7.2373 7.2373 7.3044 7.3510 7.8273 7.8273 9.9175 9.9175 10.9413 10.9458 11.4358 11.4358 13.9139 13.9139 14.0818 14.1118 15.2133 15.2133 k = 0.2955 0.1706 0.1206 ( 3185 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4203 -13.4201 -13.4175 -13.4175 -10.4567 -10.4567 -10.4520 -10.4520 -10.4469 -10.4465 -1.0059 -1.0059 5.3362 5.3362 6.6813 6.6813 6.7205 6.7625 7.2329 7.2329 7.3073 7.3536 7.7683 7.7683 9.8790 9.8790 10.8979 10.9023 11.4228 11.4228 13.8891 13.8891 14.0465 14.0737 15.1735 15.1735 k = 0.3068 0.1771 0.1253 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4202 -13.4200 -13.4172 -13.4172 -10.4567 -10.4567 -10.4517 -10.4517 -10.4464 -10.4460 -0.9648 -0.9648 5.2526 5.2526 6.6879 6.6879 6.7238 6.7651 7.2283 7.2283 7.3106 7.3563 7.7143 7.7143 9.8416 9.8416 10.8564 10.8606 11.4108 11.4108 13.8634 13.8634 14.0108 14.0354 15.1321 15.1321 k = 0.3182 0.1837 0.1299 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4098 -32.4098 -32.4097 -32.4097 -13.4202 -13.4200 -13.4169 -13.4169 -10.4568 -10.4568 -10.4513 -10.4513 -10.4460 -10.4456 -0.9238 -0.9238 5.1693 5.1693 6.6943 6.6943 6.7269 6.7673 7.2234 7.2234 7.3141 7.3589 7.6652 7.6652 9.8056 9.8056 10.8168 10.8208 11.3997 11.3997 13.8372 13.8372 13.9752 13.9975 15.0905 15.0905 k = 0.3295 0.1903 0.1345 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4201 -13.4199 -13.4167 -13.4167 -10.4569 -10.4569 -10.4510 -10.4510 -10.4456 -10.4453 -0.8832 -0.8832 5.0870 5.0870 6.7005 6.7005 6.7300 6.7692 7.2183 7.2183 7.3180 7.3615 7.6210 7.6210 9.7710 9.7710 10.7791 10.7830 11.3894 11.3894 13.8109 13.8109 13.9403 13.9603 15.0496 15.0496 k = 0.3409 0.1968 0.1392 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4201 -13.4199 -13.4165 -13.4165 -10.4569 -10.4569 -10.4507 -10.4507 -10.4453 -10.4449 -0.8431 -0.8431 5.0062 5.0062 6.7066 6.7066 6.7329 6.7708 7.2128 7.2128 7.3221 7.3641 7.5814 7.5814 9.7379 9.7379 10.7435 10.7473 11.3798 11.3798 13.7850 13.7850 13.9064 13.9244 15.0100 15.0100 k = 0.3523 0.2034 0.1438 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4200 -13.4198 -13.4164 -13.4164 -10.4570 -10.4570 -10.4505 -10.4505 -10.4450 -10.4446 -0.8039 -0.8039 4.9276 4.9276 6.7123 6.7123 6.7358 6.7720 7.2068 7.2068 7.3263 7.3666 7.5463 7.5463 9.7066 9.7066 10.7101 10.7137 11.3710 11.3710 13.7599 13.7599 13.8738 13.8900 14.9721 14.9721 k = 0.3636 0.2099 0.1485 ( 3181 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4200 -13.4198 -13.4164 -13.4164 -10.4571 -10.4571 -10.4504 -10.4504 -10.4447 -10.4444 -0.7658 -0.7658 4.8519 4.8519 6.7178 6.7178 6.7386 6.7729 7.2004 7.2004 7.3307 7.3690 7.5156 7.5156 9.6771 9.6771 10.6788 10.6822 11.3630 11.3630 13.7357 13.7357 13.8429 13.8574 14.9362 14.9362 k = 0.3750 0.2165 0.1531 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4200 -13.4199 -13.4163 -13.4163 -10.4573 -10.4573 -10.4502 -10.4502 -10.4445 -10.4442 -0.7292 -0.7292 4.7795 4.7795 6.7229 6.7229 6.7413 6.7735 7.1935 7.1935 7.3352 7.3712 7.4890 7.4890 9.6496 9.6496 10.6497 10.6529 11.3557 11.3557 13.7127 13.7127 13.8139 13.8267 14.9027 14.9027 k = 0.3864 0.2231 0.1577 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4200 -13.4198 -13.4161 -13.4161 -10.4573 -10.4573 -10.4500 -10.4500 -10.4442 -10.4439 -0.6943 -0.6943 4.7112 4.7112 6.7277 6.7277 6.7439 6.7738 7.1863 7.1863 7.3397 7.3732 7.4663 7.4663 9.6240 9.6240 10.6230 10.6260 11.3491 11.3491 13.6912 13.6912 13.7869 13.7982 14.8717 14.8717 k = 0.3977 0.2296 0.1624 ( 3175 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4198 -13.4196 -13.4159 -13.4159 -10.4573 -10.4573 -10.4498 -10.4498 -10.4437 -10.4435 -0.6615 -0.6615 4.6473 4.6473 6.7321 6.7321 6.7464 6.7738 7.1788 7.1788 7.3442 7.3750 7.4473 7.4473 9.6006 9.6006 10.5987 10.6014 11.3432 11.3432 13.6714 13.6714 13.7622 13.7721 14.8433 14.8433 k = 0.4091 0.2362 0.1670 ( 3175 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4196 -13.4158 -13.4158 -10.4573 -10.4573 -10.4496 -10.4496 -10.4435 -10.4433 -0.6311 -0.6311 4.5886 4.5886 6.7361 6.7361 6.7488 6.7736 7.1711 7.1711 7.3486 7.3765 7.4316 7.4316 9.5794 9.5794 10.5767 10.5793 11.3380 11.3380 13.6533 13.6533 13.7398 13.7484 14.8176 14.8176 k = 0.4205 0.2427 0.1716 ( 3169 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4196 -13.4156 -13.4156 -10.4574 -10.4574 -10.4494 -10.4494 -10.4432 -10.4430 -0.6033 -0.6033 4.5355 4.5355 6.7397 6.7397 6.7511 6.7732 7.1637 7.1637 7.3529 7.3777 7.4188 7.4188 9.5604 9.5604 10.5573 10.5595 11.3334 11.3334 13.6370 13.6370 13.7199 13.7273 14.7948 14.7948 k = 0.4318 0.2493 0.1763 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4196 -13.4156 -13.4156 -10.4576 -10.4576 -10.4493 -10.4493 -10.4431 -10.4429 -0.5786 -0.5786 4.4884 4.4884 6.7429 6.7429 6.7534 6.7725 7.1566 7.1566 7.3570 7.3785 7.4086 7.4086 9.5439 9.5439 10.5404 10.5423 11.3295 11.3295 13.6228 13.6228 13.7025 13.7087 14.7748 14.7748 k = 0.4432 0.2559 0.1809 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4196 -13.4155 -13.4155 -10.4576 -10.4576 -10.4491 -10.4491 -10.4429 -10.4428 -0.5571 -0.5571 4.4477 4.4477 6.7456 6.7456 6.7555 6.7716 7.1501 7.1501 7.3609 7.3790 7.4006 7.4006 9.5298 9.5298 10.5260 10.5276 11.3261 11.3261 13.6106 13.6106 13.6877 13.6928 14.7579 14.7579 k = 0.4545 0.2624 0.1856 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4100 -32.4097 -32.4097 -13.4198 -13.4197 -13.4155 -13.4155 -10.4577 -10.4577 -10.4491 -10.4491 -10.4428 -10.4427 -0.5391 -0.5391 4.4140 4.4140 6.7478 6.7478 6.7576 6.7706 7.1445 7.1445 7.3644 7.3791 7.3945 7.3945 9.5181 9.5181 10.5142 10.5156 11.3234 11.3234 13.6005 13.6005 13.6757 13.6797 14.7439 14.7439 k = 0.4659 0.2690 0.1902 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4097 -32.4097 -13.4198 -13.4198 -13.4155 -13.4155 -10.4578 -10.4578 -10.4491 -10.4491 -10.4428 -10.4427 -0.5249 -0.5249 4.3873 4.3873 6.7495 6.7495 6.7596 6.7694 7.1399 7.1399 7.3677 7.3787 7.3900 7.3900 9.5090 9.5090 10.5051 10.5061 11.3213 11.3213 13.5926 13.5926 13.6663 13.6693 14.7330 14.7330 k = 0.4773 0.2756 0.1948 ( 3181 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4100 -32.4097 -32.4097 -13.4197 -13.4197 -13.4154 -13.4154 -10.4577 -10.4577 -10.4490 -10.4490 -10.4426 -10.4425 -0.5146 -0.5146 4.3681 4.3681 6.7508 6.7508 6.7615 6.7680 7.1365 7.1365 7.3705 7.3780 7.3870 7.3870 9.5025 9.5025 10.4986 10.4993 11.3199 11.3199 13.5870 13.5870 13.6598 13.6618 14.7253 14.7253 k = 0.4886 0.2821 0.1995 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4153 -13.4153 -10.4577 -10.4577 -10.4489 -10.4489 -10.4425 -10.4425 -0.5083 -0.5083 4.3565 4.3565 6.7516 6.7516 6.7633 6.7666 7.1344 7.1344 7.3730 7.3768 7.3852 7.3852 9.4985 9.4985 10.4947 10.4951 11.3190 11.3190 13.5835 13.5835 13.6561 13.6570 14.7206 14.7206 k = 0.5000 0.2887 0.2041 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4153 -13.4153 -10.4577 -10.4577 -10.4488 -10.4488 -10.4425 -10.4425 -0.5062 -0.5062 4.3527 4.3527 6.7518 6.7518 6.7650 6.7650 7.1337 7.1337 7.3751 7.3751 7.3846 7.3846 9.4972 9.4972 10.4936 10.4936 11.3187 11.3187 13.5824 13.5824 13.6551 13.6551 14.7190 14.7190 k = 0.5000 0.2887 0.2041 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4153 -13.4153 -10.4577 -10.4577 -10.4488 -10.4488 -10.4425 -10.4425 -0.5062 -0.5062 4.3527 4.3527 6.7518 6.7518 6.7650 6.7650 7.1337 7.1337 7.3751 7.3751 7.3846 7.3846 9.4972 9.4972 10.4936 10.4936 11.3187 11.3187 13.5824 13.5824 13.6551 13.6551 14.7190 14.7190 k = 0.5040 0.2770 0.2107 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4153 -13.4153 -10.4577 -10.4577 -10.4489 -10.4488 -10.4425 -10.4425 -0.5056 -0.5055 4.3508 4.3571 6.7472 6.7555 6.7648 6.7649 7.1328 7.1344 7.3750 7.3751 7.3826 7.3863 9.4788 9.4995 10.4737 10.4745 11.3307 11.3538 13.5580 13.5917 13.6541 13.6567 14.7217 14.7574 k = 0.5081 0.2654 0.2173 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4196 -13.4196 -13.4153 -13.4152 -10.4577 -10.4576 -10.4490 -10.4487 -10.4425 -10.4425 -0.5037 -0.5035 4.3515 4.3643 6.7412 6.7580 6.7646 6.7649 7.1315 7.1348 7.3747 7.3749 7.3803 7.3876 9.4444 9.4855 10.4197 10.4243 11.3852 11.4277 13.5145 13.5804 13.6593 13.6685 14.7652 14.8313 k = 0.5121 0.2538 0.2239 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4154 -13.4152 -10.4577 -10.4575 -10.4490 -10.4486 -10.4426 -10.4426 -0.5005 -0.5002 4.3548 4.3740 6.7335 6.7580 6.7651 6.7656 7.1299 7.1349 7.3738 7.3747 7.3782 7.3886 9.3948 9.4552 10.3443 10.3560 11.4690 11.5264 13.4563 13.5423 13.6829 13.6941 14.8436 14.9333 k = 0.5161 0.2421 0.2305 ( 3175 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4196 -13.4196 -13.4154 -13.4152 -10.4576 -10.4574 -10.4490 -10.4485 -10.4426 -10.4426 -0.4959 -0.4955 4.3606 4.3864 6.7240 6.7549 6.7658 6.7685 7.1279 7.1348 7.3716 7.3743 7.3769 7.3894 9.3310 9.4091 10.2589 10.2793 11.5697 11.6380 13.3925 13.4894 13.7213 13.7324 14.9490 15.0564 k = 0.5202 0.2305 0.2370 ( 3175 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4195 -13.4195 -13.4154 -13.4152 -10.4575 -10.4572 -10.4491 -10.4484 -10.4427 -10.4427 -0.4901 -0.4896 4.3688 4.4015 6.7124 6.7497 6.7671 6.7722 7.1255 7.1344 7.3681 7.3738 7.3763 7.3899 9.2545 9.3481 10.1713 10.2003 11.6775 11.7534 13.3312 13.4324 13.7715 13.7821 15.0746 15.1957 k = 0.5242 0.2188 0.2436 ( 3177 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4195 -13.4195 -13.4154 -13.4152 -10.4574 -10.4571 -10.4491 -10.4483 -10.4428 -10.4427 -0.4831 -0.4824 4.3795 4.4192 6.6986 6.7427 6.7689 6.7765 7.1226 7.1338 7.3638 7.3732 7.3759 7.3903 9.1674 9.2735 10.0854 10.1217 11.7853 11.8649 13.2794 13.3795 13.8323 13.8423 15.2150 15.3475 k = 0.5282 0.2072 0.2502 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4194 -13.4194 -13.4155 -13.4152 -10.4573 -10.4569 -10.4491 -10.4481 -10.4428 -10.4428 -0.4748 -0.4741 4.3926 4.4396 6.6825 6.7338 6.7712 6.7813 7.1193 7.1329 7.3588 7.3723 7.3757 7.3906 9.0719 9.1876 10.0030 10.0447 11.8866 11.9648 13.2448 13.3374 13.9028 13.9122 15.3663 15.5095 k = 0.5323 0.1956 0.2568 ( 3171 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4193 -13.4193 -13.4155 -13.4151 -10.4571 -10.4567 -10.4491 -10.4480 -10.4429 -10.4429 -0.4654 -0.4645 4.4079 4.4627 6.6638 6.7231 6.7741 6.7865 7.1155 7.1317 7.3533 7.3712 7.3755 7.3909 8.9703 9.0928 9.9243 9.9696 11.9749 12.0455 13.2349 13.3129 13.9824 13.9911 15.5255 15.6797 k = 0.5363 0.1839 0.2634 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4193 -13.4193 -13.4156 -13.4152 -10.4570 -10.4566 -10.4492 -10.4479 -10.4431 -10.4430 -0.4549 -0.4539 4.4254 4.4883 6.6424 6.7103 6.7775 6.7923 7.1112 7.1302 7.3472 7.3697 7.3753 7.3912 8.8648 8.9917 9.8490 9.8963 12.0441 12.1000 13.2563 13.3120 14.0704 14.0783 15.6897 15.8566 k = 0.5403 0.1723 0.2700 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4192 -13.4192 -13.4156 -13.4152 -10.4569 -10.4564 -10.4492 -10.4478 -10.4432 -10.4431 -0.4433 -0.4422 4.4451 4.5166 6.6181 6.6954 6.7814 6.7985 7.1063 7.1285 7.3405 7.3679 7.3752 7.3917 8.7576 8.8871 9.7763 9.8244 12.0896 12.1255 13.3120 13.3391 14.1662 14.1731 15.8556 16.0385 k = 0.5444 0.1606 0.2766 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4191 -13.4191 -13.4156 -13.4152 -10.4567 -10.4561 -10.4491 -10.4476 -10.4433 -10.4433 -0.4308 -0.4295 4.4667 4.5474 6.5907 6.6783 6.7858 6.8051 7.1008 7.1263 7.3333 7.3658 7.3751 7.3923 8.6505 8.7810 9.7057 9.7537 12.1100 12.1241 13.3955 13.3995 14.2693 14.2750 16.0185 16.2233 k = 0.5484 0.1490 0.2831 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4190 -13.4190 -13.4157 -13.4152 -10.4566 -10.4559 -10.4491 -10.4475 -10.4435 -10.4434 -0.4173 -0.4160 4.4902 4.5808 6.5599 6.6589 6.7907 6.8122 7.0947 7.1237 7.3257 7.3633 7.3750 7.3932 8.5451 8.6755 9.6367 9.6841 12.1015 12.1078 13.4784 13.5129 14.3789 14.3833 16.1698 16.4065 k = 0.5524 0.1374 0.2897 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4190 -13.4190 -13.4157 -13.4153 -10.4564 -10.4557 -10.4492 -10.4474 -10.4436 -10.4435 -0.4030 -0.4015 4.5154 4.6167 6.5254 6.6372 6.7960 6.8197 7.0879 7.1207 7.3176 7.3604 7.3750 7.3943 8.4427 8.5722 9.5689 9.6154 12.0643 12.0876 13.5828 13.6454 14.4947 14.4974 16.2946 16.5775 k = 0.5565 0.1257 0.2963 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4189 -13.4188 -13.4157 -13.4153 -10.4562 -10.4555 -10.4491 -10.4472 -10.4436 -10.4436 -0.3880 -0.3864 4.5421 4.6550 6.4872 6.6129 6.8017 6.8276 7.0805 7.1171 7.3092 7.3572 7.3750 7.3957 8.3447 8.4725 9.5023 9.5477 12.0176 12.0544 13.7031 13.7915 14.6160 14.6169 16.3690 16.7031 k = 0.5605 0.1141 0.3029 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4188 -13.4187 -13.4157 -13.4153 -10.4561 -10.4553 -10.4491 -10.4471 -10.4437 -10.4437 -0.3724 -0.3706 4.5701 4.6956 6.4450 6.5861 6.8078 6.8357 7.0724 7.1130 7.3006 7.3538 7.3751 7.3972 8.2519 8.3775 9.4366 9.4809 11.9655 12.0126 13.8344 13.9471 14.7413 14.7424 16.3738 16.7151 k = 0.5645 0.1024 0.3095 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4187 -13.4186 -13.4158 -13.4153 -10.4559 -10.4551 -10.4491 -10.4471 -10.4438 -10.4437 -0.3562 -0.3543 4.5992 4.7385 6.3989 6.5569 6.8142 6.8441 7.0636 7.1082 7.2919 7.3501 7.3752 7.3990 8.1652 8.2883 9.3720 9.4152 11.9104 11.9655 13.9726 14.1091 14.8700 14.8733 16.3169 16.6185 k = 0.5685 0.0908 0.3161 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4187 -13.4186 -13.4159 -13.4154 -10.4558 -10.4550 -10.4491 -10.4471 -10.4439 -10.4439 -0.3397 -0.3377 4.6291 4.7836 6.3487 6.5253 6.8210 6.8527 7.0543 7.1027 7.2833 7.3462 7.3754 7.4009 8.0852 8.2054 9.3085 9.3507 11.8542 11.9154 14.1142 14.2754 15.0024 15.0080 16.2226 16.4793 k = 0.5726 0.0792 0.3226 ( 3185 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4186 -13.4185 -13.4159 -13.4154 -10.4557 -10.4549 -10.4491 -10.4471 -10.4439 -10.4438 -0.3229 -0.3207 4.6595 4.8307 6.2949 6.4917 6.8280 6.8614 7.0444 7.0966 7.2751 7.3422 7.3757 7.4029 8.0123 8.1294 9.2462 9.2875 11.7979 11.8639 14.2560 14.4445 15.1378 15.1458 16.1111 16.3271 k = 0.5766 0.0675 0.3292 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4185 -13.4184 -13.4159 -13.4154 -10.4555 -10.4547 -10.4491 -10.4471 -10.4438 -10.4437 -0.3059 -0.3036 4.6900 4.8796 6.2377 6.4565 6.8352 6.8701 7.0341 7.0900 7.2673 7.3382 7.3760 7.4051 7.9468 8.0606 9.1852 9.2256 11.7424 11.8121 14.3947 14.6148 15.2750 15.2850 15.9957 16.1721 k = 0.5806 0.0559 0.3358 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4184 -13.4182 -13.4159 -13.4154 -10.4554 -10.4546 -10.4491 -10.4471 -10.4437 -10.4435 -0.2890 -0.2865 4.7201 4.9301 6.1778 6.4203 6.8426 6.8785 7.0235 7.0831 7.2602 7.3342 7.3764 7.4072 7.8886 7.9990 9.1256 9.1654 11.6882 11.7609 14.5256 14.7851 15.4111 15.4221 15.8883 16.0201 k = 0.5847 0.0442 0.3424 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4184 -13.4182 -13.4160 -13.4155 -10.4553 -10.4546 -10.4492 -10.4474 -10.4437 -10.4434 -0.2722 -0.2697 4.7493 4.9818 6.1161 6.3839 6.8501 6.8866 7.0127 7.0761 7.2538 7.3303 7.3768 7.4092 7.8375 7.9447 9.0677 9.1068 11.6356 11.7108 14.6420 14.9542 15.5353 15.5426 15.8111 15.8836 k = 0.5887 0.0326 0.3490 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4183 -13.4181 -13.4159 -13.4155 -10.4552 -10.4544 -10.4492 -10.4474 -10.4435 -10.4431 -0.2558 -0.2531 4.7772 5.0342 6.0536 6.3484 6.8577 6.8941 7.0019 7.0695 7.2482 7.3265 7.3771 7.4111 7.7933 7.8972 9.0114 9.0501 11.5849 11.6621 14.7330 15.1205 15.5837 15.5948 15.8269 15.8272 k = 0.5927 0.0210 0.3556 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4180 -13.4159 -13.4155 -10.4551 -10.4544 -10.4493 -10.4476 -10.4433 -10.4429 -0.2399 -0.2371 4.8031 5.0866 5.9916 6.3149 6.8652 6.9007 6.9912 7.0635 7.2435 7.3230 7.3774 7.4126 7.7556 7.8563 8.9571 8.9953 11.5362 11.6150 14.7837 15.2801 15.4914 15.5879 15.9183 15.9404 k = 0.5968 0.0093 0.3622 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4159 -13.4156 -10.4551 -10.4544 -10.4494 -10.4479 -10.4431 -10.4426 -0.2248 -0.2218 4.8263 5.1379 5.9321 6.2846 6.8727 6.9062 6.9809 7.0588 7.2396 7.3196 7.3774 7.4136 7.7241 7.8215 8.9047 8.9428 11.4897 11.5699 14.7823 15.3324 15.4593 15.6025 16.0548 16.0816 k = 0.6008-0.0023 0.3687 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4159 -13.4156 -10.4551 -10.4545 -10.4495 -10.4480 -10.4429 -10.4423 -0.2105 -0.2074 4.8464 5.1863 5.8774 6.2588 6.8800 6.9102 6.9711 7.0556 7.2365 7.3166 7.3773 7.4140 7.6984 7.7926 8.8545 8.8925 11.4454 11.5268 14.7322 15.1967 15.6025 15.6547 16.2000 16.2288 k = 0.6048-0.0140 0.3753 ( 3189 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4159 -13.4156 -10.4551 -10.4546 -10.4496 -10.4482 -10.4426 -10.4421 -0.1972 -0.1941 4.8628 5.2293 5.8307 6.2385 6.8870 6.9128 6.9620 7.0543 7.2342 7.3138 7.3770 7.4136 7.6780 7.7690 8.8067 8.8448 11.4033 11.4857 14.6487 15.0532 15.7327 15.7453 16.3466 16.3760 k = 0.6089-0.0256 0.3819 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4159 -13.4156 -10.4551 -10.4546 -10.4498 -10.4485 -10.4424 -10.4418 -0.1853 -0.1821 4.8751 5.2629 5.7966 6.2247 6.8937 6.9138 6.9537 7.0548 7.2325 7.3113 7.3763 7.4124 7.6627 7.7505 8.7614 8.7996 11.3634 11.4467 14.5461 14.9106 15.8224 15.8795 16.4907 16.5197 k = 0.6129-0.0372 0.3885 ( 3195 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4160 -13.4157 -10.4552 -10.4547 -10.4500 -10.4487 -10.4421 -10.4415 -0.1748 -0.1716 4.8831 5.2828 5.7800 6.2182 6.8998 6.9136 6.9464 7.0571 7.2314 7.3091 7.3753 7.4103 7.6521 7.7368 8.7187 8.7573 11.3257 11.4098 14.4337 14.7702 15.9143 16.0027 16.6289 16.6567 k = 0.6169-0.0489 0.3951 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4179 -13.4160 -13.4158 -10.4552 -10.4548 -10.4501 -10.4490 -10.4419 -10.4413 -0.1660 -0.1628 4.8871 5.2859 5.7844 6.2192 6.9053 6.9123 6.9405 7.0609 7.2308 7.3071 7.3741 7.4073 7.6458 7.7276 8.6787 8.7180 11.2903 11.3750 14.3166 14.6327 16.0024 16.1133 16.7574 16.7833 k = 0.6210-0.0605 0.4017 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4160 -13.4158 -10.4552 -10.4549 -10.4502 -10.4492 -10.4417 -10.4410 -0.1591 -0.1558 4.8873 5.2731 5.8091 6.2278 6.9099 6.9103 6.9362 7.0658 7.2305 7.3052 7.3726 7.4038 7.6434 7.7228 8.6418 8.6818 11.2569 11.3423 14.1978 14.4983 16.0834 16.2102 16.8723 16.8962 k = 0.6250-0.0722 0.4082 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4550 -10.4504 -10.4494 -10.4414 -10.4408 -0.1542 -0.1509 4.8844 5.2489 5.8501 6.2435 6.9081 6.9130 6.9342 7.0716 7.2304 7.3033 7.3711 7.3999 7.6445 7.7222 8.6080 8.6490 11.2257 11.3116 14.0791 14.3675 16.1552 16.2930 16.9699 16.9924 k = 0.6250-0.0722 0.4082 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4550 -10.4504 -10.4494 -10.4414 -10.4408 -0.1542 -0.1509 4.8844 5.2489 5.8501 6.2435 6.9081 6.9130 6.9342 7.0716 7.2304 7.3033 7.3711 7.3999 7.6445 7.7222 8.6080 8.6490 11.2257 11.3116 14.0791 14.3675 16.1552 16.2930 16.9699 16.9924 k = 0.6181-0.0682 0.4196 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4549 -10.4503 -10.4494 -10.4414 -10.4408 -0.1539 -0.1506 4.8853 5.2502 5.8505 6.2440 6.9029 6.9169 6.9337 7.0719 7.2304 7.3033 7.3704 7.4005 7.6434 7.7210 8.5938 8.6482 11.2380 11.3268 14.0808 14.3695 16.1256 16.2518 16.9711 17.0453 k = 0.6111-0.0642 0.4309 ( 3192 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4177 -13.4159 -13.4158 -10.4553 -10.4547 -10.4503 -10.4493 -10.4414 -10.4408 -0.1532 -0.1499 4.8878 5.2542 5.8514 6.2456 6.8950 6.9198 6.9334 7.0727 7.2302 7.3032 7.3685 7.4021 7.6403 7.7175 8.5587 8.6396 11.2749 11.3710 14.0859 14.3756 16.0461 16.1482 16.9919 17.1527 k = 0.6042-0.0601 0.4423 ( 3194 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4177 -13.4159 -13.4158 -10.4555 -10.4546 -10.4502 -10.4493 -10.4414 -10.4408 -0.1519 -0.1486 4.8919 5.2609 5.8529 6.2481 6.8860 6.9170 6.9363 7.0739 7.2300 7.3031 7.3655 7.4046 7.6350 7.7113 8.5106 8.6192 11.3357 11.4413 14.0943 14.3859 15.9337 16.0122 17.0045 17.2791 k = 0.5972-0.0561 0.4536 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4175 -13.4159 -13.4158 -10.4554 -10.4543 -10.4502 -10.4492 -10.4415 -10.4408 -0.1502 -0.1468 4.8976 5.2702 5.8548 6.2516 6.8758 6.9094 6.9414 7.0755 7.2297 7.3028 7.3619 7.4075 7.6276 7.7022 8.4544 8.5879 11.4191 11.5341 14.1060 14.4004 15.8025 15.8612 16.9840 17.3749 k = 0.5903-0.0521 0.4649 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4174 -13.4159 -13.4158 -10.4554 -10.4541 -10.4500 -10.4490 -10.4416 -10.4409 -0.1480 -0.1446 4.9048 5.2822 5.8568 6.2558 6.8644 6.8986 6.9474 7.0774 7.2293 7.3021 7.3579 7.4109 7.6181 7.6900 8.3942 8.5482 11.5226 11.6458 14.1209 14.4192 15.6610 15.7033 16.9225 17.3302 k = 0.5833-0.0481 0.4763 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4173 -13.4158 -13.4157 -10.4555 -10.4539 -10.4499 -10.4488 -10.4416 -10.4409 -0.1455 -0.1420 4.9133 5.2968 5.8588 6.2608 6.8517 6.8848 6.9536 7.0794 7.2290 7.3008 7.3536 7.4144 7.6067 7.6741 8.3335 8.5031 11.6435 11.7730 14.1389 14.4426 15.5145 15.5423 16.8271 17.1908 k = 0.5764-0.0441 0.4876 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4173 -13.4159 -13.4158 -10.4556 -10.4538 -10.4498 -10.4487 -10.4419 -10.4412 -0.1426 -0.1391 4.9230 5.3140 5.8604 6.2663 6.8374 6.8682 6.9602 7.0814 7.2286 7.2986 7.3494 7.4182 7.5935 7.6546 8.2757 8.4556 11.7790 11.9129 14.1596 14.4706 15.3663 15.3805 16.7089 17.0314 k = 0.5694-0.0401 0.4990 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4172 -13.4160 -13.4159 -10.4556 -10.4537 -10.4497 -10.4486 -10.4421 -10.4413 -0.1395 -0.1359 4.9336 5.3339 5.8611 6.2722 6.8216 6.8489 6.9671 7.0833 7.2284 7.2954 7.3455 7.4221 7.5787 7.6315 8.2233 8.4083 11.9265 12.0627 14.1822 14.5036 15.2165 15.2222 16.5769 16.8674 k = 0.5625-0.0361 0.5103 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4172 -13.4161 -13.4159 -10.4557 -10.4536 -10.4495 -10.4484 -10.4424 -10.4415 -0.1361 -0.1325 4.9450 5.3562 5.8603 6.2781 6.8042 6.8271 6.9744 7.0848 7.2282 7.2908 7.3421 7.4261 7.5625 7.6058 8.1780 8.3632 12.0833 12.2203 14.2053 14.5416 15.0573 15.0794 16.4370 16.7028 k = 0.5556-0.0321 0.5217 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4171 -13.4161 -13.4159 -10.4557 -10.4535 -10.4493 -10.4482 -10.4426 -10.4417 -0.1326 -0.1289 4.9569 5.3811 5.8574 6.2839 6.7852 6.8036 6.9819 7.0858 7.2282 7.2852 7.3392 7.4301 7.5447 7.5793 8.1404 8.3217 12.2471 12.3834 14.2255 14.5839 14.8999 14.9475 16.2931 16.5390 k = 0.5486-0.0281 0.5330 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4170 -13.4161 -13.4160 -10.4558 -10.4534 -10.4491 -10.4480 -10.4429 -10.4419 -0.1291 -0.1254 4.9688 5.4086 5.8516 6.2891 6.7644 6.7797 6.9898 7.0860 7.2285 7.2790 7.3365 7.4339 7.5247 7.5550 8.1103 8.2849 12.4157 12.5500 14.2360 14.6224 14.7537 14.8344 16.1475 16.3768 k = 0.5417-0.0241 0.5443 ( 3185 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4169 -13.4161 -13.4160 -10.4557 -10.4533 -10.4489 -10.4477 -10.4431 -10.4420 -0.1257 -0.1219 4.9805 5.4384 5.8419 6.2936 6.7414 6.7573 6.9981 7.0852 7.2289 7.2730 7.3338 7.4374 7.5028 7.5350 8.0871 8.2533 12.5868 12.7181 14.2243 14.5612 14.7092 14.7605 16.0022 16.2166 k = 0.5347-0.0200 0.5557 ( 3189 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4169 -13.4161 -13.4160 -10.4558 -10.4533 -10.4488 -10.4475 -10.4434 -10.4422 -0.1224 -0.1185 4.9915 5.4707 5.8276 6.2969 6.7174 6.7377 7.0065 7.0833 7.2291 7.2682 7.3305 7.4396 7.4820 7.5192 8.0697 8.2271 12.7577 12.8855 14.1768 14.4163 14.7045 14.7882 15.8586 16.0586 k = 0.5278-0.0160 0.5670 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4181 -13.4168 -13.4162 -13.4161 -10.4558 -10.4533 -10.4486 -10.4472 -10.4437 -10.4423 -0.1195 -0.1155 5.0015 5.5053 5.8078 6.2989 6.6948 6.7207 7.0150 7.0802 7.2289 7.2658 7.3261 7.4383 7.4674 7.5064 8.0570 8.2061 12.9256 13.0504 14.0940 14.2669 14.7179 14.8623 15.7184 15.9032 k = 0.5208-0.0120 0.5784 ( 3187 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4180 -13.4167 -13.4162 -13.4161 -10.4558 -10.4532 -10.4485 -10.4470 -10.4438 -10.4424 -0.1170 -0.1130 5.0099 5.5421 5.7822 6.2995 6.6757 6.7069 7.0234 7.0762 7.2279 7.2664 7.3204 7.4315 7.4627 7.4958 8.0483 8.1902 13.0861 13.2106 13.9903 14.1195 14.7635 14.9516 15.5838 15.7503 k = 0.5139-0.0080 0.5897 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4165 -13.4162 -13.4160 -10.4557 -10.4531 -10.4483 -10.4467 -10.4440 -10.4424 -0.1150 -0.1110 5.0163 5.5809 5.7509 6.2992 6.6614 6.6967 7.0310 7.0716 7.2264 7.2696 7.3136 7.4237 7.4637 7.4875 8.0426 8.1792 13.2325 13.3634 13.8814 13.9763 14.8283 15.0552 15.4596 15.6002 k = 0.5069-0.0040 0.6010 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4165 -13.4162 -13.4161 -10.4558 -10.4531 -10.4482 -10.4465 -10.4442 -10.4425 -0.1137 -0.1096 5.0203 5.6208 5.7150 6.2983 6.6527 6.6905 7.0370 7.0675 7.2250 7.2741 7.3070 7.4188 7.4658 7.4817 8.0395 8.1728 13.3500 13.5023 13.7858 13.8435 14.8953 15.1737 15.3583 15.4531 k = 0.5000 0.0000 0.6124 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4180 -13.4166 -13.4163 -13.4161 -10.4559 -10.4532 -10.4482 -10.4466 -10.4443 -10.4425 -0.1132 -0.1092 5.0217 5.6497 5.6871 6.2978 6.6499 6.6884 7.0395 7.0657 7.2244 7.2766 7.3038 7.4172 7.4668 7.4795 8.0386 8.1707 13.4006 13.5823 13.7423 13.7656 14.9289 15.2998 15.3134 15.3173 k = 0.5000 0.0000 0.6124 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4180 -13.4166 -13.4163 -13.4161 -10.4559 -10.4532 -10.4482 -10.4466 -10.4443 -10.4425 -0.1132 -0.1092 5.0217 5.6497 5.6871 6.2978 6.6499 6.6884 7.0395 7.0657 7.2244 7.2766 7.3038 7.4172 7.4668 7.4795 8.0386 8.1707 13.4006 13.5823 13.7423 13.7656 14.9289 15.2998 15.3134 15.3173 k = 0.5000 0.0080 0.6010 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4099 -32.4098 -13.4180 -13.4166 -13.4162 -13.4161 -10.4558 -10.4532 -10.4482 -10.4466 -10.4443 -10.4425 -0.1141 -0.1101 5.0206 5.6471 5.6864 6.2966 6.6541 6.6915 7.0349 7.0686 7.2256 7.2715 7.3094 7.4205 7.4643 7.4827 8.0403 8.1748 13.3949 13.5793 13.7374 13.7609 14.9333 15.3073 15.3169 15.3308 k = 0.5000 0.0160 0.5897 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4179 -13.4165 -13.4161 -13.4160 -10.4557 -10.4530 -10.4481 -10.4465 -10.4442 -10.4425 -0.1167 -0.1127 5.0173 5.6352 5.6890 6.2932 6.6658 6.7007 7.0250 7.0735 7.2292 7.2625 7.3196 7.4305 7.4598 7.4897 8.0455 8.1870 13.3784 13.5698 13.7227 13.7472 14.9465 15.3286 15.3362 15.3620 k = 0.5000 0.0241 0.5784 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4166 -13.4161 -13.4160 -10.4556 -10.4530 -10.4482 -10.4465 -10.4443 -10.4426 -0.1210 -0.1170 5.0117 5.6102 5.6998 6.2886 6.6830 6.7159 7.0132 7.0767 7.2347 7.2549 7.3290 7.4474 7.4550 7.4989 8.0547 8.2072 13.3527 13.5532 13.6991 13.7256 14.9691 15.3620 15.3727 15.4083 k = 0.5000 0.0321 0.5670 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4167 -13.4161 -13.4161 -10.4557 -10.4531 -10.4482 -10.4465 -10.4444 -10.4427 -0.1269 -0.1230 5.0038 5.5746 5.7178 6.2839 6.7029 6.7369 7.0009 7.0773 7.2394 7.2525 7.3361 7.4503 7.4706 7.5109 8.0681 8.2350 13.3197 13.5295 13.6673 13.6975 15.0010 15.4074 15.4234 15.4679 k = 0.5000 0.0401 0.5557 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4168 -13.4161 -13.4160 -10.4557 -10.4532 -10.4482 -10.4465 -10.4444 -10.4428 -0.1345 -0.1306 4.9933 5.5313 5.7419 6.2805 6.7231 6.7628 6.9887 7.0754 7.2385 7.2597 7.3413 7.4457 7.4975 7.5276 8.0865 8.2702 13.2813 13.4987 13.6284 13.6648 15.0422 15.4641 15.4862 15.5390 k = 0.5000 0.0481 0.5443 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4179 -13.4169 -13.4161 -13.4159 -10.4557 -10.4532 -10.4482 -10.4464 -10.4445 -10.4429 -0.1435 -0.1397 4.9801 5.4826 5.7711 6.2793 6.7427 6.7915 6.9769 7.0717 7.2363 7.2710 7.3451 7.4412 7.5230 7.5535 8.1103 8.3124 13.2391 13.4619 13.5835 13.6287 15.0919 15.5307 15.5592 15.6198 k = 0.5000 0.0561 0.5330 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4180 -13.4170 -13.4161 -13.4159 -10.4557 -10.4532 -10.4482 -10.4464 -10.4445 -10.4430 -0.1539 -0.1502 4.9642 5.4299 5.8051 6.2812 6.7613 6.8207 6.9659 7.0671 7.2348 7.2832 7.3480 7.4368 7.5457 7.5896 8.1400 8.3612 13.1945 13.4202 13.5338 13.5905 15.1490 15.6059 15.6409 15.7086 k = 0.5000 0.0642 0.5217 ( 3192 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4173 -13.4162 -13.4159 -10.4557 -10.4534 -10.4483 -10.4465 -10.4447 -10.4433 -0.1656 -0.1620 4.9456 5.3747 5.8432 6.2869 6.7787 6.8484 6.9562 7.0624 7.2343 7.2949 7.3504 7.4326 7.5691 7.6321 8.1762 8.4165 13.1484 13.3748 13.4806 13.5507 15.2120 15.6885 15.7299 15.8040 k = 0.5000 0.0722 0.5103 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4181 -13.4173 -13.4161 -13.4158 -10.4557 -10.4533 -10.4483 -10.4464 -10.4446 -10.4433 -0.1785 -0.1750 4.9244 5.3179 5.8850 6.2965 6.7944 6.8723 6.9491 7.0585 7.2347 7.3056 7.3526 7.4286 7.5952 7.6785 8.2193 8.4776 13.1018 13.3271 13.4249 13.5101 15.2791 15.7774 15.8247 15.9047 k = 0.5000 0.0802 0.4990 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4181 -13.4173 -13.4160 -13.4157 -10.4556 -10.4533 -10.4482 -10.4463 -10.4446 -10.4434 -0.1924 -0.1890 4.9007 5.2603 5.9300 6.3102 6.8080 6.8890 6.9474 7.0559 7.2360 7.3149 7.3546 7.4247 7.6249 7.7278 8.2696 8.5443 13.0554 13.2781 13.3676 13.4693 15.3482 15.8716 15.9241 16.0093 k = 0.5000 0.0882 0.4876 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4175 -13.4160 -13.4157 -10.4556 -10.4534 -10.4483 -10.4463 -10.4447 -10.4436 -0.2072 -0.2040 4.8747 5.2026 5.9776 6.3278 6.8191 6.8950 6.9544 7.0554 7.2381 7.3227 7.3565 7.4210 7.6584 7.7793 8.3270 8.6158 13.0095 13.2286 13.3093 13.4289 15.4165 15.9699 16.0263 16.1163 k = 0.5000 0.0962 0.4763 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4176 -13.4160 -13.4156 -10.4556 -10.4536 -10.4484 -10.4463 -10.4447 -10.4437 -0.2227 -0.2197 4.8468 5.1453 6.0271 6.3488 6.8273 6.8926 6.9675 7.0571 7.2410 7.3293 7.3583 7.4175 7.6960 7.8330 8.3915 8.6918 12.9645 13.1794 13.2505 13.3893 15.4803 16.0709 16.1292 16.2233 k = 0.5000 0.1042 0.4649 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4177 -13.4160 -13.4155 -10.4556 -10.4537 -10.4484 -10.4463 -10.4446 -10.4438 -0.2389 -0.2360 4.8174 5.0887 6.0780 6.3728 6.8325 6.8869 6.9819 7.0612 7.2448 7.3347 7.3600 7.4142 7.7379 7.8887 8.4626 8.7715 12.9206 13.1312 13.1918 13.3512 15.5339 16.1716 16.2293 16.3261 k = 0.5000 0.1123 0.4536 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4183 -13.4179 -13.4160 -13.4156 -10.4556 -10.4538 -10.4485 -10.4464 -10.4447 -10.4439 -0.2555 -0.2527 4.7868 5.0332 6.1295 6.3991 6.8347 6.8802 6.9958 7.0672 7.2494 7.3393 7.3617 7.4111 7.7844 7.9469 8.5396 8.8544 12.8777 13.0844 13.1334 13.3151 15.5690 16.2633 16.3187 16.4171 k = 0.5000 0.1203 0.4423 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4184 -13.4180 -13.4160 -13.4155 -10.4557 -10.4540 -10.4486 -10.4464 -10.4446 -10.4440 -0.2725 -0.2699 4.7554 4.9790 6.1812 6.4271 6.8344 6.8731 7.0088 7.0745 7.2550 7.3433 7.3632 7.4083 7.8359 8.0079 8.6219 8.9398 12.8354 13.0395 13.0759 13.2815 15.5747 16.3015 16.3877 16.4959 k = 0.5000 0.1283 0.4309 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4184 -13.4181 -13.4159 -13.4154 -10.4557 -10.4541 -10.4486 -10.4464 -10.4445 -10.4440 -0.2896 -0.2872 4.7235 4.9264 6.2322 6.4560 6.8319 6.8661 7.0209 7.0823 7.2613 7.3469 7.3646 7.4056 7.8926 8.0722 8.7085 9.0270 12.7933 12.9957 13.0210 13.2511 15.5400 16.2121 16.4476 16.5871 k = 0.5000 0.1363 0.4196 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4186 -13.4182 -13.4159 -13.4154 -10.4558 -10.4543 -10.4488 -10.4465 -10.4444 -10.4440 -0.3068 -0.3045 4.6915 4.8755 6.2822 6.4854 6.8280 6.8590 7.0324 7.0899 7.2684 7.3501 7.3659 7.4032 7.9549 8.1402 8.7987 9.1155 12.7502 12.9479 12.9746 13.2243 15.4603 16.0480 16.4957 16.6911 k = 0.5000 0.1443 0.4082 ( 3170 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4098 -32.4097 -13.4185 -13.4182 -13.4158 -13.4153 -10.4558 -10.4544 -10.4488 -10.4466 -10.4442 -10.4439 -0.3239 -0.3218 4.6598 4.8265 6.3304 6.5145 6.8230 6.8519 7.0432 7.0970 7.2761 7.3531 7.3670 7.4010 8.0231 8.2122 8.8917 9.2045 12.7050 12.8932 12.9409 13.2017 15.3417 15.8593 16.5350 16.7967 k = 0.5000 0.1524 0.3969 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4097 -13.4186 -13.4184 -13.4158 -13.4153 -10.4559 -10.4547 -10.4489 -10.4467 -10.4441 -10.4438 -0.3408 -0.3388 4.6285 4.7796 6.3765 6.5429 6.8176 6.8447 7.0535 7.1034 7.2843 7.3559 7.3680 7.3990 8.0973 8.2885 8.9867 9.2933 12.6566 12.8354 12.9167 13.1840 15.1960 15.6629 16.5626 16.8897 k = 0.5000 0.1604 0.3856 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4187 -13.4185 -13.4158 -13.4153 -10.4561 -10.4549 -10.4490 -10.4469 -10.4440 -10.4438 -0.3574 -0.3555 4.5981 4.7347 6.4201 6.5701 6.8119 6.8375 7.0631 7.1090 7.2927 7.3586 7.3689 7.3973 8.1774 8.3692 9.0831 9.3815 12.6041 12.7754 12.9010 13.1717 15.0350 15.4656 16.5637 16.9361 k = 0.5000 0.1684 0.3742 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4188 -13.4186 -13.4157 -13.4153 -10.4562 -10.4552 -10.4490 -10.4470 -10.4439 -10.4437 -0.3735 -0.3718 4.5687 4.6922 6.4610 6.5959 6.8062 6.8304 7.0720 7.1138 7.3013 7.3611 7.3697 7.3957 8.2634 8.4542 9.1804 9.4683 12.5469 12.7128 12.8942 13.1653 14.8677 15.2711 16.5203 16.8813 k = 0.5000 0.1764 0.3629 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4189 -13.4188 -13.4157 -13.4153 -10.4563 -10.4554 -10.4490 -10.4472 -10.4438 -10.4436 -0.3891 -0.3875 4.5406 4.6519 6.4990 6.6200 6.8006 6.8233 7.0803 7.1178 7.3098 7.3634 7.3705 7.3944 8.3548 8.5431 9.2779 9.5532 12.4846 12.6466 12.8963 13.1653 14.7003 15.0818 16.4287 16.7430 k = 0.5000 0.1844 0.3515 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4190 -13.4189 -13.4157 -13.4152 -10.4565 -10.4557 -10.4491 -10.4473 -10.4436 -10.4435 -0.4040 -0.4025 4.5139 4.6139 6.5340 6.6422 6.7952 6.8164 7.0879 7.1213 7.3181 7.3656 7.3712 7.3934 8.4511 8.6354 9.3755 9.6358 12.4169 12.5757 12.9074 13.1721 14.5376 14.8996 16.3014 16.5723 k = 0.5000 0.1925 0.3402 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4191 -13.4190 -13.4157 -13.4152 -10.4566 -10.4559 -10.4491 -10.4475 -10.4435 -10.4434 -0.4182 -0.4169 4.4888 4.5784 6.5659 6.6625 6.7902 6.8097 7.0947 7.1242 7.3261 7.3676 7.3718 7.3925 8.5516 8.7304 9.4728 9.7158 12.3437 12.4989 12.9277 13.1860 14.3830 14.7261 16.1533 16.3911 k = 0.5000 0.2005 0.3289 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4192 -13.4191 -13.4156 -13.4152 -10.4568 -10.4561 -10.4492 -10.4476 -10.4433 -10.4433 -0.4315 -0.4303 4.4654 4.5454 6.5950 6.6808 6.7855 6.8033 7.1009 7.1267 7.3337 7.3693 7.3724 7.3918 8.6553 8.8272 9.5698 9.7930 12.2645 12.4149 12.9569 13.2073 14.2395 14.5628 15.9948 16.2074 k = 0.5000 0.2085 0.3175 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4100 -32.4097 -32.4097 -13.4193 -13.4193 -13.4156 -13.4153 -10.4570 -10.4564 -10.4492 -10.4478 -10.4433 -10.4432 -0.4440 -0.4429 4.4440 4.5149 6.6211 6.6971 6.7812 6.7971 7.1064 7.1287 7.3408 7.3708 7.3730 7.3913 8.7610 8.9243 9.6664 9.8674 12.1792 12.3230 12.9951 13.2359 14.1091 14.4109 15.8322 16.0248 k = 0.5000 0.2165 0.3062 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4194 -13.4194 -13.4156 -13.4153 -10.4571 -10.4566 -10.4492 -10.4479 -10.4432 -10.4431 -0.4554 -0.4545 4.4245 4.4869 6.6445 6.7114 6.7774 6.7913 7.1113 7.1304 7.3474 7.3719 7.3736 7.3910 8.8671 9.0204 9.7630 9.9394 12.0877 12.2229 13.0420 13.2719 13.9937 14.2716 15.6694 15.8455 k = 0.5000 0.2245 0.2948 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4196 -13.4195 -13.4156 -13.4153 -10.4574 -10.4569 -10.4493 -10.4481 -10.4431 -10.4431 -0.4658 -0.4650 4.4072 4.4615 6.6652 6.7238 6.7740 6.7859 7.1157 7.1318 7.3534 7.3727 7.3742 7.3907 8.9719 9.1135 9.8598 10.0096 11.9901 12.1149 13.0971 13.3146 13.8939 14.1454 15.5092 15.6710 k = 0.5000 0.2325 0.2835 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4195 -13.4195 -13.4155 -13.4152 -10.4574 -10.4570 -10.4492 -10.4482 -10.4429 -10.4429 -0.4751 -0.4744 4.3920 4.4388 6.6834 6.7343 6.7711 6.7809 7.1194 7.1329 7.3589 7.3734 7.3749 7.3905 9.0733 9.2014 9.9572 10.0791 11.8873 12.0001 13.1596 13.3634 13.8102 14.0332 15.3541 15.5028 k = 0.5000 0.2406 0.2722 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4195 -13.4195 -13.4154 -13.4152 -10.4574 -10.4571 -10.4491 -10.4483 -10.4427 -10.4427 -0.4833 -0.4827 4.3791 4.4186 6.6993 6.7430 6.7688 6.7762 7.1227 7.1338 7.3638 7.3738 7.3755 7.3903 9.1687 9.2820 10.0552 10.1487 11.7806 11.8804 13.2282 13.4169 13.7422 13.9351 15.2063 15.3424 k = 0.5000 0.2486 0.2608 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4195 -13.4195 -13.4154 -13.4152 -10.4575 -10.4573 -10.4491 -10.4484 -10.4427 -10.4427 -0.4903 -0.4898 4.3686 4.4010 6.7128 6.7499 6.7670 6.7721 7.1255 7.1344 7.3681 7.3742 7.3760 7.3899 9.2558 9.3527 10.1532 10.2195 11.6722 11.7587 13.3013 13.4729 13.6894 13.8509 15.0689 15.1918 k = 0.5000 0.2566 0.2495 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4196 -13.4196 -13.4154 -13.4152 -10.4576 -10.4574 -10.4490 -10.4485 -10.4426 -10.4426 -0.4960 -0.4956 4.3604 4.3861 6.7243 6.7550 6.7657 6.7684 7.1279 7.1348 7.3716 7.3745 7.3768 7.3894 9.3321 9.4113 10.2496 10.2913 11.5658 11.6386 13.3760 13.5277 13.6513 13.7807 14.9456 15.0536 k = 0.5000 0.2646 0.2381 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4196 -13.4196 -13.4153 -13.4152 -10.4577 -10.4575 -10.4490 -10.4486 -10.4425 -10.4425 -0.5005 -0.5002 4.3547 4.3738 6.7337 6.7580 6.7650 6.7657 7.1299 7.1349 7.3738 7.3747 7.3782 7.3886 9.3956 9.4561 10.3405 10.3621 11.4668 11.5255 13.4484 13.5741 13.6295 13.7244 14.8417 14.9314 k = 0.5000 0.2726 0.2268 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4196 -13.4196 -13.4153 -13.4152 -10.4577 -10.4576 -10.4490 -10.4487 -10.4425 -10.4425 -0.5037 -0.5035 4.3515 4.3642 6.7413 6.7580 6.7645 6.7649 7.1315 7.1348 7.3747 7.3749 7.3804 7.3876 9.4449 9.4858 10.4189 10.4267 11.3843 11.4268 13.5120 13.5937 13.6347 13.6828 14.7644 14.8303 k = 0.5000 0.2807 0.2155 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4153 -13.4153 -10.4577 -10.4577 -10.4489 -10.4488 -10.4425 -10.4425 -0.5056 -0.5055 4.3508 4.3571 6.7472 6.7554 6.7648 6.7649 7.1328 7.1344 7.3750 7.3751 7.3826 7.3863 9.4789 9.4995 10.4737 10.4749 11.3305 11.3535 13.5580 13.5923 13.6510 13.6593 14.7216 14.7570 k = 0.5000 0.2887 0.2041 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4153 -13.4153 -10.4577 -10.4577 -10.4488 -10.4488 -10.4425 -10.4425 -0.5062 -0.5062 4.3527 4.3527 6.7518 6.7518 6.7650 6.7650 7.1337 7.1337 7.3751 7.3751 7.3846 7.3846 9.4972 9.4972 10.4936 10.4936 11.3187 11.3187 13.5824 13.5824 13.6551 13.6551 14.7190 14.7190 k = 0.5000 0.2887 0.2041 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4153 -13.4153 -10.4577 -10.4577 -10.4488 -10.4488 -10.4425 -10.4425 -0.5062 -0.5062 4.3527 4.3527 6.7518 6.7518 6.7650 6.7650 7.1337 7.1337 7.3751 7.3751 7.3846 7.3846 9.4972 9.4972 10.4936 10.4936 11.3187 11.3187 13.5824 13.5824 13.6551 13.6551 14.7190 14.7190 k = 0.4960 0.2863 0.2173 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4153 -13.4153 -10.4577 -10.4577 -10.4489 -10.4488 -10.4425 -10.4425 -0.5056 -0.5055 4.3508 4.3571 6.7472 6.7555 6.7648 6.7649 7.1328 7.1344 7.3750 7.3751 7.3826 7.3863 9.4788 9.4995 10.4737 10.4745 11.3307 11.3538 13.5580 13.5917 13.6541 13.6567 14.7217 14.7574 k = 0.4919 0.2840 0.2305 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4196 -13.4196 -13.4153 -13.4152 -10.4577 -10.4576 -10.4490 -10.4487 -10.4425 -10.4425 -0.5037 -0.5035 4.3515 4.3643 6.7412 6.7580 6.7646 6.7649 7.1315 7.1348 7.3747 7.3749 7.3803 7.3876 9.4444 9.4855 10.4197 10.4243 11.3852 11.4277 13.5145 13.5804 13.6593 13.6685 14.7652 14.8313 k = 0.4879 0.2817 0.2436 ( 3179 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4197 -13.4197 -13.4154 -13.4152 -10.4577 -10.4575 -10.4490 -10.4486 -10.4426 -10.4426 -0.5005 -0.5002 4.3548 4.3740 6.7335 6.7580 6.7651 6.7656 7.1299 7.1349 7.3738 7.3747 7.3782 7.3886 9.3948 9.4552 10.3443 10.3560 11.4690 11.5264 13.4563 13.5423 13.6829 13.6941 14.8436 14.9333 k = 0.4839 0.2794 0.2568 ( 3175 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4196 -13.4196 -13.4154 -13.4152 -10.4576 -10.4574 -10.4490 -10.4485 -10.4426 -10.4426 -0.4959 -0.4955 4.3606 4.3864 6.7240 6.7549 6.7658 6.7685 7.1279 7.1348 7.3716 7.3743 7.3769 7.3894 9.3310 9.4091 10.2589 10.2793 11.5697 11.6380 13.3925 13.4894 13.7213 13.7324 14.9490 15.0564 k = 0.4798 0.2770 0.2700 ( 3175 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4195 -13.4195 -13.4154 -13.4152 -10.4575 -10.4572 -10.4491 -10.4484 -10.4427 -10.4427 -0.4901 -0.4896 4.3688 4.4015 6.7124 6.7497 6.7671 6.7722 7.1255 7.1344 7.3681 7.3738 7.3763 7.3899 9.2545 9.3481 10.1713 10.2003 11.6775 11.7534 13.3312 13.4324 13.7715 13.7821 15.0746 15.1957 k = 0.4758 0.2747 0.2831 ( 3177 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4195 -13.4195 -13.4154 -13.4152 -10.4574 -10.4571 -10.4491 -10.4483 -10.4428 -10.4427 -0.4831 -0.4824 4.3795 4.4192 6.6986 6.7427 6.7689 6.7765 7.1226 7.1338 7.3638 7.3732 7.3759 7.3903 9.1674 9.2735 10.0854 10.1217 11.7853 11.8649 13.2794 13.3795 13.8323 13.8423 15.2150 15.3475 k = 0.4718 0.2724 0.2963 ( 3173 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4194 -13.4194 -13.4155 -13.4152 -10.4573 -10.4569 -10.4491 -10.4481 -10.4428 -10.4428 -0.4748 -0.4741 4.3926 4.4396 6.6825 6.7338 6.7712 6.7813 7.1193 7.1329 7.3588 7.3723 7.3757 7.3906 9.0719 9.1876 10.0030 10.0447 11.8866 11.9648 13.2448 13.3374 13.9028 13.9122 15.3663 15.5095 k = 0.4677 0.2701 0.3095 ( 3171 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4193 -13.4193 -13.4155 -13.4151 -10.4571 -10.4567 -10.4491 -10.4480 -10.4429 -10.4429 -0.4654 -0.4645 4.4079 4.4627 6.6638 6.7231 6.7741 6.7865 7.1155 7.1317 7.3533 7.3712 7.3755 7.3909 8.9703 9.0928 9.9243 9.9696 11.9749 12.0455 13.2349 13.3129 13.9824 13.9911 15.5255 15.6797 k = 0.4637 0.2677 0.3226 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4193 -13.4193 -13.4156 -13.4152 -10.4570 -10.4566 -10.4492 -10.4479 -10.4431 -10.4430 -0.4549 -0.4539 4.4254 4.4883 6.6424 6.7103 6.7775 6.7923 7.1112 7.1302 7.3472 7.3697 7.3753 7.3912 8.8648 8.9917 9.8490 9.8963 12.0441 12.1000 13.2563 13.3120 14.0704 14.0783 15.6897 15.8566 k = 0.4597 0.2654 0.3358 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4192 -13.4192 -13.4156 -13.4152 -10.4569 -10.4564 -10.4492 -10.4478 -10.4432 -10.4431 -0.4433 -0.4422 4.4451 4.5166 6.6181 6.6954 6.7814 6.7985 7.1063 7.1285 7.3405 7.3679 7.3752 7.3917 8.7576 8.8871 9.7763 9.8244 12.0896 12.1255 13.3120 13.3391 14.1662 14.1731 15.8556 16.0385 k = 0.4556 0.2631 0.3490 ( 3174 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4191 -13.4191 -13.4156 -13.4152 -10.4567 -10.4561 -10.4491 -10.4476 -10.4433 -10.4433 -0.4308 -0.4295 4.4667 4.5474 6.5907 6.6783 6.7858 6.8051 7.1008 7.1263 7.3333 7.3658 7.3751 7.3923 8.6505 8.7810 9.7057 9.7537 12.1100 12.1241 13.3955 13.3995 14.2693 14.2750 16.0185 16.2233 k = 0.4516 0.2607 0.3622 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6977 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4190 -13.4190 -13.4157 -13.4152 -10.4566 -10.4559 -10.4491 -10.4475 -10.4435 -10.4434 -0.4173 -0.4160 4.4902 4.5808 6.5599 6.6589 6.7907 6.8122 7.0947 7.1237 7.3257 7.3633 7.3750 7.3932 8.5451 8.6755 9.6367 9.6841 12.1015 12.1078 13.4784 13.5129 14.3789 14.3833 16.1698 16.4065 k = 0.4476 0.2584 0.3753 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4097 -32.4097 -13.4190 -13.4190 -13.4157 -13.4153 -10.4564 -10.4557 -10.4492 -10.4474 -10.4436 -10.4435 -0.4030 -0.4015 4.5154 4.6167 6.5254 6.6371 6.7960 6.8197 7.0879 7.1207 7.3176 7.3604 7.3750 7.3943 8.4427 8.5722 9.5689 9.6154 12.0643 12.0876 13.5828 13.6454 14.4947 14.4974 16.2946 16.5775 k = 0.4435 0.2561 0.3885 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4097 -32.4097 -13.4189 -13.4188 -13.4157 -13.4153 -10.4562 -10.4555 -10.4491 -10.4472 -10.4436 -10.4436 -0.3880 -0.3864 4.5421 4.6550 6.4872 6.6129 6.8017 6.8276 7.0805 7.1171 7.3092 7.3572 7.3750 7.3957 8.3447 8.4725 9.5023 9.5477 12.0176 12.0544 13.7031 13.7915 14.6160 14.6169 16.3690 16.7031 k = 0.4395 0.2538 0.4017 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4099 -32.4099 -32.4098 -32.4098 -13.4188 -13.4187 -13.4157 -13.4153 -10.4561 -10.4553 -10.4491 -10.4471 -10.4437 -10.4437 -0.3724 -0.3706 4.5701 4.6956 6.4450 6.5861 6.8078 6.8357 7.0724 7.1130 7.3006 7.3538 7.3751 7.3972 8.2519 8.3775 9.4367 9.4809 11.9655 12.0126 13.8344 13.9471 14.7413 14.7424 16.3738 16.7151 k = 0.4355 0.2514 0.4148 ( 3176 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4187 -13.4186 -13.4158 -13.4153 -10.4559 -10.4551 -10.4491 -10.4471 -10.4438 -10.4437 -0.3562 -0.3543 4.5992 4.7385 6.3989 6.5569 6.8142 6.8441 7.0636 7.1082 7.2919 7.3501 7.3752 7.3990 8.1652 8.2883 9.3720 9.4152 11.9104 11.9655 13.9726 14.1091 14.8700 14.8733 16.3169 16.6185 k = 0.4315 0.2491 0.4280 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4187 -13.4186 -13.4159 -13.4154 -10.4558 -10.4550 -10.4491 -10.4471 -10.4439 -10.4439 -0.3397 -0.3377 4.6291 4.7836 6.3487 6.5253 6.8210 6.8527 7.0543 7.1027 7.2833 7.3462 7.3754 7.4009 8.0852 8.2054 9.3085 9.3507 11.8542 11.9154 14.1142 14.2754 15.0024 15.0080 16.2226 16.4793 k = 0.4274 0.2468 0.4412 ( 3185 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4186 -13.4185 -13.4159 -13.4154 -10.4557 -10.4549 -10.4491 -10.4471 -10.4439 -10.4438 -0.3229 -0.3207 4.6595 4.8307 6.2949 6.4917 6.8280 6.8614 7.0444 7.0966 7.2751 7.3422 7.3757 7.4029 8.0123 8.1294 9.2462 9.2875 11.7979 11.8639 14.2560 14.4445 15.1378 15.1458 16.1111 16.3271 k = 0.4234 0.2444 0.4543 ( 3183 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4185 -13.4184 -13.4159 -13.4154 -10.4555 -10.4547 -10.4491 -10.4471 -10.4438 -10.4437 -0.3059 -0.3036 4.6900 4.8796 6.2377 6.4565 6.8352 6.8701 7.0341 7.0900 7.2673 7.3382 7.3760 7.4051 7.9468 8.0606 9.1852 9.2256 11.7424 11.8121 14.3947 14.6148 15.2750 15.2850 15.9957 16.1721 k = 0.4194 0.2421 0.4675 ( 3178 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4184 -13.4182 -13.4159 -13.4154 -10.4554 -10.4546 -10.4491 -10.4471 -10.4437 -10.4435 -0.2890 -0.2865 4.7201 4.9301 6.1778 6.4203 6.8426 6.8785 7.0235 7.0831 7.2602 7.3342 7.3764 7.4072 7.8886 7.9990 9.1256 9.1654 11.6882 11.7609 14.5256 14.7851 15.4111 15.4221 15.8883 16.0201 k = 0.4153 0.2398 0.4807 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4184 -13.4182 -13.4160 -13.4155 -10.4553 -10.4546 -10.4492 -10.4474 -10.4437 -10.4434 -0.2722 -0.2697 4.7493 4.9818 6.1161 6.3839 6.8501 6.8866 7.0127 7.0761 7.2538 7.3303 7.3768 7.4092 7.8375 7.9447 9.0677 9.1068 11.6356 11.7108 14.6420 14.9542 15.5353 15.5426 15.8111 15.8836 k = 0.4113 0.2375 0.4938 ( 3180 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6977 -32.4100 -32.4099 -32.4098 -32.4098 -13.4183 -13.4181 -13.4159 -13.4155 -10.4552 -10.4544 -10.4492 -10.4474 -10.4435 -10.4431 -0.2558 -0.2531 4.7772 5.0342 6.0536 6.3484 6.8577 6.8941 7.0019 7.0695 7.2482 7.3265 7.3771 7.4111 7.7933 7.8972 9.0114 9.0501 11.5849 11.6621 14.7330 15.1205 15.5837 15.5948 15.8269 15.8272 k = 0.4073 0.2351 0.5070 ( 3182 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4180 -13.4159 -13.4155 -10.4551 -10.4544 -10.4493 -10.4476 -10.4433 -10.4429 -0.2399 -0.2371 4.8031 5.0866 5.9916 6.3149 6.8652 6.9007 6.9912 7.0635 7.2435 7.3230 7.3774 7.4126 7.7556 7.8563 8.9571 8.9953 11.5362 11.6150 14.7837 15.2801 15.4914 15.5879 15.9183 15.9404 k = 0.4032 0.2328 0.5202 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4159 -13.4156 -10.4551 -10.4544 -10.4494 -10.4479 -10.4431 -10.4426 -0.2248 -0.2218 4.8263 5.1379 5.9321 6.2846 6.8727 6.9062 6.9809 7.0588 7.2396 7.3196 7.3774 7.4136 7.7241 7.8215 8.9047 8.9428 11.4897 11.5699 14.7823 15.3324 15.4593 15.6025 16.0548 16.0816 k = 0.3992 0.2305 0.5334 ( 3184 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4159 -13.4156 -10.4551 -10.4545 -10.4495 -10.4480 -10.4429 -10.4423 -0.2105 -0.2074 4.8464 5.1863 5.8774 6.2588 6.8800 6.9102 6.9711 7.0556 7.2365 7.3166 7.3773 7.4140 7.6984 7.7926 8.8545 8.8925 11.4454 11.5268 14.7322 15.1967 15.6025 15.6547 16.2000 16.2288 k = 0.3952 0.2281 0.5465 ( 3189 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4159 -13.4156 -10.4551 -10.4546 -10.4496 -10.4483 -10.4426 -10.4421 -0.1972 -0.1941 4.8628 5.2293 5.8307 6.2385 6.8870 6.9128 6.9620 7.0543 7.2342 7.3138 7.3770 7.4136 7.6780 7.7690 8.8067 8.8448 11.4033 11.4857 14.6487 15.0532 15.7327 15.7453 16.3466 16.3760 k = 0.3911 0.2258 0.5597 ( 3191 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4159 -13.4156 -10.4551 -10.4546 -10.4498 -10.4485 -10.4424 -10.4418 -0.1853 -0.1821 4.8751 5.2629 5.7966 6.2247 6.8937 6.9138 6.9537 7.0548 7.2325 7.3113 7.3763 7.4124 7.6627 7.7505 8.7614 8.7996 11.3634 11.4467 14.5461 14.9106 15.8224 15.8795 16.4907 16.5197 k = 0.3871 0.2235 0.5729 ( 3195 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4179 -13.4160 -13.4157 -10.4552 -10.4547 -10.4500 -10.4487 -10.4421 -10.4415 -0.1748 -0.1716 4.8831 5.2828 5.7800 6.2182 6.8998 6.9136 6.9464 7.0571 7.2314 7.3091 7.3753 7.4103 7.6521 7.7368 8.7187 8.7573 11.3257 11.4098 14.4337 14.7702 15.9143 16.0027 16.6289 16.6567 k = 0.3831 0.2212 0.5860 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4179 -13.4160 -13.4158 -10.4552 -10.4548 -10.4501 -10.4490 -10.4419 -10.4413 -0.1660 -0.1628 4.8871 5.2859 5.7844 6.2192 6.9053 6.9123 6.9405 7.0609 7.2308 7.3071 7.3741 7.4073 7.6458 7.7276 8.6787 8.7180 11.2903 11.3750 14.3166 14.6327 16.0024 16.1133 16.7574 16.7833 k = 0.3790 0.2188 0.5992 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4160 -13.4158 -10.4552 -10.4549 -10.4502 -10.4492 -10.4417 -10.4410 -0.1591 -0.1558 4.8873 5.2731 5.8091 6.2278 6.9099 6.9103 6.9362 7.0658 7.2305 7.3052 7.3726 7.4038 7.6434 7.7228 8.6418 8.6818 11.2569 11.3423 14.1978 14.4983 16.0834 16.2102 16.8723 16.8962 k = 0.3750 0.2165 0.6124 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4550 -10.4504 -10.4494 -10.4414 -10.4408 -0.1542 -0.1509 4.8844 5.2489 5.8501 6.2435 6.9081 6.9130 6.9342 7.0716 7.2304 7.3033 7.3711 7.3999 7.6445 7.7222 8.6080 8.6490 11.2257 11.3116 14.0791 14.3675 16.1552 16.2930 16.9699 16.9924 k = 0.6250-0.0722 0.4082 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4550 -10.4504 -10.4494 -10.4414 -10.4408 -0.1542 -0.1509 4.8844 5.2489 5.8501 6.2435 6.9081 6.9130 6.9342 7.0716 7.2304 7.3033 7.3711 7.3999 7.6445 7.7222 8.6080 8.6490 11.2257 11.3116 14.0791 14.3675 16.1552 16.2930 16.9699 16.9924 k = 0.6181-0.0842 0.4082 ( 3200 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4099 -32.4098 -13.4183 -13.4178 -13.4159 -13.4158 -10.4553 -10.4552 -10.4505 -10.4498 -10.4409 -10.4404 -0.1483 -0.1450 4.8763 5.2011 5.9337 6.2795 6.9039 6.9143 6.9362 7.0832 7.2304 7.2996 7.3689 7.3940 7.6491 7.7252 8.5538 8.5969 11.1736 11.2603 13.8766 14.1482 16.2727 16.4235 17.1234 17.1440 k = 0.6111-0.0962 0.4082 ( 3196 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4183 -13.4178 -13.4158 -13.4158 -10.4554 -10.4553 -10.4507 -10.4500 -10.4405 -10.4399 -0.1436 -0.1404 4.8663 5.1553 6.0203 6.3211 6.8996 6.9116 6.9434 7.0968 7.2303 7.2953 7.3673 7.3899 7.6536 7.7292 8.5025 8.5478 11.1213 11.2082 13.6774 13.9354 16.3944 16.5549 17.2794 17.2981 k = 0.6042-0.1083 0.4082 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4099 -32.4098 -32.4098 -13.4182 -13.4177 -13.4157 -13.4157 -10.4555 -10.4554 -10.4508 -10.4503 -10.4400 -10.4394 -0.1400 -0.1369 4.8549 5.1114 6.1091 6.3672 6.8954 6.9080 6.9531 7.1125 7.2302 7.2906 7.3666 7.3875 7.6580 7.7341 8.4541 8.5018 11.0683 11.1550 13.4837 13.7300 16.5190 16.6868 17.4378 17.4546 k = 0.5972-0.1203 0.4082 ( 3188 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4182 -13.4177 -13.4157 -13.4157 -10.4557 -10.4555 -10.4509 -10.4506 -10.4396 -10.4391 -0.1373 -0.1344 4.8424 5.0698 6.1988 6.4162 6.8912 6.9044 6.9644 7.1301 7.2301 7.2858 7.3668 7.3864 7.6621 7.7396 8.4092 8.4594 11.0144 11.1001 13.2973 13.5327 16.6456 16.8186 17.5982 17.6132 k = 0.5903-0.1323 0.4082 ( 3186 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4182 -13.4177 -13.4157 -13.4156 -10.4558 -10.4555 -10.4511 -10.4508 -10.4391 -10.4387 -0.1355 -0.1327 4.8293 5.0304 6.2882 6.4667 6.8873 6.9012 6.9774 7.1497 7.2302 7.2812 7.3680 7.3864 7.6660 7.7456 8.3681 8.4207 10.9592 11.0430 13.1197 13.3444 16.7735 16.9499 17.7604 17.7738 k = 0.5833-0.1443 0.4082 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4183 -13.4177 -13.4157 -13.4156 -10.4561 -10.4557 -10.4512 -10.4511 -10.4388 -10.4384 -0.1344 -0.1317 4.8159 4.9934 6.3756 6.5172 6.8836 6.8985 6.9925 7.1707 7.2308 7.2772 7.3705 7.3872 7.6695 7.7520 8.3315 8.3863 10.9023 10.9831 12.9524 13.1661 16.9017 17.0801 17.9241 17.9362 k = 0.5764-0.1564 0.4082 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4183 -13.4177 -13.4157 -13.4156 -10.4563 -10.4558 -10.4513 -10.4513 -10.4385 -10.4381 -0.1338 -0.1314 4.8027 4.9589 6.4590 6.5660 6.8802 6.8965 7.0104 7.1918 7.2331 7.2741 7.3742 7.3886 7.6727 7.7582 8.3002 8.3564 10.8436 10.9201 12.7970 12.9989 17.0298 17.2084 18.0891 18.1000 k = 0.5694-0.1684 0.4082 ( 3190 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4183 -13.4178 -13.4157 -13.4156 -10.4564 -10.4560 -10.4515 -10.4514 -10.4382 -10.4378 -0.1337 -0.1314 4.7900 4.9267 6.5360 6.6120 6.8772 6.8951 7.0318 7.2084 7.2409 7.2723 7.3794 7.3905 7.6753 7.7639 8.2749 8.3317 10.7827 10.8537 12.6547 12.8436 17.1567 17.3339 18.2549 18.2649 k = 0.5625-0.1804 0.4082 ( 3198 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4184 -13.4179 -13.4158 -13.4156 -10.4567 -10.4562 -10.4517 -10.4516 -10.4380 -10.4376 -0.1340 -0.1319 4.7782 4.8971 6.6042 6.6539 6.8746 6.8943 7.0574 7.2157 7.2584 7.2725 7.3862 7.3925 7.6775 7.7682 8.2569 8.3126 10.7199 10.7840 12.5268 12.7011 17.2815 17.4554 18.4209 18.4306 k = 0.5556-0.1925 0.4082 ( 3198 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4184 -13.4180 -13.4158 -13.4156 -10.4569 -10.4564 -10.4518 -10.4517 -10.4377 -10.4374 -0.1344 -0.1326 4.7674 4.8700 6.6613 6.6911 6.8725 6.8940 7.0869 7.2176 7.2755 7.2805 7.3947 7.3947 7.6791 7.7702 8.2469 8.2995 10.6556 10.7116 12.4141 12.5723 17.4031 17.5714 18.5866 18.5963 k = 0.5486-0.2045 0.4082 ( 3202 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4181 -13.4158 -13.4156 -10.4571 -10.4566 -10.4520 -10.4518 -10.4375 -10.4372 -0.1351 -0.1334 4.7580 4.8455 6.7066 6.7230 6.8710 6.8941 7.1183 7.2177 7.2831 7.3021 7.3967 7.4049 7.6802 7.7693 8.2455 8.2927 10.5905 10.6376 12.3171 12.4577 17.5202 17.6802 18.7511 18.7614 k = 0.5417-0.2165 0.4082 ( 3206 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4181 -13.4158 -13.4157 -10.4573 -10.4568 -10.4521 -10.4519 -10.4372 -10.4370 -0.1357 -0.1343 4.7502 4.8235 6.7405 6.7496 6.8702 6.8944 7.1474 7.2172 7.2970 7.3214 7.3986 7.4164 7.6809 7.7651 8.2524 8.2919 10.5262 10.5641 12.2359 12.3577 17.6312 17.7797 18.9132 18.9246 k = 0.5347-0.2285 0.4082 ( 3206 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4182 -13.4158 -13.4157 -10.4574 -10.4570 -10.4522 -10.4520 -10.4371 -10.4369 -0.1364 -0.1352 4.7442 4.8040 6.7649 6.7709 6.8705 6.8947 7.1703 7.2163 7.3183 7.3375 7.4002 7.4282 7.6814 7.7575 8.2659 8.2966 10.4645 10.4934 12.1701 12.2723 17.7341 17.8676 19.0714 19.0841 k = 0.5278-0.2406 0.4082 ( 3206 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4100 -32.4100 -32.4098 -32.4098 -13.4185 -13.4182 -13.4158 -13.4157 -10.4574 -10.4571 -10.4522 -10.4521 -10.4369 -10.4367 -0.1370 -0.1361 4.7400 4.7871 6.7820 6.7870 6.8719 6.8945 7.1856 7.2152 7.3444 7.3508 7.4020 7.4389 7.6823 7.7473 8.2836 8.3054 10.4080 10.4288 12.1193 12.2013 17.8268 17.9411 19.2229 19.2370 k = 0.5208-0.2526 0.4082 ( 3214 PWs) bands (ev): -65.7562 -65.7562 -32.6978 -32.6978 -32.4101 -32.4100 -32.4098 -32.4098 -13.4185 -13.4184 -13.4159 -13.4158 -10.4575 -10.4573 -10.4523 -10.4522 -10.4369 -10.4367 -0.1375 -0.1368 4.7378 4.7728 6.7937 6.7982 6.8745 6.8938 7.1952 7.2139 7.3616 7.3689 7.4058 7.4470 7.6841 7.7354 8.3023 8.3163 10.3597 10.3735 12.0830 12.1445 17.9069 17.9977 19.3634 19.3782 k = 0.5139-0.2646 0.4082 ( 3218 PWs) bands (ev): -65.7562 -65.7562 -32.6979 -32.6979 -32.4101 -32.4101 -32.4099 -32.4099 -13.4186 -13.4185 -13.4159 -13.4158 -10.4576 -10.4574 -10.4524 -10.4523 -10.4368 -10.4367 -0.1379 -0.1374 4.7378 4.7609 6.8015 6.8050 6.8782 6.8921 7.2012 7.2124 7.3704 7.3826 7.4164 7.4512 7.6874 7.7229 8.3188 8.3266 10.3225 10.3307 12.0604 12.1014 17.9717 18.0350 19.4852 19.4988 k = 0.5069-0.2766 0.4082 ( 3226 PWs) bands (ev): -65.7562 -65.7562 -32.6979 -32.6979 -32.4101 -32.4101 -32.4099 -32.4099 -13.4187 -13.4186 -13.4159 -13.4159 -10.4577 -10.4576 -10.4524 -10.4524 -10.4368 -10.4367 -0.1381 -0.1378 4.7401 4.7516 6.8063 6.8082 6.8822 6.8896 7.2053 7.2105 7.3773 7.3848 7.4317 7.4505 7.6929 7.7111 8.3303 8.3338 10.2995 10.3032 12.0511 12.0716 18.0186 18.0512 19.5745 19.5832 k = 0.5000-0.2887 0.4082 ( 3218 PWs) bands (ev): -65.7562 -65.7562 -32.6979 -32.6979 -32.4101 -32.4101 -32.4099 -32.4099 -13.4185 -13.4185 -13.4158 -13.4158 -10.4576 -10.4576 -10.4523 -10.4523 -10.4367 -10.4367 -0.1381 -0.1381 4.7446 4.7446 6.8086 6.8086 6.8862 6.8862 7.2083 7.2083 7.3823 7.3823 7.4439 7.4439 7.7009 7.7009 8.3354 8.3354 10.2927 10.2927 12.0549 12.0549 18.0456 18.0456 19.6115 19.6115 Writing output data file MgCuBi.save init_run : 1.04s CPU 0.60s WALL ( 1 calls) electrons : 229.13s CPU 136.29s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.11s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 229.13s CPU 136.28s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.20s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.20s CPU 0.28s WALL ( 337 calls) cegterg : 202.53s CPU 119.48s WALL ( 342 calls) Called by sum_band: Called by *egterg: h_psi : 144.46s CPU 81.12s WALL ( 5680 calls) s_psi : 4.67s CPU 2.58s WALL ( 5680 calls) g_psi : 0.22s CPU 0.13s WALL ( 5001 calls) cdiaghg : 56.77s CPU 36.69s WALL ( 5338 calls) cegterg:over : 6.98s CPU 4.03s WALL ( 5001 calls) cegterg:upda : 4.82s CPU 2.93s WALL ( 5001 calls) cegterg:last : 2.98s CPU 1.82s WALL ( 1016 calls) cdiaghg:chol : 3.05s CPU 1.99s WALL ( 5338 calls) cdiaghg:inve : 1.52s CPU 1.04s WALL ( 5338 calls) cdiaghg:para : 3.25s CPU 2.05s WALL ( 10676 calls) Called by h_psi: h_psi:vloc : 133.64s CPU 74.88s WALL ( 5680 calls) h_psi:vnl : 10.62s CPU 6.12s WALL ( 5680 calls) add_vuspsi : 6.22s CPU 3.58s WALL ( 5680 calls) General routines calbec : 4.38s CPU 2.52s WALL ( 5680 calls) fft : 0.04s CPU 0.02s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 125.70s CPU 70.12s WALL ( 552516 calls) interpolate : 0.02s CPU 0.01s WALL ( 4 calls) davcio : 0.33s CPU 0.60s WALL ( 674 calls) Parallel routines fft_scatter : 50.84s CPU 29.42s WALL ( 552539 calls) PWSCF : 4m 3.23s CPU 2m40.88s WALL This run was terminated on: 2: 7:40 12Feb2017 =------------------------------------------------------------------------------= JOB DONE. 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