Program PWSCF v.5.1.1 starts on 19Jul2015 at 21:20:39 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./Ni4W.save/ file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 31 18 5 997 453 72 Max 32 19 6 1005 475 77 Sum 1523 907 267 48073 22223 3577 bravais-lattice index = 14 lattice parameter (alat) = 8.3603 a.u. unit-cell volume = 393.6144 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 2 number of electrons = 54.00 number of Kohn-Sham states= 64 kinetic-energy cutoff = 56.0000 Ry charge density cutoff = 374.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.360282 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.161245 celldm(5)= -0.161245 celldm(6)= -0.677510 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.677510 0.735514 0.000000 ) a(3) = ( -0.161245 -0.367757 0.915836 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.921139 0.545949 ) b(2) = ( 0.000000 1.359594 0.545949 ) b(3) = ( 0.000000 0.000000 1.091899 ) PseudoPot. # 1 for W read from file: /home/autes/Pseudo/W.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 434a31466ac5fb6822520d5f43d3a35f Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1273 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 Ni read from file: /home/autes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 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 1195 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 W 14.00 183.84000 W( 1.00) Ni 10.00 58.69340 Ni( 1.00) 2 Sym. Ops., with 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 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 381 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 2) = ( 0.0000000 0.0000000 0.0139987), wk = 0.0026247 k( 3) = ( 0.0000000 0.0000000 0.0279974), wk = 0.0026247 k( 4) = ( 0.0000000 0.0000000 0.0419961), wk = 0.0026247 k( 5) = ( 0.0000000 0.0000000 0.0559948), wk = 0.0026247 k( 6) = ( 0.0000000 0.0000000 0.0699935), wk = 0.0026247 k( 7) = ( 0.0000000 0.0000000 0.0839922), wk = 0.0026247 k( 8) = ( 0.0000000 0.0000000 0.0979909), wk = 0.0026247 k( 9) = ( 0.0000000 0.0000000 0.1119896), wk = 0.0026247 k( 10) = ( 0.0000000 0.0000000 0.1259883), wk = 0.0026247 k( 11) = ( 0.0000000 0.0000000 0.1399870), wk = 0.0026247 k( 12) = ( 0.0000000 0.0000000 0.1539857), wk = 0.0026247 k( 13) = ( 0.0000000 0.0000000 0.1679844), wk = 0.0026247 k( 14) = ( 0.0000000 0.0000000 0.1819832), wk = 0.0026247 k( 15) = ( 0.0000000 0.0000000 0.1959819), wk = 0.0026247 k( 16) = ( 0.0000000 0.0000000 0.2099806), wk = 0.0026247 k( 17) = ( 0.0000000 0.0000000 0.2239793), wk = 0.0026247 k( 18) = ( 0.0000000 0.0000000 0.2379780), wk = 0.0026247 k( 19) = ( 0.0000000 0.0000000 0.2519767), wk = 0.0026247 k( 20) = ( 0.0000000 0.0000000 0.2659754), wk = 0.0026247 k( 21) = ( 0.0000000 0.0000000 0.2799741), wk = 0.0026247 k( 22) = ( 0.0000000 0.0000000 0.2939728), wk = 0.0026247 k( 23) = ( 0.0000000 0.0000000 0.3079715), wk = 0.0026247 k( 24) = ( 0.0000000 0.0000000 0.3219702), wk = 0.0026247 k( 25) = ( 0.0000000 0.0000000 0.3359689), wk = 0.0026247 k( 26) = ( 0.0000000 0.0000000 0.3499676), wk = 0.0026247 k( 27) = ( 0.0000000 0.0000000 0.3639663), wk = 0.0026247 k( 28) = ( 0.0000000 0.0000000 0.3779650), wk = 0.0026247 k( 29) = ( 0.0000000 0.0000000 0.3919637), wk = 0.0026247 k( 30) = ( 0.0000000 0.0000000 0.4059624), wk = 0.0026247 k( 31) = ( 0.0000000 0.0000000 0.4199611), wk = 0.0026247 k( 32) = ( 0.0000000 0.0000000 0.4339598), wk = 0.0026247 k( 33) = ( 0.0000000 0.0000000 0.4479585), wk = 0.0026247 k( 34) = ( 0.0000000 0.0000000 0.4619572), wk = 0.0026247 k( 35) = ( 0.0000000 0.0000000 0.4759560), wk = 0.0026247 k( 36) = ( 0.0000000 0.0000000 0.4899547), wk = 0.0026247 k( 37) = ( 0.0000000 0.0000000 0.5039534), wk = 0.0026247 k( 38) = ( 0.0000000 0.0000000 0.5179521), wk = 0.0026247 k( 39) = ( 0.0000000 0.0000000 0.5319508), wk = 0.0026247 k( 40) = ( 0.0000000 0.0000000 0.5459495), wk = 0.0026247 k( 41) = ( 0.0000000 0.0000000 0.5459495), wk = 0.0026247 k( 42) = ( -0.0128205 0.0056212 0.5459495), wk = 0.0026247 k( 43) = ( -0.0256410 0.0112425 0.5459495), wk = 0.0026247 k( 44) = ( -0.0384615 0.0168637 0.5459495), wk = 0.0026247 k( 45) = ( -0.0512821 0.0224849 0.5459495), wk = 0.0026247 k( 46) = ( -0.0641026 0.0281061 0.5459495), wk = 0.0026247 k( 47) = ( -0.0769231 0.0337274 0.5459495), wk = 0.0026247 k( 48) = ( -0.0897436 0.0393486 0.5459495), wk = 0.0026247 k( 49) = ( -0.1025641 0.0449698 0.5459495), wk = 0.0026247 k( 50) = ( -0.1153846 0.0505910 0.5459495), wk = 0.0026247 k( 51) = ( -0.1282051 0.0562123 0.5459495), wk = 0.0026247 k( 52) = ( -0.1410256 0.0618335 0.5459495), wk = 0.0026247 k( 53) = ( -0.1538461 0.0674547 0.5459495), wk = 0.0026247 k( 54) = ( -0.1666667 0.0730759 0.5459495), wk = 0.0026247 k( 55) = ( -0.1794872 0.0786972 0.5459495), wk = 0.0026247 k( 56) = ( -0.1923077 0.0843184 0.5459495), wk = 0.0026247 k( 57) = ( -0.2051282 0.0899396 0.5459495), wk = 0.0026247 k( 58) = ( -0.2179487 0.0955608 0.5459495), wk = 0.0026247 k( 59) = ( -0.2307692 0.1011821 0.5459495), wk = 0.0026247 k( 60) = ( -0.2435897 0.1068033 0.5459495), wk = 0.0026247 k( 61) = ( -0.2564103 0.1124245 0.5459495), wk = 0.0026247 k( 62) = ( -0.2692308 0.1180457 0.5459495), wk = 0.0026247 k( 63) = ( -0.2820513 0.1236670 0.5459495), wk = 0.0026247 k( 64) = ( -0.2948718 0.1292882 0.5459495), wk = 0.0026247 k( 65) = ( -0.3076923 0.1349094 0.5459495), wk = 0.0026247 k( 66) = ( -0.3205128 0.1405306 0.5459495), wk = 0.0026247 k( 67) = ( -0.3333333 0.1461519 0.5459495), wk = 0.0026247 k( 68) = ( -0.3461538 0.1517731 0.5459495), wk = 0.0026247 k( 69) = ( -0.3589744 0.1573943 0.5459495), wk = 0.0026247 k( 70) = ( -0.3717949 0.1630155 0.5459495), wk = 0.0026247 k( 71) = ( -0.3846154 0.1686368 0.5459495), wk = 0.0026247 k( 72) = ( -0.3974359 0.1742580 0.5459495), wk = 0.0026247 k( 73) = ( -0.4102564 0.1798792 0.5459495), wk = 0.0026247 k( 74) = ( -0.4230769 0.1855004 0.5459495), wk = 0.0026247 k( 75) = ( -0.4358974 0.1911217 0.5459495), wk = 0.0026247 k( 76) = ( -0.4487179 0.1967429 0.5459495), wk = 0.0026247 k( 77) = ( -0.4615385 0.2023641 0.5459495), wk = 0.0026247 k( 78) = ( -0.4743590 0.2079853 0.5459495), wk = 0.0026247 k( 79) = ( -0.4871795 0.2136066 0.5459495), wk = 0.0026247 k( 80) = ( -0.5000000 0.2192278 0.5459495), wk = 0.0026247 k( 81) = ( -0.5000000 0.2192278 0.5459495), wk = 0.0026247 k( 82) = ( -0.4909091 0.2152418 0.5360231), wk = 0.0026247 k( 83) = ( -0.4818182 0.2112559 0.5260968), wk = 0.0026247 k( 84) = ( -0.4727273 0.2072699 0.5161704), wk = 0.0026247 k( 85) = ( -0.4636364 0.2032839 0.5062440), wk = 0.0026247 k( 86) = ( -0.4545455 0.1992980 0.4963177), wk = 0.0026247 k( 87) = ( -0.4454546 0.1953120 0.4863913), wk = 0.0026247 k( 88) = ( -0.4363636 0.1913261 0.4764650), wk = 0.0026247 k( 89) = ( -0.4272727 0.1873401 0.4665386), wk = 0.0026247 k( 90) = ( -0.4181818 0.1833541 0.4566123), wk = 0.0026247 k( 91) = ( -0.4090909 0.1793682 0.4466859), wk = 0.0026247 k( 92) = ( -0.4000000 0.1753822 0.4367596), wk = 0.0026247 k( 93) = ( -0.3909091 0.1713963 0.4268332), wk = 0.0026247 k( 94) = ( -0.3818182 0.1674103 0.4169069), wk = 0.0026247 k( 95) = ( -0.3727273 0.1634243 0.4069805), wk = 0.0026247 k( 96) = ( -0.3636364 0.1594384 0.3970542), wk = 0.0026247 k( 97) = ( -0.3545454 0.1554524 0.3871278), wk = 0.0026247 k( 98) = ( -0.3454546 0.1514665 0.3772015), wk = 0.0026247 k( 99) = ( -0.3363636 0.1474805 0.3672751), wk = 0.0026247 k( 100) = ( -0.3272727 0.1434946 0.3573487), wk = 0.0026247 k( 101) = ( -0.3181818 0.1395086 0.3474224), wk = 0.0026247 k( 102) = ( -0.3090909 0.1355226 0.3374960), wk = 0.0026247 k( 103) = ( -0.3000000 0.1315367 0.3275697), wk = 0.0026247 k( 104) = ( -0.2909091 0.1275507 0.3176433), wk = 0.0026247 k( 105) = ( -0.2818182 0.1235647 0.3077170), wk = 0.0026247 k( 106) = ( -0.2727273 0.1195788 0.2977906), wk = 0.0026247 k( 107) = ( -0.2636364 0.1155928 0.2878643), wk = 0.0026247 k( 108) = ( -0.2545455 0.1116069 0.2779379), wk = 0.0026247 k( 109) = ( -0.2454545 0.1076209 0.2680116), wk = 0.0026247 k( 110) = ( -0.2363636 0.1036350 0.2580852), wk = 0.0026247 k( 111) = ( -0.2272727 0.0996490 0.2481589), wk = 0.0026247 k( 112) = ( -0.2181818 0.0956630 0.2382325), wk = 0.0026247 k( 113) = ( -0.2090909 0.0916771 0.2283061), wk = 0.0026247 k( 114) = ( -0.2000000 0.0876911 0.2183798), wk = 0.0026247 k( 115) = ( -0.1909091 0.0837052 0.2084534), wk = 0.0026247 k( 116) = ( -0.1818182 0.0797192 0.1985271), wk = 0.0026247 k( 117) = ( -0.1727273 0.0757332 0.1886007), wk = 0.0026247 k( 118) = ( -0.1636364 0.0717473 0.1786744), wk = 0.0026247 k( 119) = ( -0.1545455 0.0677613 0.1687480), wk = 0.0026247 k( 120) = ( -0.1454545 0.0637754 0.1588217), wk = 0.0026247 k( 121) = ( -0.1363636 0.0597894 0.1488953), wk = 0.0026247 k( 122) = ( -0.1272727 0.0558034 0.1389690), wk = 0.0026247 k( 123) = ( -0.1181818 0.0518175 0.1290426), wk = 0.0026247 k( 124) = ( -0.1090909 0.0478315 0.1191162), wk = 0.0026247 k( 125) = ( -0.1000000 0.0438456 0.1091899), wk = 0.0026247 k( 126) = ( -0.0909091 0.0398596 0.0992635), wk = 0.0026247 k( 127) = ( -0.0818182 0.0358736 0.0893372), wk = 0.0026247 k( 128) = ( -0.0727273 0.0318877 0.0794108), wk = 0.0026247 k( 129) = ( -0.0636364 0.0279017 0.0694845), wk = 0.0026247 k( 130) = ( -0.0545455 0.0239158 0.0595581), wk = 0.0026247 k( 131) = ( -0.0454546 0.0199298 0.0496318), wk = 0.0026247 k( 132) = ( -0.0363636 0.0159438 0.0397054), wk = 0.0026247 k( 133) = ( -0.0272727 0.0119579 0.0297791), wk = 0.0026247 k( 134) = ( -0.0181818 0.0079719 0.0198527), wk = 0.0026247 k( 135) = ( -0.0090909 0.0039860 0.0099264), wk = 0.0026247 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 137) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 138) = ( 0.0055826 0.0127324 -0.0000000), wk = 0.0026247 k( 139) = ( 0.0111652 0.0254649 -0.0000000), wk = 0.0026247 k( 140) = ( 0.0167478 0.0381973 -0.0000000), wk = 0.0026247 k( 141) = ( 0.0223304 0.0509297 -0.0000000), wk = 0.0026247 k( 142) = ( 0.0279130 0.0636622 -0.0000000), wk = 0.0026247 k( 143) = ( 0.0334956 0.0763946 -0.0000000), wk = 0.0026247 k( 144) = ( 0.0390783 0.0891270 -0.0000000), wk = 0.0026247 k( 145) = ( 0.0446609 0.1018595 -0.0000000), wk = 0.0026247 k( 146) = ( 0.0502435 0.1145919 -0.0000000), wk = 0.0026247 k( 147) = ( 0.0558261 0.1273244 -0.0000000), wk = 0.0026247 k( 148) = ( 0.0614087 0.1400568 -0.0000000), wk = 0.0026247 k( 149) = ( 0.0669913 0.1527892 -0.0000000), wk = 0.0026247 k( 150) = ( 0.0725739 0.1655217 -0.0000000), wk = 0.0026247 k( 151) = ( 0.0781565 0.1782541 -0.0000000), wk = 0.0026247 k( 152) = ( 0.0837391 0.1909865 -0.0000000), wk = 0.0026247 k( 153) = ( 0.0893217 0.2037190 -0.0000000), wk = 0.0026247 k( 154) = ( 0.0949043 0.2164514 -0.0000000), wk = 0.0026247 k( 155) = ( 0.1004869 0.2291838 -0.0000000), wk = 0.0026247 k( 156) = ( 0.1060695 0.2419163 -0.0000000), wk = 0.0026247 k( 157) = ( 0.1116521 0.2546487 -0.0000000), wk = 0.0026247 k( 158) = ( 0.1172347 0.2673811 -0.0000000), wk = 0.0026247 k( 159) = ( 0.1228174 0.2801136 -0.0000000), wk = 0.0026247 k( 160) = ( 0.1284000 0.2928460 -0.0000000), wk = 0.0026247 k( 161) = ( 0.1339826 0.3055784 -0.0000000), wk = 0.0026247 k( 162) = ( 0.1395652 0.3183109 -0.0000000), wk = 0.0026247 k( 163) = ( 0.1451478 0.3310433 -0.0000000), wk = 0.0026247 k( 164) = ( 0.1507304 0.3437757 -0.0000000), wk = 0.0026247 k( 165) = ( 0.1563130 0.3565082 -0.0000000), wk = 0.0026247 k( 166) = ( 0.1618956 0.3692406 -0.0000000), wk = 0.0026247 k( 167) = ( 0.1674782 0.3819731 -0.0000000), wk = 0.0026247 k( 168) = ( 0.1730608 0.3947055 -0.0000000), wk = 0.0026247 k( 169) = ( 0.1786434 0.4074379 -0.0000000), wk = 0.0026247 k( 170) = ( 0.1842260 0.4201704 -0.0000000), wk = 0.0026247 k( 171) = ( 0.1898086 0.4329028 -0.0000000), wk = 0.0026247 k( 172) = ( 0.1953912 0.4456352 -0.0000000), wk = 0.0026247 k( 173) = ( 0.2009739 0.4583677 -0.0000000), wk = 0.0026247 k( 174) = ( 0.2065565 0.4711001 -0.0000000), wk = 0.0026247 k( 175) = ( 0.2121391 0.4838325 -0.0000000), wk = 0.0026247 k( 176) = ( 0.2177217 0.4965650 -0.0000000), wk = 0.0026247 k( 177) = ( 0.2233043 0.5092974 -0.0000000), wk = 0.0026247 k( 178) = ( 0.2288869 0.5220298 -0.0000000), wk = 0.0026247 k( 179) = ( 0.2344695 0.5347623 -0.0000000), wk = 0.0026247 k( 180) = ( 0.2400521 0.5474947 -0.0000000), wk = 0.0026247 k( 181) = ( 0.2456347 0.5602271 -0.0000000), wk = 0.0026247 k( 182) = ( 0.2512173 0.5729596 -0.0000000), wk = 0.0026247 k( 183) = ( 0.2567999 0.5856920 -0.0000000), wk = 0.0026247 k( 184) = ( 0.2623825 0.5984244 -0.0000000), wk = 0.0026247 k( 185) = ( 0.2679651 0.6111569 -0.0000000), wk = 0.0026247 k( 186) = ( 0.2735477 0.6238893 -0.0000000), wk = 0.0026247 k( 187) = ( 0.2791304 0.6366218 -0.0000000), wk = 0.0026247 k( 188) = ( 0.2847130 0.6493542 -0.0000000), wk = 0.0026247 k( 189) = ( 0.2902956 0.6620866 -0.0000000), wk = 0.0026247 k( 190) = ( 0.2958782 0.6748191 -0.0000000), wk = 0.0026247 k( 191) = ( 0.3014608 0.6875515 -0.0000000), wk = 0.0026247 k( 192) = ( 0.3070434 0.7002839 -0.0000000), wk = 0.0026247 k( 193) = ( 0.3126260 0.7130164 -0.0000000), wk = 0.0026247 k( 194) = ( 0.3182086 0.7257488 -0.0000000), wk = 0.0026247 k( 195) = ( 0.3237912 0.7384812 -0.0000000), wk = 0.0026247 k( 196) = ( 0.3293738 0.7512137 -0.0000000), wk = 0.0026247 k( 197) = ( 0.3349564 0.7639461 -0.0000000), wk = 0.0026247 k( 198) = ( 0.3405390 0.7766785 -0.0000000), wk = 0.0026247 k( 199) = ( 0.3461216 0.7894110 -0.0000000), wk = 0.0026247 k( 200) = ( 0.3461216 0.7894110 -0.0000000), wk = 0.0026247 k( 201) = ( 0.3438863 0.7843127 0.0126965), wk = 0.0026247 k( 202) = ( 0.3416509 0.7792144 0.0253930), wk = 0.0026247 k( 203) = ( 0.3394155 0.7741160 0.0380895), wk = 0.0026247 k( 204) = ( 0.3371801 0.7690177 0.0507860), wk = 0.0026247 k( 205) = ( 0.3349447 0.7639194 0.0634825), wk = 0.0026247 k( 206) = ( 0.3327093 0.7588211 0.0761790), wk = 0.0026247 k( 207) = ( 0.3304739 0.7537227 0.0888755), wk = 0.0026247 k( 208) = ( 0.3282386 0.7486244 0.1015720), wk = 0.0026247 k( 209) = ( 0.3260032 0.7435261 0.1142685), wk = 0.0026247 k( 210) = ( 0.3237678 0.7384278 0.1269650), wk = 0.0026247 k( 211) = ( 0.3215324 0.7333295 0.1396615), wk = 0.0026247 k( 212) = ( 0.3192970 0.7282311 0.1523580), wk = 0.0026247 k( 213) = ( 0.3170616 0.7231328 0.1650545), wk = 0.0026247 k( 214) = ( 0.3148262 0.7180345 0.1777510), wk = 0.0026247 k( 215) = ( 0.3125908 0.7129362 0.1904475), wk = 0.0026247 k( 216) = ( 0.3103554 0.7078379 0.2031440), wk = 0.0026247 k( 217) = ( 0.3081201 0.7027395 0.2158405), wk = 0.0026247 k( 218) = ( 0.3058847 0.6976412 0.2285370), wk = 0.0026247 k( 219) = ( 0.3036493 0.6925429 0.2412335), wk = 0.0026247 k( 220) = ( 0.3014139 0.6874446 0.2539300), wk = 0.0026247 k( 221) = ( 0.2991785 0.6823462 0.2666265), wk = 0.0026247 k( 222) = ( 0.2969431 0.6772479 0.2793230), wk = 0.0026247 k( 223) = ( 0.2947077 0.6721496 0.2920195), wk = 0.0026247 k( 224) = ( 0.2924723 0.6670513 0.3047160), wk = 0.0026247 k( 225) = ( 0.2902370 0.6619530 0.3174125), wk = 0.0026247 k( 226) = ( 0.2880016 0.6568547 0.3301090), wk = 0.0026247 k( 227) = ( 0.2857662 0.6517563 0.3428055), wk = 0.0026247 k( 228) = ( 0.2835308 0.6466580 0.3555020), wk = 0.0026247 k( 229) = ( 0.2812954 0.6415597 0.3681985), wk = 0.0026247 k( 230) = ( 0.2790600 0.6364614 0.3808950), wk = 0.0026247 k( 231) = ( 0.2768246 0.6313630 0.3935915), wk = 0.0026247 k( 232) = ( 0.2745893 0.6262647 0.4062880), wk = 0.0026247 k( 233) = ( 0.2723539 0.6211664 0.4189845), wk = 0.0026247 k( 234) = ( 0.2701185 0.6160681 0.4316810), wk = 0.0026247 k( 235) = ( 0.2678831 0.6109698 0.4443775), wk = 0.0026247 k( 236) = ( 0.2656477 0.6058715 0.4570740), wk = 0.0026247 k( 237) = ( 0.2634123 0.6007731 0.4697705), wk = 0.0026247 k( 238) = ( 0.2611769 0.5956748 0.4824670), wk = 0.0026247 k( 239) = ( 0.2589416 0.5905765 0.4951635), wk = 0.0026247 k( 240) = ( 0.2567062 0.5854782 0.5078600), wk = 0.0026247 k( 241) = ( 0.2544708 0.5803798 0.5205565), wk = 0.0026247 k( 242) = ( 0.2522354 0.5752815 0.5332530), wk = 0.0026247 k( 243) = ( 0.2500000 0.5701832 0.5459495), wk = 0.0026247 k( 244) = ( 0.2500000 0.5701832 0.5459495), wk = 0.0026247 k( 245) = ( 0.2410714 0.5740980 0.5362004), wk = 0.0026247 k( 246) = ( 0.2321429 0.5780128 0.5264513), wk = 0.0026247 k( 247) = ( 0.2232143 0.5819275 0.5167022), wk = 0.0026247 k( 248) = ( 0.2142857 0.5858423 0.5069531), wk = 0.0026247 k( 249) = ( 0.2053571 0.5897571 0.4972040), wk = 0.0026247 k( 250) = ( 0.1964286 0.5936719 0.4874549), wk = 0.0026247 k( 251) = ( 0.1875000 0.5975867 0.4777058), wk = 0.0026247 k( 252) = ( 0.1785714 0.6015015 0.4679567), wk = 0.0026247 k( 253) = ( 0.1696429 0.6054162 0.4582076), wk = 0.0026247 k( 254) = ( 0.1607143 0.6093310 0.4484585), wk = 0.0026247 k( 255) = ( 0.1517857 0.6132458 0.4387094), wk = 0.0026247 k( 256) = ( 0.1428571 0.6171606 0.4289603), wk = 0.0026247 k( 257) = ( 0.1339286 0.6210754 0.4192112), wk = 0.0026247 k( 258) = ( 0.1250000 0.6249902 0.4094621), wk = 0.0026247 k( 259) = ( 0.1160714 0.6289049 0.3997130), wk = 0.0026247 k( 260) = ( 0.1071429 0.6328197 0.3899639), wk = 0.0026247 k( 261) = ( 0.0982143 0.6367345 0.3802148), wk = 0.0026247 k( 262) = ( 0.0892857 0.6406493 0.3704657), wk = 0.0026247 k( 263) = ( 0.0803571 0.6445641 0.3607166), wk = 0.0026247 k( 264) = ( 0.0714286 0.6484788 0.3509675), wk = 0.0026247 k( 265) = ( 0.0625000 0.6523936 0.3412184), wk = 0.0026247 k( 266) = ( 0.0535714 0.6563084 0.3314693), wk = 0.0026247 k( 267) = ( 0.0446429 0.6602232 0.3217202), wk = 0.0026247 k( 268) = ( 0.0357143 0.6641380 0.3119711), wk = 0.0026247 k( 269) = ( 0.0267857 0.6680528 0.3022220), wk = 0.0026247 k( 270) = ( 0.0178571 0.6719675 0.2924729), wk = 0.0026247 k( 271) = ( 0.0089286 0.6758823 0.2827238), wk = 0.0026247 k( 272) = ( 0.0000000 0.6797971 0.2729747), wk = 0.0026247 k( 273) = ( 0.0000000 0.6797971 0.2729747), wk = 0.0026247 k( 274) = ( -0.0104885 0.6764755 0.2812467), wk = 0.0026247 k( 275) = ( -0.0209771 0.6731538 0.2895187), wk = 0.0026247 k( 276) = ( -0.0314656 0.6698322 0.2977906), wk = 0.0026247 k( 277) = ( -0.0419541 0.6665106 0.3060626), wk = 0.0026247 k( 278) = ( -0.0524427 0.6631889 0.3143345), wk = 0.0026247 k( 279) = ( -0.0629312 0.6598673 0.3226065), wk = 0.0026247 k( 280) = ( -0.0734197 0.6565457 0.3308785), wk = 0.0026247 k( 281) = ( -0.0839083 0.6532240 0.3391504), wk = 0.0026247 k( 282) = ( -0.0943968 0.6499024 0.3474224), wk = 0.0026247 k( 283) = ( -0.1048854 0.6465808 0.3556944), wk = 0.0026247 k( 284) = ( -0.1153739 0.6432591 0.3639663), wk = 0.0026247 k( 285) = ( -0.1258624 0.6399375 0.3722383), wk = 0.0026247 k( 286) = ( -0.1363509 0.6366159 0.3805102), wk = 0.0026247 k( 287) = ( -0.1468395 0.6332942 0.3887822), wk = 0.0026247 k( 288) = ( -0.1573280 0.6299726 0.3970542), wk = 0.0026247 k( 289) = ( -0.1678166 0.6266510 0.4053261), wk = 0.0026247 k( 290) = ( -0.1783051 0.6233293 0.4135981), wk = 0.0026247 k( 291) = ( -0.1887936 0.6200077 0.4218700), wk = 0.0026247 k( 292) = ( -0.1992822 0.6166861 0.4301420), wk = 0.0026247 k( 293) = ( -0.2097707 0.6133644 0.4384140), wk = 0.0026247 k( 294) = ( -0.2202592 0.6100428 0.4466859), wk = 0.0026247 k( 295) = ( -0.2307478 0.6067212 0.4549579), wk = 0.0026247 k( 296) = ( -0.2412363 0.6033995 0.4632299), wk = 0.0026247 k( 297) = ( -0.2517248 0.6000779 0.4715018), wk = 0.0026247 k( 298) = ( -0.2622134 0.5967563 0.4797738), wk = 0.0026247 k( 299) = ( -0.2727019 0.5934346 0.4880457), wk = 0.0026247 k( 300) = ( -0.2831904 0.5901130 0.4963177), wk = 0.0026247 k( 301) = ( -0.2936790 0.5867914 0.5045897), wk = 0.0026247 k( 302) = ( -0.3041675 0.5834697 0.5128616), wk = 0.0026247 k( 303) = ( -0.3146560 0.5801481 0.5211336), wk = 0.0026247 k( 304) = ( -0.3251446 0.5768265 0.5294055), wk = 0.0026247 k( 305) = ( -0.3356331 0.5735048 0.5376775), wk = 0.0026247 k( 306) = ( -0.3461216 0.5701832 0.5459495), wk = 0.0026247 k( 307) = ( -0.3461216 0.5701832 0.5459495), wk = 0.0026247 k( 308) = ( -0.3516173 0.5576491 0.5459495), wk = 0.0026247 k( 309) = ( -0.3571129 0.5451150 0.5459495), wk = 0.0026247 k( 310) = ( -0.3626086 0.5325808 0.5459495), wk = 0.0026247 k( 311) = ( -0.3681043 0.5200467 0.5459495), wk = 0.0026247 k( 312) = ( -0.3735999 0.5075126 0.5459495), wk = 0.0026247 k( 313) = ( -0.3790956 0.4949785 0.5459495), wk = 0.0026247 k( 314) = ( -0.3845912 0.4824444 0.5459495), wk = 0.0026247 k( 315) = ( -0.3900869 0.4699102 0.5459495), wk = 0.0026247 k( 316) = ( -0.3955825 0.4573761 0.5459495), wk = 0.0026247 k( 317) = ( -0.4010782 0.4448420 0.5459495), wk = 0.0026247 k( 318) = ( -0.4065739 0.4323079 0.5459495), wk = 0.0026247 k( 319) = ( -0.4120695 0.4197737 0.5459495), wk = 0.0026247 k( 320) = ( -0.4175652 0.4072396 0.5459495), wk = 0.0026247 k( 321) = ( -0.4230608 0.3947055 0.5459495), wk = 0.0026247 k( 322) = ( -0.4285565 0.3821714 0.5459495), wk = 0.0026247 k( 323) = ( -0.4340521 0.3696373 0.5459495), wk = 0.0026247 k( 324) = ( -0.4395478 0.3571031 0.5459495), wk = 0.0026247 k( 325) = ( -0.4450434 0.3445690 0.5459495), wk = 0.0026247 k( 326) = ( -0.4505391 0.3320349 0.5459495), wk = 0.0026247 k( 327) = ( -0.4560347 0.3195008 0.5459495), wk = 0.0026247 k( 328) = ( -0.4615304 0.3069666 0.5459495), wk = 0.0026247 k( 329) = ( -0.4670261 0.2944325 0.5459495), wk = 0.0026247 k( 330) = ( -0.4725217 0.2818984 0.5459495), wk = 0.0026247 k( 331) = ( -0.4780174 0.2693643 0.5459495), wk = 0.0026247 k( 332) = ( -0.4835130 0.2568302 0.5459495), wk = 0.0026247 k( 333) = ( -0.4890087 0.2442960 0.5459495), wk = 0.0026247 k( 334) = ( -0.4945043 0.2317619 0.5459495), wk = 0.0026247 k( 335) = ( -0.5000000 0.2192278 0.5459495), wk = 0.0026247 k( 336) = ( 0.0000000 0.0000000 0.5459495), wk = 0.0026247 k( 337) = ( 0.0055556 0.0126707 0.5459495), wk = 0.0026247 k( 338) = ( 0.0111111 0.0253415 0.5459495), wk = 0.0026247 k( 339) = ( 0.0166667 0.0380122 0.5459495), wk = 0.0026247 k( 340) = ( 0.0222222 0.0506829 0.5459495), wk = 0.0026247 k( 341) = ( 0.0277778 0.0633537 0.5459495), wk = 0.0026247 k( 342) = ( 0.0333333 0.0760244 0.5459495), wk = 0.0026247 k( 343) = ( 0.0388889 0.0886952 0.5459495), wk = 0.0026247 k( 344) = ( 0.0444444 0.1013659 0.5459495), wk = 0.0026247 k( 345) = ( 0.0500000 0.1140366 0.5459495), wk = 0.0026247 k( 346) = ( 0.0555556 0.1267074 0.5459495), wk = 0.0026247 k( 347) = ( 0.0611111 0.1393781 0.5459495), wk = 0.0026247 k( 348) = ( 0.0666667 0.1520489 0.5459495), wk = 0.0026247 k( 349) = ( 0.0722222 0.1647196 0.5459495), wk = 0.0026247 k( 350) = ( 0.0777778 0.1773903 0.5459495), wk = 0.0026247 k( 351) = ( 0.0833333 0.1900611 0.5459495), wk = 0.0026247 k( 352) = ( 0.0888889 0.2027318 0.5459495), wk = 0.0026247 k( 353) = ( 0.0944444 0.2154025 0.5459495), wk = 0.0026247 k( 354) = ( 0.1000000 0.2280733 0.5459495), wk = 0.0026247 k( 355) = ( 0.1055556 0.2407440 0.5459495), wk = 0.0026247 k( 356) = ( 0.1111111 0.2534148 0.5459495), wk = 0.0026247 k( 357) = ( 0.1166667 0.2660855 0.5459495), wk = 0.0026247 k( 358) = ( 0.1222222 0.2787562 0.5459495), wk = 0.0026247 k( 359) = ( 0.1277778 0.2914270 0.5459495), wk = 0.0026247 k( 360) = ( 0.1333333 0.3040977 0.5459495), wk = 0.0026247 k( 361) = ( 0.1388889 0.3167684 0.5459495), wk = 0.0026247 k( 362) = ( 0.1444444 0.3294392 0.5459495), wk = 0.0026247 k( 363) = ( 0.1500000 0.3421099 0.5459495), wk = 0.0026247 k( 364) = ( 0.1555556 0.3547807 0.5459495), wk = 0.0026247 k( 365) = ( 0.1611111 0.3674514 0.5459495), wk = 0.0026247 k( 366) = ( 0.1666667 0.3801221 0.5459495), wk = 0.0026247 k( 367) = ( 0.1722222 0.3927929 0.5459495), wk = 0.0026247 k( 368) = ( 0.1777778 0.4054636 0.5459495), wk = 0.0026247 k( 369) = ( 0.1833333 0.4181343 0.5459495), wk = 0.0026247 k( 370) = ( 0.1888889 0.4308051 0.5459495), wk = 0.0026247 k( 371) = ( 0.1944444 0.4434758 0.5459495), wk = 0.0026247 k( 372) = ( 0.2000000 0.4561466 0.5459495), wk = 0.0026247 k( 373) = ( 0.2055556 0.4688173 0.5459495), wk = 0.0026247 k( 374) = ( 0.2111111 0.4814880 0.5459495), wk = 0.0026247 k( 375) = ( 0.2166667 0.4941588 0.5459495), wk = 0.0026247 k( 376) = ( 0.2222222 0.5068295 0.5459495), wk = 0.0026247 k( 377) = ( 0.2277778 0.5195003 0.5459495), wk = 0.0026247 k( 378) = ( 0.2333333 0.5321710 0.5459495), wk = 0.0026247 k( 379) = ( 0.2388889 0.5448417 0.5459495), wk = 0.0026247 k( 380) = ( 0.2444444 0.5575125 0.5459495), wk = 0.0026247 k( 381) = ( 0.2500000 0.5701832 0.5459495), wk = 0.0026247 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 2) = ( 0.0000000 0.0000000 0.0128205), wk = 0.0026247 k( 3) = ( 0.0000000 0.0000000 0.0256410), wk = 0.0026247 k( 4) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0026247 k( 5) = ( 0.0000000 0.0000000 0.0512821), wk = 0.0026247 k( 6) = ( 0.0000000 0.0000000 0.0641026), wk = 0.0026247 k( 7) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0026247 k( 8) = ( 0.0000000 0.0000000 0.0897436), wk = 0.0026247 k( 9) = ( 0.0000000 0.0000000 0.1025641), wk = 0.0026247 k( 10) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0026247 k( 11) = ( 0.0000000 0.0000000 0.1282051), wk = 0.0026247 k( 12) = ( 0.0000000 0.0000000 0.1410256), wk = 0.0026247 k( 13) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0026247 k( 14) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0026247 k( 15) = ( 0.0000000 0.0000000 0.1794872), wk = 0.0026247 k( 16) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0026247 k( 17) = ( 0.0000000 0.0000000 0.2051282), wk = 0.0026247 k( 18) = ( 0.0000000 0.0000000 0.2179487), wk = 0.0026247 k( 19) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0026247 k( 20) = ( 0.0000000 0.0000000 0.2435897), wk = 0.0026247 k( 21) = ( 0.0000000 0.0000000 0.2564103), wk = 0.0026247 k( 22) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0026247 k( 23) = ( 0.0000000 0.0000000 0.2820513), wk = 0.0026247 k( 24) = ( 0.0000000 0.0000000 0.2948718), wk = 0.0026247 k( 25) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0026247 k( 26) = ( 0.0000000 0.0000000 0.3205128), wk = 0.0026247 k( 27) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0026247 k( 28) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0026247 k( 29) = ( 0.0000000 0.0000000 0.3589744), wk = 0.0026247 k( 30) = ( 0.0000000 0.0000000 0.3717949), wk = 0.0026247 k( 31) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0026247 k( 32) = ( 0.0000000 0.0000000 0.3974359), wk = 0.0026247 k( 33) = ( 0.0000000 0.0000000 0.4102564), wk = 0.0026247 k( 34) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0026247 k( 35) = ( 0.0000000 0.0000000 0.4358974), wk = 0.0026247 k( 36) = ( 0.0000000 0.0000000 0.4487179), wk = 0.0026247 k( 37) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0026247 k( 38) = ( 0.0000000 0.0000000 0.4743590), wk = 0.0026247 k( 39) = ( 0.0000000 0.0000000 0.4871795), wk = 0.0026247 k( 40) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026247 k( 41) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026247 k( 42) = ( -0.0128205 0.0128205 0.5000000), wk = 0.0026247 k( 43) = ( -0.0256410 0.0256410 0.5000000), wk = 0.0026247 k( 44) = ( -0.0384615 0.0384615 0.5000000), wk = 0.0026247 k( 45) = ( -0.0512821 0.0512821 0.5000000), wk = 0.0026247 k( 46) = ( -0.0641026 0.0641026 0.5000000), wk = 0.0026247 k( 47) = ( -0.0769231 0.0769231 0.5000000), wk = 0.0026247 k( 48) = ( -0.0897436 0.0897436 0.5000000), wk = 0.0026247 k( 49) = ( -0.1025641 0.1025641 0.5000000), wk = 0.0026247 k( 50) = ( -0.1153846 0.1153846 0.5000000), wk = 0.0026247 k( 51) = ( -0.1282051 0.1282051 0.5000000), wk = 0.0026247 k( 52) = ( -0.1410256 0.1410256 0.5000000), wk = 0.0026247 k( 53) = ( -0.1538461 0.1538461 0.5000000), wk = 0.0026247 k( 54) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0026247 k( 55) = ( -0.1794872 0.1794872 0.5000000), wk = 0.0026247 k( 56) = ( -0.1923077 0.1923077 0.5000000), wk = 0.0026247 k( 57) = ( -0.2051282 0.2051282 0.5000000), wk = 0.0026247 k( 58) = ( -0.2179487 0.2179487 0.5000000), wk = 0.0026247 k( 59) = ( -0.2307692 0.2307692 0.5000000), wk = 0.0026247 k( 60) = ( -0.2435897 0.2435897 0.5000000), wk = 0.0026247 k( 61) = ( -0.2564103 0.2564103 0.5000000), wk = 0.0026247 k( 62) = ( -0.2692308 0.2692308 0.5000000), wk = 0.0026247 k( 63) = ( -0.2820513 0.2820513 0.5000000), wk = 0.0026247 k( 64) = ( -0.2948718 0.2948718 0.5000000), wk = 0.0026247 k( 65) = ( -0.3076923 0.3076923 0.5000000), wk = 0.0026247 k( 66) = ( -0.3205128 0.3205128 0.5000000), wk = 0.0026247 k( 67) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0026247 k( 68) = ( -0.3461538 0.3461538 0.5000000), wk = 0.0026247 k( 69) = ( -0.3589744 0.3589744 0.5000000), wk = 0.0026247 k( 70) = ( -0.3717949 0.3717949 0.5000000), wk = 0.0026247 k( 71) = ( -0.3846154 0.3846154 0.5000000), wk = 0.0026247 k( 72) = ( -0.3974359 0.3974359 0.5000000), wk = 0.0026247 k( 73) = ( -0.4102564 0.4102564 0.5000000), wk = 0.0026247 k( 74) = ( -0.4230769 0.4230769 0.5000000), wk = 0.0026247 k( 75) = ( -0.4358974 0.4358974 0.5000000), wk = 0.0026247 k( 76) = ( -0.4487179 0.4487179 0.5000000), wk = 0.0026247 k( 77) = ( -0.4615385 0.4615385 0.5000000), wk = 0.0026247 k( 78) = ( -0.4743590 0.4743590 0.5000000), wk = 0.0026247 k( 79) = ( -0.4871795 0.4871795 0.5000000), wk = 0.0026247 k( 80) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026247 k( 81) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026247 k( 82) = ( -0.4909091 0.4909091 0.4909091), wk = 0.0026247 k( 83) = ( -0.4818182 0.4818182 0.4818182), wk = 0.0026247 k( 84) = ( -0.4727273 0.4727273 0.4727273), wk = 0.0026247 k( 85) = ( -0.4636364 0.4636364 0.4636364), wk = 0.0026247 k( 86) = ( -0.4545455 0.4545455 0.4545455), wk = 0.0026247 k( 87) = ( -0.4454546 0.4454546 0.4454546), wk = 0.0026247 k( 88) = ( -0.4363636 0.4363636 0.4363636), wk = 0.0026247 k( 89) = ( -0.4272727 0.4272727 0.4272727), wk = 0.0026247 k( 90) = ( -0.4181818 0.4181818 0.4181818), wk = 0.0026247 k( 91) = ( -0.4090909 0.4090909 0.4090909), wk = 0.0026247 k( 92) = ( -0.4000000 0.4000000 0.4000000), wk = 0.0026247 k( 93) = ( -0.3909091 0.3909091 0.3909091), wk = 0.0026247 k( 94) = ( -0.3818182 0.3818182 0.3818182), wk = 0.0026247 k( 95) = ( -0.3727273 0.3727273 0.3727273), wk = 0.0026247 k( 96) = ( -0.3636364 0.3636364 0.3636364), wk = 0.0026247 k( 97) = ( -0.3545454 0.3545454 0.3545454), wk = 0.0026247 k( 98) = ( -0.3454546 0.3454546 0.3454546), wk = 0.0026247 k( 99) = ( -0.3363636 0.3363636 0.3363636), wk = 0.0026247 k( 100) = ( -0.3272727 0.3272727 0.3272727), wk = 0.0026247 k( 101) = ( -0.3181818 0.3181818 0.3181818), wk = 0.0026247 k( 102) = ( -0.3090909 0.3090909 0.3090909), wk = 0.0026247 k( 103) = ( -0.3000000 0.3000000 0.3000000), wk = 0.0026247 k( 104) = ( -0.2909091 0.2909091 0.2909091), wk = 0.0026247 k( 105) = ( -0.2818182 0.2818182 0.2818182), wk = 0.0026247 k( 106) = ( -0.2727273 0.2727273 0.2727273), wk = 0.0026247 k( 107) = ( -0.2636364 0.2636364 0.2636364), wk = 0.0026247 k( 108) = ( -0.2545455 0.2545455 0.2545455), wk = 0.0026247 k( 109) = ( -0.2454545 0.2454545 0.2454545), wk = 0.0026247 k( 110) = ( -0.2363636 0.2363636 0.2363636), wk = 0.0026247 k( 111) = ( -0.2272727 0.2272727 0.2272727), wk = 0.0026247 k( 112) = ( -0.2181818 0.2181818 0.2181818), wk = 0.0026247 k( 113) = ( -0.2090909 0.2090909 0.2090909), wk = 0.0026247 k( 114) = ( -0.2000000 0.2000000 0.2000000), wk = 0.0026247 k( 115) = ( -0.1909091 0.1909091 0.1909091), wk = 0.0026247 k( 116) = ( -0.1818182 0.1818182 0.1818182), wk = 0.0026247 k( 117) = ( -0.1727273 0.1727273 0.1727273), wk = 0.0026247 k( 118) = ( -0.1636364 0.1636364 0.1636364), wk = 0.0026247 k( 119) = ( -0.1545455 0.1545455 0.1545455), wk = 0.0026247 k( 120) = ( -0.1454545 0.1454545 0.1454545), wk = 0.0026247 k( 121) = ( -0.1363636 0.1363636 0.1363636), wk = 0.0026247 k( 122) = ( -0.1272727 0.1272727 0.1272727), wk = 0.0026247 k( 123) = ( -0.1181818 0.1181818 0.1181818), wk = 0.0026247 k( 124) = ( -0.1090909 0.1090909 0.1090909), wk = 0.0026247 k( 125) = ( -0.1000000 0.1000000 0.1000000), wk = 0.0026247 k( 126) = ( -0.0909091 0.0909091 0.0909091), wk = 0.0026247 k( 127) = ( -0.0818182 0.0818182 0.0818182), wk = 0.0026247 k( 128) = ( -0.0727273 0.0727273 0.0727273), wk = 0.0026247 k( 129) = ( -0.0636364 0.0636364 0.0636364), wk = 0.0026247 k( 130) = ( -0.0545455 0.0545454 0.0545455), wk = 0.0026247 k( 131) = ( -0.0454546 0.0454545 0.0454546), wk = 0.0026247 k( 132) = ( -0.0363636 0.0363636 0.0363636), wk = 0.0026247 k( 133) = ( -0.0272727 0.0272727 0.0272727), wk = 0.0026247 k( 134) = ( -0.0181818 0.0181818 0.0181818), wk = 0.0026247 k( 135) = ( -0.0090909 0.0090909 0.0090909), wk = 0.0026247 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 137) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 138) = ( 0.0055826 0.0055826 -0.0055826), wk = 0.0026247 k( 139) = ( 0.0111652 0.0111652 -0.0111652), wk = 0.0026247 k( 140) = ( 0.0167478 0.0167478 -0.0167478), wk = 0.0026247 k( 141) = ( 0.0223304 0.0223304 -0.0223304), wk = 0.0026247 k( 142) = ( 0.0279130 0.0279130 -0.0279130), wk = 0.0026247 k( 143) = ( 0.0334956 0.0334956 -0.0334956), wk = 0.0026247 k( 144) = ( 0.0390783 0.0390783 -0.0390783), wk = 0.0026247 k( 145) = ( 0.0446609 0.0446609 -0.0446609), wk = 0.0026247 k( 146) = ( 0.0502435 0.0502435 -0.0502435), wk = 0.0026247 k( 147) = ( 0.0558261 0.0558261 -0.0558261), wk = 0.0026247 k( 148) = ( 0.0614087 0.0614087 -0.0614087), wk = 0.0026247 k( 149) = ( 0.0669913 0.0669913 -0.0669913), wk = 0.0026247 k( 150) = ( 0.0725739 0.0725739 -0.0725739), wk = 0.0026247 k( 151) = ( 0.0781565 0.0781565 -0.0781565), wk = 0.0026247 k( 152) = ( 0.0837391 0.0837391 -0.0837391), wk = 0.0026247 k( 153) = ( 0.0893217 0.0893217 -0.0893217), wk = 0.0026247 k( 154) = ( 0.0949043 0.0949043 -0.0949043), wk = 0.0026247 k( 155) = ( 0.1004869 0.1004869 -0.1004869), wk = 0.0026247 k( 156) = ( 0.1060695 0.1060695 -0.1060695), wk = 0.0026247 k( 157) = ( 0.1116521 0.1116521 -0.1116521), wk = 0.0026247 k( 158) = ( 0.1172347 0.1172348 -0.1172348), wk = 0.0026247 k( 159) = ( 0.1228174 0.1228174 -0.1228174), wk = 0.0026247 k( 160) = ( 0.1284000 0.1284000 -0.1284000), wk = 0.0026247 k( 161) = ( 0.1339826 0.1339826 -0.1339826), wk = 0.0026247 k( 162) = ( 0.1395652 0.1395652 -0.1395652), wk = 0.0026247 k( 163) = ( 0.1451478 0.1451478 -0.1451478), wk = 0.0026247 k( 164) = ( 0.1507304 0.1507304 -0.1507304), wk = 0.0026247 k( 165) = ( 0.1563130 0.1563130 -0.1563130), wk = 0.0026247 k( 166) = ( 0.1618956 0.1618956 -0.1618956), wk = 0.0026247 k( 167) = ( 0.1674782 0.1674782 -0.1674782), wk = 0.0026247 k( 168) = ( 0.1730608 0.1730608 -0.1730608), wk = 0.0026247 k( 169) = ( 0.1786434 0.1786434 -0.1786434), wk = 0.0026247 k( 170) = ( 0.1842260 0.1842260 -0.1842260), wk = 0.0026247 k( 171) = ( 0.1898086 0.1898086 -0.1898086), wk = 0.0026247 k( 172) = ( 0.1953912 0.1953912 -0.1953912), wk = 0.0026247 k( 173) = ( 0.2009739 0.2009739 -0.2009739), wk = 0.0026247 k( 174) = ( 0.2065565 0.2065565 -0.2065565), wk = 0.0026247 k( 175) = ( 0.2121391 0.2121391 -0.2121391), wk = 0.0026247 k( 176) = ( 0.2177217 0.2177217 -0.2177217), wk = 0.0026247 k( 177) = ( 0.2233043 0.2233043 -0.2233043), wk = 0.0026247 k( 178) = ( 0.2288869 0.2288869 -0.2288869), wk = 0.0026247 k( 179) = ( 0.2344695 0.2344695 -0.2344695), wk = 0.0026247 k( 180) = ( 0.2400521 0.2400521 -0.2400521), wk = 0.0026247 k( 181) = ( 0.2456347 0.2456347 -0.2456347), wk = 0.0026247 k( 182) = ( 0.2512173 0.2512173 -0.2512173), wk = 0.0026247 k( 183) = ( 0.2567999 0.2567999 -0.2567999), wk = 0.0026247 k( 184) = ( 0.2623825 0.2623825 -0.2623825), wk = 0.0026247 k( 185) = ( 0.2679651 0.2679651 -0.2679651), wk = 0.0026247 k( 186) = ( 0.2735477 0.2735477 -0.2735477), wk = 0.0026247 k( 187) = ( 0.2791304 0.2791304 -0.2791304), wk = 0.0026247 k( 188) = ( 0.2847130 0.2847130 -0.2847130), wk = 0.0026247 k( 189) = ( 0.2902956 0.2902956 -0.2902956), wk = 0.0026247 k( 190) = ( 0.2958782 0.2958782 -0.2958782), wk = 0.0026247 k( 191) = ( 0.3014608 0.3014608 -0.3014608), wk = 0.0026247 k( 192) = ( 0.3070434 0.3070434 -0.3070434), wk = 0.0026247 k( 193) = ( 0.3126260 0.3126260 -0.3126260), wk = 0.0026247 k( 194) = ( 0.3182086 0.3182086 -0.3182086), wk = 0.0026247 k( 195) = ( 0.3237912 0.3237912 -0.3237912), wk = 0.0026247 k( 196) = ( 0.3293738 0.3293738 -0.3293738), wk = 0.0026247 k( 197) = ( 0.3349564 0.3349564 -0.3349564), wk = 0.0026247 k( 198) = ( 0.3405390 0.3405390 -0.3405390), wk = 0.0026247 k( 199) = ( 0.3461216 0.3461216 -0.3461216), wk = 0.0026247 k( 200) = ( 0.3461216 0.3461216 -0.3461216), wk = 0.0026247 k( 201) = ( 0.3438863 0.3438863 -0.3322584), wk = 0.0026247 k( 202) = ( 0.3416509 0.3416509 -0.3183951), wk = 0.0026247 k( 203) = ( 0.3394155 0.3394155 -0.3045318), wk = 0.0026247 k( 204) = ( 0.3371801 0.3371801 -0.2906685), wk = 0.0026247 k( 205) = ( 0.3349447 0.3349447 -0.2768052), wk = 0.0026247 k( 206) = ( 0.3327093 0.3327093 -0.2629419), wk = 0.0026247 k( 207) = ( 0.3304739 0.3304739 -0.2490786), wk = 0.0026247 k( 208) = ( 0.3282386 0.3282386 -0.2352153), wk = 0.0026247 k( 209) = ( 0.3260032 0.3260032 -0.2213520), wk = 0.0026247 k( 210) = ( 0.3237678 0.3237678 -0.2074887), wk = 0.0026247 k( 211) = ( 0.3215324 0.3215324 -0.1936254), wk = 0.0026247 k( 212) = ( 0.3192970 0.3192970 -0.1797621), wk = 0.0026247 k( 213) = ( 0.3170616 0.3170616 -0.1658988), wk = 0.0026247 k( 214) = ( 0.3148262 0.3148262 -0.1520355), wk = 0.0026247 k( 215) = ( 0.3125908 0.3125908 -0.1381722), wk = 0.0026247 k( 216) = ( 0.3103554 0.3103554 -0.1243089), wk = 0.0026247 k( 217) = ( 0.3081201 0.3081201 -0.1104456), wk = 0.0026247 k( 218) = ( 0.3058847 0.3058847 -0.0965823), wk = 0.0026247 k( 219) = ( 0.3036493 0.3036493 -0.0827191), wk = 0.0026247 k( 220) = ( 0.3014139 0.3014139 -0.0688558), wk = 0.0026247 k( 221) = ( 0.2991785 0.2991785 -0.0549925), wk = 0.0026247 k( 222) = ( 0.2969431 0.2969431 -0.0411292), wk = 0.0026247 k( 223) = ( 0.2947077 0.2947077 -0.0272659), wk = 0.0026247 k( 224) = ( 0.2924723 0.2924724 -0.0134026), wk = 0.0026247 k( 225) = ( 0.2902370 0.2902370 0.0004607), wk = 0.0026247 k( 226) = ( 0.2880016 0.2880016 0.0143240), wk = 0.0026247 k( 227) = ( 0.2857662 0.2857662 0.0281873), wk = 0.0026247 k( 228) = ( 0.2835308 0.2835308 0.0420506), wk = 0.0026247 k( 229) = ( 0.2812954 0.2812954 0.0559139), wk = 0.0026247 k( 230) = ( 0.2790600 0.2790600 0.0697772), wk = 0.0026247 k( 231) = ( 0.2768246 0.2768246 0.0836405), wk = 0.0026247 k( 232) = ( 0.2745893 0.2745893 0.0975038), wk = 0.0026247 k( 233) = ( 0.2723539 0.2723539 0.1113671), wk = 0.0026247 k( 234) = ( 0.2701185 0.2701185 0.1252303), wk = 0.0026247 k( 235) = ( 0.2678831 0.2678831 0.1390937), wk = 0.0026247 k( 236) = ( 0.2656477 0.2656477 0.1529569), wk = 0.0026247 k( 237) = ( 0.2634123 0.2634123 0.1668202), wk = 0.0026247 k( 238) = ( 0.2611769 0.2611769 0.1806835), wk = 0.0026247 k( 239) = ( 0.2589416 0.2589416 0.1945468), wk = 0.0026247 k( 240) = ( 0.2567062 0.2567062 0.2084101), wk = 0.0026247 k( 241) = ( 0.2544708 0.2544708 0.2222734), wk = 0.0026247 k( 242) = ( 0.2522354 0.2522354 0.2361367), wk = 0.0026247 k( 243) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026247 k( 244) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026247 k( 245) = ( 0.2410714 0.2589286 0.2410714), wk = 0.0026247 k( 246) = ( 0.2321429 0.2678571 0.2321429), wk = 0.0026247 k( 247) = ( 0.2232143 0.2767857 0.2232143), wk = 0.0026247 k( 248) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0026247 k( 249) = ( 0.2053571 0.2946429 0.2053571), wk = 0.0026247 k( 250) = ( 0.1964286 0.3035714 0.1964286), wk = 0.0026247 k( 251) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0026247 k( 252) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0026247 k( 253) = ( 0.1696429 0.3303571 0.1696429), wk = 0.0026247 k( 254) = ( 0.1607143 0.3392857 0.1607143), wk = 0.0026247 k( 255) = ( 0.1517857 0.3482143 0.1517857), wk = 0.0026247 k( 256) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0026247 k( 257) = ( 0.1339286 0.3660714 0.1339286), wk = 0.0026247 k( 258) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0026247 k( 259) = ( 0.1160714 0.3839286 0.1160714), wk = 0.0026247 k( 260) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0026247 k( 261) = ( 0.0982143 0.4017857 0.0982143), wk = 0.0026247 k( 262) = ( 0.0892857 0.4107143 0.0892857), wk = 0.0026247 k( 263) = ( 0.0803571 0.4196429 0.0803571), wk = 0.0026247 k( 264) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0026247 k( 265) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0026247 k( 266) = ( 0.0535714 0.4464286 0.0535714), wk = 0.0026247 k( 267) = ( 0.0446429 0.4553571 0.0446429), wk = 0.0026247 k( 268) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0026247 k( 269) = ( 0.0267857 0.4732143 0.0267857), wk = 0.0026247 k( 270) = ( 0.0178571 0.4821429 0.0178571), wk = 0.0026247 k( 271) = ( 0.0089286 0.4910714 0.0089286), wk = 0.0026247 k( 272) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026247 k( 273) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026247 k( 274) = ( -0.0104885 0.5046630 0.0104885), wk = 0.0026247 k( 275) = ( -0.0209771 0.5093260 0.0209771), wk = 0.0026247 k( 276) = ( -0.0314656 0.5139889 0.0314656), wk = 0.0026247 k( 277) = ( -0.0419541 0.5186519 0.0419541), wk = 0.0026247 k( 278) = ( -0.0524427 0.5233149 0.0524427), wk = 0.0026247 k( 279) = ( -0.0629312 0.5279779 0.0629312), wk = 0.0026247 k( 280) = ( -0.0734197 0.5326409 0.0734197), wk = 0.0026247 k( 281) = ( -0.0839083 0.5373038 0.0839083), wk = 0.0026247 k( 282) = ( -0.0943968 0.5419668 0.0943968), wk = 0.0026247 k( 283) = ( -0.1048854 0.5466298 0.1048853), wk = 0.0026247 k( 284) = ( -0.1153739 0.5512928 0.1153739), wk = 0.0026247 k( 285) = ( -0.1258624 0.5559558 0.1258624), wk = 0.0026247 k( 286) = ( -0.1363509 0.5606187 0.1363510), wk = 0.0026247 k( 287) = ( -0.1468395 0.5652817 0.1468395), wk = 0.0026247 k( 288) = ( -0.1573280 0.5699447 0.1573280), wk = 0.0026247 k( 289) = ( -0.1678166 0.5746077 0.1678166), wk = 0.0026247 k( 290) = ( -0.1783051 0.5792707 0.1783051), wk = 0.0026247 k( 291) = ( -0.1887936 0.5839336 0.1887936), wk = 0.0026247 k( 292) = ( -0.1992822 0.5885966 0.1992822), wk = 0.0026247 k( 293) = ( -0.2097707 0.5932596 0.2097707), wk = 0.0026247 k( 294) = ( -0.2202592 0.5979226 0.2202592), wk = 0.0026247 k( 295) = ( -0.2307478 0.6025856 0.2307478), wk = 0.0026247 k( 296) = ( -0.2412363 0.6072485 0.2412363), wk = 0.0026247 k( 297) = ( -0.2517248 0.6119115 0.2517248), wk = 0.0026247 k( 298) = ( -0.2622134 0.6165745 0.2622134), wk = 0.0026247 k( 299) = ( -0.2727019 0.6212375 0.2727019), wk = 0.0026247 k( 300) = ( -0.2831904 0.6259005 0.2831904), wk = 0.0026247 k( 301) = ( -0.2936790 0.6305635 0.2936790), wk = 0.0026247 k( 302) = ( -0.3041675 0.6352264 0.3041675), wk = 0.0026247 k( 303) = ( -0.3146560 0.6398894 0.3146560), wk = 0.0026247 k( 304) = ( -0.3251446 0.6445524 0.3251446), wk = 0.0026247 k( 305) = ( -0.3356331 0.6492154 0.3356331), wk = 0.0026247 k( 306) = ( -0.3461216 0.6538784 0.3461216), wk = 0.0026247 k( 307) = ( -0.3461216 0.6538784 0.3461216), wk = 0.0026247 k( 308) = ( -0.3516173 0.6483827 0.3516173), wk = 0.0026247 k( 309) = ( -0.3571129 0.6428870 0.3571129), wk = 0.0026247 k( 310) = ( -0.3626086 0.6373914 0.3626086), wk = 0.0026247 k( 311) = ( -0.3681043 0.6318957 0.3681043), wk = 0.0026247 k( 312) = ( -0.3735999 0.6264001 0.3735999), wk = 0.0026247 k( 313) = ( -0.3790956 0.6209044 0.3790956), wk = 0.0026247 k( 314) = ( -0.3845912 0.6154088 0.3845912), wk = 0.0026247 k( 315) = ( -0.3900869 0.6099131 0.3900869), wk = 0.0026247 k( 316) = ( -0.3955825 0.6044175 0.3955825), wk = 0.0026247 k( 317) = ( -0.4010782 0.5989218 0.4010782), wk = 0.0026247 k( 318) = ( -0.4065739 0.5934261 0.4065739), wk = 0.0026247 k( 319) = ( -0.4120695 0.5879305 0.4120695), wk = 0.0026247 k( 320) = ( -0.4175652 0.5824348 0.4175652), wk = 0.0026247 k( 321) = ( -0.4230608 0.5769392 0.4230608), wk = 0.0026247 k( 322) = ( -0.4285565 0.5714435 0.4285565), wk = 0.0026247 k( 323) = ( -0.4340521 0.5659479 0.4340521), wk = 0.0026247 k( 324) = ( -0.4395478 0.5604522 0.4395478), wk = 0.0026247 k( 325) = ( -0.4450434 0.5549566 0.4450434), wk = 0.0026247 k( 326) = ( -0.4505391 0.5494609 0.4505391), wk = 0.0026247 k( 327) = ( -0.4560347 0.5439652 0.4560347), wk = 0.0026247 k( 328) = ( -0.4615304 0.5384696 0.4615304), wk = 0.0026247 k( 329) = ( -0.4670261 0.5329739 0.4670261), wk = 0.0026247 k( 330) = ( -0.4725217 0.5274783 0.4725217), wk = 0.0026247 k( 331) = ( -0.4780174 0.5219826 0.4780174), wk = 0.0026247 k( 332) = ( -0.4835130 0.5164870 0.4835130), wk = 0.0026247 k( 333) = ( -0.4890087 0.5109913 0.4890087), wk = 0.0026247 k( 334) = ( -0.4945043 0.5054957 0.4945043), wk = 0.0026247 k( 335) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0026247 k( 336) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026247 k( 337) = ( 0.0055556 0.0055556 0.4944444), wk = 0.0026247 k( 338) = ( 0.0111111 0.0111111 0.4888889), wk = 0.0026247 k( 339) = ( 0.0166667 0.0166667 0.4833333), wk = 0.0026247 k( 340) = ( 0.0222222 0.0222222 0.4777778), wk = 0.0026247 k( 341) = ( 0.0277778 0.0277778 0.4722222), wk = 0.0026247 k( 342) = ( 0.0333333 0.0333333 0.4666667), wk = 0.0026247 k( 343) = ( 0.0388889 0.0388889 0.4611111), wk = 0.0026247 k( 344) = ( 0.0444444 0.0444444 0.4555556), wk = 0.0026247 k( 345) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0026247 k( 346) = ( 0.0555556 0.0555556 0.4444444), wk = 0.0026247 k( 347) = ( 0.0611111 0.0611111 0.4388889), wk = 0.0026247 k( 348) = ( 0.0666667 0.0666667 0.4333333), wk = 0.0026247 k( 349) = ( 0.0722222 0.0722222 0.4277778), wk = 0.0026247 k( 350) = ( 0.0777778 0.0777778 0.4222222), wk = 0.0026247 k( 351) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0026247 k( 352) = ( 0.0888889 0.0888889 0.4111111), wk = 0.0026247 k( 353) = ( 0.0944444 0.0944444 0.4055556), wk = 0.0026247 k( 354) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0026247 k( 355) = ( 0.1055556 0.1055556 0.3944444), wk = 0.0026247 k( 356) = ( 0.1111111 0.1111111 0.3888889), wk = 0.0026247 k( 357) = ( 0.1166667 0.1166667 0.3833333), wk = 0.0026247 k( 358) = ( 0.1222222 0.1222222 0.3777778), wk = 0.0026247 k( 359) = ( 0.1277778 0.1277778 0.3722222), wk = 0.0026247 k( 360) = ( 0.1333333 0.1333333 0.3666667), wk = 0.0026247 k( 361) = ( 0.1388889 0.1388889 0.3611111), wk = 0.0026247 k( 362) = ( 0.1444444 0.1444444 0.3555556), wk = 0.0026247 k( 363) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0026247 k( 364) = ( 0.1555556 0.1555556 0.3444444), wk = 0.0026247 k( 365) = ( 0.1611111 0.1611111 0.3388889), wk = 0.0026247 k( 366) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0026247 k( 367) = ( 0.1722222 0.1722222 0.3277778), wk = 0.0026247 k( 368) = ( 0.1777778 0.1777778 0.3222222), wk = 0.0026247 k( 369) = ( 0.1833333 0.1833333 0.3166667), wk = 0.0026247 k( 370) = ( 0.1888889 0.1888889 0.3111111), wk = 0.0026247 k( 371) = ( 0.1944444 0.1944444 0.3055556), wk = 0.0026247 k( 372) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0026247 k( 373) = ( 0.2055556 0.2055556 0.2944444), wk = 0.0026247 k( 374) = ( 0.2111111 0.2111111 0.2888889), wk = 0.0026247 k( 375) = ( 0.2166667 0.2166667 0.2833333), wk = 0.0026247 k( 376) = ( 0.2222222 0.2222222 0.2777778), wk = 0.0026247 k( 377) = ( 0.2277778 0.2277778 0.2722222), wk = 0.0026247 k( 378) = ( 0.2333333 0.2333333 0.2666667), wk = 0.0026247 k( 379) = ( 0.2388889 0.2388889 0.2611111), wk = 0.0026247 k( 380) = ( 0.2444444 0.2444444 0.2555556), wk = 0.0026247 k( 381) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026247 Dense grid: 48073 G-vectors FFT dimensions: ( 54, 54, 54) Smooth grid: 22223 G-vectors FFT dimensions: ( 40, 40, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.12 Mb ( 120, 64) NL pseudopotentials 0.16 Mb ( 60, 170) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 998) G-vector shells 0.00 Mb ( 473) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.47 Mb ( 120, 256) Each subspace H/S matrix 1.00 Mb ( 256, 256) Each matrix 0.33 Mb ( 170, 2, 64) The potential is recalculated from file : ./Ni4W.save/charge-density.dat Starting wfc are 98 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 44.8 secs Computing kpt #: 2 total cpu time spent up to now is 46.8 secs Computing kpt #: 3 total cpu time spent up to now is 48.8 secs Computing kpt #: 4 total cpu time spent up to now is 50.7 secs Computing kpt #: 5 total cpu time spent up to now is 52.6 secs Computing kpt #: 6 total cpu time spent up to now is 54.4 secs Computing kpt #: 7 total cpu time spent up to now is 56.3 secs Computing kpt #: 8 total cpu time spent up to now is 58.4 secs Computing kpt #: 9 total cpu time spent up to now is 60.3 secs Computing kpt #: 10 total cpu time spent up to now is 62.1 secs Computing kpt #: 11 total cpu time spent up to now is 63.9 secs Computing kpt #: 12 total cpu time spent up to now is 65.9 secs Computing kpt #: 13 total cpu time spent up to now is 67.8 secs Computing kpt #: 14 total cpu time spent up to now is 69.7 secs Computing kpt #: 15 total cpu time spent up to now is 71.4 secs Computing kpt #: 16 total cpu time spent up to now is 73.3 secs Computing kpt #: 17 total cpu time spent up to now is 75.3 secs Computing kpt #: 18 total cpu time spent up to now is 77.2 secs Computing kpt #: 19 total cpu time spent up to now is 78.9 secs Computing kpt #: 20 total cpu time spent up to now is 80.7 secs Computing kpt #: 21 total cpu time spent up to now is 82.6 secs Computing kpt #: 22 total cpu time spent up to now is 84.5 secs Computing kpt #: 23 total cpu time spent up to now is 86.3 secs Computing kpt #: 24 total cpu time spent up to now is 88.0 secs Computing kpt #: 25 total cpu time spent up to now is 89.8 secs Computing kpt #: 26 total cpu time spent up to now is 91.7 secs Computing kpt #: 27 total cpu time spent up to now is 93.4 secs Computing kpt #: 28 total cpu time spent up to now is 95.1 secs Computing kpt #: 29 total cpu time spent up to now is 97.0 secs Computing kpt #: 30 total cpu time spent up to now is 98.8 secs Computing kpt #: 31 total cpu time spent up to now is 100.7 secs Computing kpt #: 32 total cpu time spent up to now is 102.5 secs Computing kpt #: 33 total cpu time spent up to now is 104.3 secs Computing kpt #: 34 total cpu time spent up to now is 106.1 secs Computing kpt #: 35 total cpu time spent up to now is 108.0 secs Computing kpt #: 36 total cpu time spent up to now is 109.8 secs Computing kpt #: 37 total cpu time spent up to now is 111.6 secs Computing kpt #: 38 total cpu time spent up to now is 113.4 secs Computing kpt #: 39 total cpu time spent up to now is 115.2 secs Computing kpt #: 40 total cpu time spent up to now is 117.0 secs Computing kpt #: 41 total cpu time spent up to now is 118.7 secs Computing kpt #: 42 total cpu time spent up to now is 120.5 secs Computing kpt #: 43 total cpu time spent up to now is 122.3 secs Computing kpt #: 44 total cpu time spent up to now is 124.1 secs Computing kpt #: 45 total cpu time spent up to now is 125.8 secs Computing kpt #: 46 total cpu time spent up to now is 127.6 secs Computing kpt #: 47 total cpu time spent up to now is 129.3 secs Computing kpt #: 48 total cpu time spent up to now is 131.0 secs Computing kpt #: 49 total cpu time spent up to now is 132.7 secs Computing kpt #: 50 total cpu time spent up to now is 134.4 secs Computing kpt #: 51 total cpu time spent up to now is 136.1 secs Computing kpt #: 52 total cpu time spent up to now is 137.9 secs Computing kpt #: 53 total cpu time spent up to now is 139.6 secs Computing kpt #: 54 total cpu time spent up to now is 141.4 secs Computing kpt #: 55 total cpu time spent up to now is 143.2 secs Computing kpt #: 56 total cpu time spent up to now is 145.2 secs Computing kpt #: 57 total cpu time spent up to now is 147.2 secs Computing kpt #: 58 total cpu time spent up to now is 149.0 secs Computing kpt #: 59 total cpu time spent up to now is 151.0 secs Computing kpt #: 60 total cpu time spent up to now is 152.8 secs Computing kpt #: 61 total cpu time spent up to now is 154.7 secs Computing kpt #: 62 total cpu time spent up to now is 156.5 secs Computing kpt #: 63 total cpu time spent up to now is 158.4 secs Computing kpt #: 64 total cpu time spent up to now is 160.4 secs Computing kpt #: 65 total cpu time spent up to now is 162.4 secs Computing kpt #: 66 total cpu time spent up to now is 164.5 secs Computing kpt #: 67 total cpu time spent up to now is 166.5 secs Computing kpt #: 68 total cpu time spent up to now is 168.6 secs Computing kpt #: 69 total cpu time spent up to now is 170.6 secs Computing kpt #: 70 total cpu time spent up to now is 172.7 secs Computing kpt #: 71 total cpu time spent up to now is 174.7 secs Computing kpt #: 72 total cpu time spent up to now is 176.8 secs Computing kpt #: 73 total cpu time spent up to now is 178.9 secs Computing kpt #: 74 total cpu time spent up to now is 181.0 secs Computing kpt #: 75 total cpu time spent up to now is 183.1 secs Computing kpt #: 76 total cpu time spent up to now is 185.1 secs Computing kpt #: 77 total cpu time spent up to now is 187.3 secs Computing kpt #: 78 total cpu time spent up to now is 189.4 secs Computing kpt #: 79 total cpu time spent up to now is 191.4 secs Computing kpt #: 80 total cpu time spent up to now is 193.1 secs Computing kpt #: 81 total cpu time spent up to now is 195.1 secs Computing kpt #: 82 total cpu time spent up to now is 197.1 secs Computing kpt #: 83 total cpu time spent up to now is 199.2 secs Computing kpt #: 84 total cpu time spent up to now is 201.3 secs Computing kpt #: 85 total cpu time spent up to now is 203.4 secs Computing kpt #: 86 total cpu time spent up to now is 205.5 secs Computing kpt #: 87 total cpu time spent up to now is 207.6 secs Computing kpt #: 88 total cpu time spent up to now is 209.6 secs Computing kpt #: 89 total cpu time spent up to now is 211.7 secs Computing kpt #: 90 total cpu time spent up to now is 213.7 secs Computing kpt #: 91 total cpu time spent up to now is 215.6 secs Computing kpt #: 92 total cpu time spent up to now is 217.7 secs Computing kpt #: 93 total cpu time spent up to now is 219.7 secs Computing kpt #: 94 total cpu time spent up to now is 221.7 secs Computing kpt #: 95 total cpu time spent up to now is 223.5 secs Computing kpt #: 96 total cpu time spent up to now is 225.4 secs Computing kpt #: 97 total cpu time spent up to now is 227.2 secs Computing kpt #: 98 total cpu time spent up to now is 229.1 secs Computing kpt #: 99 total cpu time spent up to now is 231.0 secs Computing kpt #: 100 total cpu time spent up to now is 232.8 secs Computing kpt #: 101 total cpu time spent up to now is 234.8 secs Computing kpt #: 102 total cpu time spent up to now is 236.6 secs Computing kpt #: 103 total cpu time spent up to now is 238.4 secs Computing kpt #: 104 total cpu time spent up to now is 240.3 secs Computing kpt #: 105 total cpu time spent up to now is 242.1 secs Computing kpt #: 106 total cpu time spent up to now is 243.9 secs Computing kpt #: 107 total cpu time spent up to now is 245.7 secs Computing kpt #: 108 total cpu time spent up to now is 247.6 secs Computing kpt #: 109 total cpu time spent up to now is 249.6 secs Computing kpt #: 110 total cpu time spent up to now is 251.4 secs Computing kpt #: 111 total cpu time spent up to now is 253.4 secs Computing kpt #: 112 total cpu time spent up to now is 255.3 secs Computing kpt #: 113 total cpu time spent up to now is 257.2 secs Computing kpt #: 114 total cpu time spent up to now is 259.1 secs Computing kpt #: 115 total cpu time spent up to now is 261.0 secs Computing kpt #: 116 total cpu time spent up to now is 262.7 secs Computing kpt #: 117 total cpu time spent up to now is 264.5 secs Computing kpt #: 118 total cpu time spent up to now is 266.2 secs Computing kpt #: 119 total cpu time spent up to now is 268.0 secs Computing kpt #: 120 total cpu time spent up to now is 269.7 secs Computing kpt #: 121 total cpu time spent up to now is 271.6 secs Computing kpt #: 122 total cpu time spent up to now is 273.3 secs Computing kpt #: 123 total cpu time spent up to now is 275.1 secs Computing kpt #: 124 total cpu time spent up to now is 276.9 secs Computing kpt #: 125 total cpu time spent up to now is 278.8 secs Computing kpt #: 126 total cpu time spent up to now is 280.7 secs Computing kpt #: 127 total cpu time spent up to now is 282.7 secs Computing kpt #: 128 total cpu time spent up to now is 284.6 secs Computing kpt #: 129 total cpu time spent up to now is 286.5 secs Computing kpt #: 130 total cpu time spent up to now is 288.3 secs Computing kpt #: 131 total cpu time spent up to now is 290.2 secs Computing kpt #: 132 total cpu time spent up to now is 292.2 secs Computing kpt #: 133 total cpu time spent up to now is 294.2 secs Computing kpt #: 134 total cpu time spent up to now is 296.2 secs Computing kpt #: 135 total cpu time spent up to now is 298.2 secs Computing kpt #: 136 total cpu time spent up to now is 300.0 secs Computing kpt #: 137 total cpu time spent up to now is 301.9 secs Computing kpt #: 138 total cpu time spent up to now is 303.8 secs Computing kpt #: 139 total cpu time spent up to now is 305.6 secs Computing kpt #: 140 total cpu time spent up to now is 307.6 secs Computing kpt #: 141 total cpu time spent up to now is 309.6 secs Computing kpt #: 142 total cpu time spent up to now is 311.5 secs Computing kpt #: 143 total cpu time spent up to now is 313.4 secs Computing kpt #: 144 total cpu time spent up to now is 315.3 secs Computing kpt #: 145 total cpu time spent up to now is 317.2 secs Computing kpt #: 146 total cpu time spent up to now is 319.2 secs Computing kpt #: 147 total cpu time spent up to now is 321.2 secs Computing kpt #: 148 total cpu time spent up to now is 323.1 secs Computing kpt #: 149 total cpu time spent up to now is 324.9 secs Computing kpt #: 150 total cpu time spent up to now is 326.9 secs Computing kpt #: 151 total cpu time spent up to now is 328.8 secs Computing kpt #: 152 total cpu time spent up to now is 330.9 secs Computing kpt #: 153 total cpu time spent up to now is 332.8 secs Computing kpt #: 154 total cpu time spent up to now is 334.8 secs Computing kpt #: 155 total cpu time spent up to now is 337.0 secs Computing kpt #: 156 total cpu time spent up to now is 339.4 secs Computing kpt #: 157 total cpu time spent up to now is 341.8 secs Computing kpt #: 158 total cpu time spent up to now is 344.2 secs Computing kpt #: 159 total cpu time spent up to now is 346.5 secs Computing kpt #: 160 total cpu time spent up to now is 348.8 secs Computing kpt #: 161 total cpu time spent up to now is 351.2 secs Computing kpt #: 162 total cpu time spent up to now is 353.7 secs Computing kpt #: 163 total cpu time spent up to now is 356.3 secs Computing kpt #: 164 total cpu time spent up to now is 358.8 secs Computing kpt #: 165 total cpu time spent up to now is 361.5 secs Computing kpt #: 166 total cpu time spent up to now is 364.4 secs Computing kpt #: 167 total cpu time spent up to now is 367.2 secs Computing kpt #: 168 total cpu time spent up to now is 370.0 secs Computing kpt #: 169 total cpu time spent up to now is 372.9 secs Computing kpt #: 170 total cpu time spent up to now is 375.9 secs Computing kpt #: 171 total cpu time spent up to now is 378.9 secs Computing kpt #: 172 total cpu time spent up to now is 381.8 secs Computing kpt #: 173 total cpu time spent up to now is 384.7 secs Computing kpt #: 174 total cpu time spent up to now is 387.8 secs Computing kpt #: 175 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 393.0 secs Computing kpt #: 176 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 398.5 secs Computing kpt #: 177 total cpu time spent up to now is 402.0 secs Computing kpt #: 178 total cpu time spent up to now is 405.2 secs Computing kpt #: 179 total cpu time spent up to now is 408.2 secs Computing kpt #: 180 total cpu time spent up to now is 411.1 secs Computing kpt #: 181 total cpu time spent up to now is 414.1 secs Computing kpt #: 182 total cpu time spent up to now is 416.7 secs Computing kpt #: 183 total cpu time spent up to now is 419.6 secs Computing kpt #: 184 total cpu time spent up to now is 422.6 secs Computing kpt #: 185 total cpu time spent up to now is 425.4 secs Computing kpt #: 186 total cpu time spent up to now is 428.0 secs Computing kpt #: 187 total cpu time spent up to now is 430.8 secs Computing kpt #: 188 total cpu time spent up to now is 433.7 secs Computing kpt #: 189 total cpu time spent up to now is 436.0 secs Computing kpt #: 190 total cpu time spent up to now is 438.9 secs Computing kpt #: 191 total cpu time spent up to now is 441.8 secs Computing kpt #: 192 total cpu time spent up to now is 444.6 secs Computing kpt #: 193 total cpu time spent up to now is 447.2 secs Computing kpt #: 194 total cpu time spent up to now is 449.6 secs Computing kpt #: 195 total cpu time spent up to now is 452.4 secs Computing kpt #: 196 total cpu time spent up to now is 455.3 secs Computing kpt #: 197 total cpu time spent up to now is 458.1 secs Computing kpt #: 198 total cpu time spent up to now is 461.3 secs Computing kpt #: 199 total cpu time spent up to now is 464.3 secs Computing kpt #: 200 total cpu time spent up to now is 467.3 secs Computing kpt #: 201 total cpu time spent up to now is 470.3 secs Computing kpt #: 202 total cpu time spent up to now is 473.2 secs Computing kpt #: 203 total cpu time spent up to now is 476.1 secs Computing kpt #: 204 total cpu time spent up to now is 478.6 secs Computing kpt #: 205 total cpu time spent up to now is 481.3 secs Computing kpt #: 206 total cpu time spent up to now is 483.7 secs Computing kpt #: 207 total cpu time spent up to now is 486.0 secs Computing kpt #: 208 total cpu time spent up to now is 488.3 secs Computing kpt #: 209 total cpu time spent up to now is 490.6 secs Computing kpt #: 210 total cpu time spent up to now is 492.9 secs Computing kpt #: 211 total cpu time spent up to now is 495.0 secs Computing kpt #: 212 total cpu time spent up to now is 497.4 secs Computing kpt #: 213 total cpu time spent up to now is 499.6 secs Computing kpt #: 214 total cpu time spent up to now is 501.9 secs Computing kpt #: 215 total cpu time spent up to now is 504.1 secs Computing kpt #: 216 total cpu time spent up to now is 506.4 secs Computing kpt #: 217 total cpu time spent up to now is 508.5 secs Computing kpt #: 218 total cpu time spent up to now is 510.8 secs Computing kpt #: 219 total cpu time spent up to now is 513.0 secs Computing kpt #: 220 total cpu time spent up to now is 515.2 secs Computing kpt #: 221 total cpu time spent up to now is 517.5 secs Computing kpt #: 222 total cpu time spent up to now is 519.8 secs Computing kpt #: 223 total cpu time spent up to now is 522.0 secs Computing kpt #: 224 total cpu time spent up to now is 524.2 secs Computing kpt #: 225 total cpu time spent up to now is 526.5 secs Computing kpt #: 226 total cpu time spent up to now is 528.8 secs Computing kpt #: 227 total cpu time spent up to now is 531.1 secs Computing kpt #: 228 total cpu time spent up to now is 533.4 secs Computing kpt #: 229 total cpu time spent up to now is 535.8 secs Computing kpt #: 230 total cpu time spent up to now is 538.2 secs Computing kpt #: 231 total cpu time spent up to now is 540.7 secs Computing kpt #: 232 total cpu time spent up to now is 543.1 secs Computing kpt #: 233 total cpu time spent up to now is 545.7 secs Computing kpt #: 234 total cpu time spent up to now is 548.3 secs Computing kpt #: 235 total cpu time spent up to now is 550.9 secs Computing kpt #: 236 total cpu time spent up to now is 553.5 secs Computing kpt #: 237 total cpu time spent up to now is 556.1 secs Computing kpt #: 238 total cpu time spent up to now is 558.6 secs Computing kpt #: 239 total cpu time spent up to now is 561.1 secs Computing kpt #: 240 total cpu time spent up to now is 563.5 secs Computing kpt #: 241 total cpu time spent up to now is 565.8 secs Computing kpt #: 242 total cpu time spent up to now is 568.1 secs Computing kpt #: 243 total cpu time spent up to now is 570.4 secs Computing kpt #: 244 total cpu time spent up to now is 572.5 secs Computing kpt #: 245 total cpu time spent up to now is 574.8 secs Computing kpt #: 246 total cpu time spent up to now is 577.2 secs Computing kpt #: 247 total cpu time spent up to now is 579.7 secs Computing kpt #: 248 total cpu time spent up to now is 582.2 secs Computing kpt #: 249 total cpu time spent up to now is 584.7 secs Computing kpt #: 250 total cpu time spent up to now is 587.2 secs Computing kpt #: 251 total cpu time spent up to now is 589.8 secs Computing kpt #: 252 total cpu time spent up to now is 592.4 secs Computing kpt #: 253 total cpu time spent up to now is 595.0 secs Computing kpt #: 254 total cpu time spent up to now is 597.7 secs Computing kpt #: 255 total cpu time spent up to now is 600.3 secs Computing kpt #: 256 total cpu time spent up to now is 602.9 secs Computing kpt #: 257 total cpu time spent up to now is 605.5 secs Computing kpt #: 258 total cpu time spent up to now is 608.0 secs Computing kpt #: 259 total cpu time spent up to now is 610.6 secs Computing kpt #: 260 total cpu time spent up to now is 613.1 secs Computing kpt #: 261 total cpu time spent up to now is 615.7 secs Computing kpt #: 262 total cpu time spent up to now is 618.2 secs Computing kpt #: 263 total cpu time spent up to now is 620.6 secs Computing kpt #: 264 total cpu time spent up to now is 623.1 secs Computing kpt #: 265 total cpu time spent up to now is 625.5 secs Computing kpt #: 266 total cpu time spent up to now is 627.8 secs Computing kpt #: 267 total cpu time spent up to now is 630.2 secs Computing kpt #: 268 total cpu time spent up to now is 632.4 secs Computing kpt #: 269 total cpu time spent up to now is 634.6 secs Computing kpt #: 270 total cpu time spent up to now is 636.8 secs Computing kpt #: 271 total cpu time spent up to now is 638.9 secs Computing kpt #: 272 total cpu time spent up to now is 641.0 secs Computing kpt #: 273 total cpu time spent up to now is 643.1 secs Computing kpt #: 274 total cpu time spent up to now is 645.3 secs Computing kpt #: 275 total cpu time spent up to now is 647.3 secs Computing kpt #: 276 total cpu time spent up to now is 649.4 secs Computing kpt #: 277 total cpu time spent up to now is 651.6 secs Computing kpt #: 278 total cpu time spent up to now is 654.0 secs Computing kpt #: 279 total cpu time spent up to now is 656.2 secs Computing kpt #: 280 total cpu time spent up to now is 658.5 secs Computing kpt #: 281 total cpu time spent up to now is 660.9 secs Computing kpt #: 282 total cpu time spent up to now is 663.2 secs Computing kpt #: 283 total cpu time spent up to now is 665.6 secs Computing kpt #: 284 total cpu time spent up to now is 667.9 secs Computing kpt #: 285 total cpu time spent up to now is 670.3 secs Computing kpt #: 286 total cpu time spent up to now is 672.7 secs Computing kpt #: 287 total cpu time spent up to now is 675.1 secs Computing kpt #: 288 total cpu time spent up to now is 677.6 secs Computing kpt #: 289 total cpu time spent up to now is 680.0 secs Computing kpt #: 290 total cpu time spent up to now is 682.5 secs Computing kpt #: 291 total cpu time spent up to now is 684.9 secs Computing kpt #: 292 total cpu time spent up to now is 687.3 secs Computing kpt #: 293 total cpu time spent up to now is 689.8 secs Computing kpt #: 294 total cpu time spent up to now is 692.3 secs Computing kpt #: 295 total cpu time spent up to now is 694.8 secs Computing kpt #: 296 total cpu time spent up to now is 697.1 secs Computing kpt #: 297 total cpu time spent up to now is 699.6 secs Computing kpt #: 298 total cpu time spent up to now is 702.0 secs Computing kpt #: 299 total cpu time spent up to now is 704.6 secs Computing kpt #: 300 total cpu time spent up to now is 707.2 secs Computing kpt #: 301 total cpu time spent up to now is 710.0 secs Computing kpt #: 302 total cpu time spent up to now is 712.6 secs Computing kpt #: 303 total cpu time spent up to now is 715.8 secs Computing kpt #: 304 total cpu time spent up to now is 718.7 secs Computing kpt #: 305 total cpu time spent up to now is 721.7 secs Computing kpt #: 306 total cpu time spent up to now is 724.7 secs Computing kpt #: 307 total cpu time spent up to now is 727.7 secs Computing kpt #: 308 total cpu time spent up to now is 730.8 secs Computing kpt #: 309 total cpu time spent up to now is 733.8 secs Computing kpt #: 310 total cpu time spent up to now is 736.6 secs Computing kpt #: 311 total cpu time spent up to now is 739.4 secs Computing kpt #: 312 total cpu time spent up to now is 741.7 secs Computing kpt #: 313 total cpu time spent up to now is 744.0 secs Computing kpt #: 314 total cpu time spent up to now is 746.2 secs Computing kpt #: 315 total cpu time spent up to now is 748.3 secs Computing kpt #: 316 total cpu time spent up to now is 750.6 secs Computing kpt #: 317 total cpu time spent up to now is 752.7 secs Computing kpt #: 318 total cpu time spent up to now is 754.8 secs Computing kpt #: 319 total cpu time spent up to now is 757.1 secs Computing kpt #: 320 total cpu time spent up to now is 759.3 secs Computing kpt #: 321 total cpu time spent up to now is 761.4 secs Computing kpt #: 322 total cpu time spent up to now is 763.6 secs Computing kpt #: 323 total cpu time spent up to now is 765.7 secs Computing kpt #: 324 total cpu time spent up to now is 768.0 secs Computing kpt #: 325 total cpu time spent up to now is 770.2 secs Computing kpt #: 326 total cpu time spent up to now is 772.5 secs Computing kpt #: 327 total cpu time spent up to now is 774.7 secs Computing kpt #: 328 total cpu time spent up to now is 776.9 secs Computing kpt #: 329 total cpu time spent up to now is 779.0 secs Computing kpt #: 330 total cpu time spent up to now is 781.2 secs Computing kpt #: 331 total cpu time spent up to now is 783.3 secs Computing kpt #: 332 total cpu time spent up to now is 785.5 secs Computing kpt #: 333 total cpu time spent up to now is 787.6 secs Computing kpt #: 334 total cpu time spent up to now is 789.6 secs Computing kpt #: 335 total cpu time spent up to now is 791.3 secs Computing kpt #: 336 total cpu time spent up to now is 793.1 secs Computing kpt #: 337 total cpu time spent up to now is 794.9 secs Computing kpt #: 338 total cpu time spent up to now is 796.6 secs Computing kpt #: 339 total cpu time spent up to now is 798.4 secs Computing kpt #: 340 total cpu time spent up to now is 800.2 secs Computing kpt #: 341 total cpu time spent up to now is 802.0 secs Computing kpt #: 342 total cpu time spent up to now is 804.0 secs Computing kpt #: 343 total cpu time spent up to now is 805.8 secs Computing kpt #: 344 total cpu time spent up to now is 807.5 secs Computing kpt #: 345 total cpu time spent up to now is 809.3 secs Computing kpt #: 346 total cpu time spent up to now is 811.0 secs Computing kpt #: 347 total cpu time spent up to now is 812.9 secs Computing kpt #: 348 total cpu time spent up to now is 814.9 secs Computing kpt #: 349 total cpu time spent up to now is 816.7 secs Computing kpt #: 350 total cpu time spent up to now is 818.7 secs Computing kpt #: 351 total cpu time spent up to now is 820.7 secs Computing kpt #: 352 total cpu time spent up to now is 822.9 secs Computing kpt #: 353 total cpu time spent up to now is 825.1 secs Computing kpt #: 354 total cpu time spent up to now is 827.3 secs Computing kpt #: 355 total cpu time spent up to now is 829.7 secs Computing kpt #: 356 total cpu time spent up to now is 832.1 secs Computing kpt #: 357 total cpu time spent up to now is 834.5 secs Computing kpt #: 358 total cpu time spent up to now is 836.9 secs Computing kpt #: 359 total cpu time spent up to now is 839.3 secs Computing kpt #: 360 total cpu time spent up to now is 841.9 secs Computing kpt #: 361 total cpu time spent up to now is 844.3 secs Computing kpt #: 362 total cpu time spent up to now is 846.8 secs Computing kpt #: 363 total cpu time spent up to now is 849.3 secs Computing kpt #: 364 total cpu time spent up to now is 851.8 secs Computing kpt #: 365 total cpu time spent up to now is 854.3 secs Computing kpt #: 366 total cpu time spent up to now is 856.8 secs Computing kpt #: 367 total cpu time spent up to now is 859.5 secs Computing kpt #: 368 total cpu time spent up to now is 861.9 secs Computing kpt #: 369 total cpu time spent up to now is 864.3 secs Computing kpt #: 370 total cpu time spent up to now is 866.8 secs Computing kpt #: 371 total cpu time spent up to now is 869.1 secs Computing kpt #: 372 total cpu time spent up to now is 871.6 secs Computing kpt #: 373 total cpu time spent up to now is 873.9 secs Computing kpt #: 374 total cpu time spent up to now is 876.2 secs Computing kpt #: 375 total cpu time spent up to now is 878.6 secs Computing kpt #: 376 total cpu time spent up to now is 880.9 secs Computing kpt #: 377 total cpu time spent up to now is 883.3 secs Computing kpt #: 378 total cpu time spent up to now is 885.6 secs Computing kpt #: 379 total cpu time spent up to now is 887.9 secs Computing kpt #: 380 total cpu time spent up to now is 890.3 secs Computing kpt #: 381 total cpu time spent up to now is 892.5 secs ethr = 1.85E-11, avg # of iterations = 27.6 total cpu time spent up to now is 892.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2747 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3916 -19.3916 7.0144 7.0144 11.9844 11.9844 12.1367 12.1367 12.8280 12.8280 12.9205 12.9205 12.9381 12.9381 12.9496 12.9496 13.3664 13.3664 13.3891 13.3891 13.5164 13.5164 13.7496 13.7496 13.8245 13.8245 13.8274 13.8274 14.2079 14.2079 14.2689 14.2689 14.4522 14.4522 15.2318 15.2318 15.2638 15.2638 15.2939 15.2939 15.3574 15.3574 15.8430 15.8430 15.9969 15.9969 16.3850 16.3850 17.3039 17.3039 17.8224 17.8224 17.9582 17.9582 19.7413 19.7413 20.0484 20.0484 k = 0.0000 0.0000 0.0140 ( 2747 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3916 -19.3916 7.0162 7.0162 11.9832 11.9832 12.1344 12.1344 12.8273 12.8273 12.9186 12.9186 12.9374 12.9374 12.9484 12.9484 13.3685 13.3685 13.3922 13.3922 13.5075 13.5075 13.7458 13.7458 13.8043 13.8043 13.8633 13.8633 14.2078 14.2078 14.2690 14.2690 14.4527 14.4527 15.2306 15.2306 15.2619 15.2619 15.2950 15.2950 15.3585 15.3585 15.8422 15.8422 15.9964 15.9964 16.3850 16.3850 17.3039 17.3039 17.8223 17.8223 17.9582 17.9582 19.7334 19.7334 20.0373 20.0373 k = 0.0000 0.0000 0.0280 ( 2739 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3915 -19.3915 7.0216 7.0216 11.9796 11.9796 12.1277 12.1277 12.8246 12.8246 12.9113 12.9113 12.9355 12.9355 12.9471 12.9471 13.3730 13.3730 13.4025 13.4025 13.4835 13.4835 13.7385 13.7385 13.7950 13.7950 13.9133 13.9133 14.2075 14.2075 14.2693 14.2693 14.4542 14.4542 15.2272 15.2272 15.2573 15.2573 15.2975 15.2975 15.3618 15.3618 15.8398 15.8398 15.9951 15.9951 16.3853 16.3853 17.3041 17.3041 17.8221 17.8221 17.9583 17.9583 19.7079 19.7079 20.0099 20.0099 k = 0.0000 0.0000 0.0420 ( 2737 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4150 -19.4150 -19.3916 -19.3916 7.0306 7.0306 11.9735 11.9735 12.1167 12.1167 12.8189 12.8189 12.8965 12.8965 12.9343 12.9343 12.9480 12.9480 13.3767 13.3767 13.4193 13.4193 13.4521 13.4521 13.7328 13.7328 13.7911 13.7911 13.9720 13.9720 14.2069 14.2069 14.2701 14.2701 14.4568 14.4568 15.2215 15.2215 15.2517 15.2517 15.2999 15.2999 15.3669 15.3669 15.8359 15.8359 15.9929 15.9929 16.3857 16.3857 17.3043 17.3043 17.8213 17.8213 17.9587 17.9587 19.6610 19.6610 19.9794 19.9794 k = 0.0000 0.0000 0.0560 ( 2737 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4150 -19.4150 -19.3916 -19.3916 7.0432 7.0432 11.9650 11.9650 12.1018 12.1018 12.8091 12.8091 12.8756 12.8756 12.9353 12.9353 12.9509 12.9509 13.3750 13.3750 13.4123 13.4123 13.4518 13.4518 13.7299 13.7299 13.7893 13.7893 14.0365 14.0365 14.2059 14.2059 14.2714 14.2714 14.4607 14.4607 15.2139 15.2139 15.2459 15.2459 15.3017 15.3017 15.3733 15.3733 15.8304 15.8304 15.9899 15.9899 16.3862 16.3862 17.3046 17.3046 17.8196 17.8196 17.9599 17.9599 19.5918 19.5918 19.9557 19.9557 k = 0.0000 0.0000 0.0700 ( 2745 PWs) bands (ev): -57.7708 -57.7708 -29.1778 -29.1778 -19.4151 -19.4151 -19.3916 -19.3916 7.0594 7.0594 11.9541 11.9541 12.0833 12.0833 12.7940 12.7940 12.8512 12.8512 12.9385 12.9385 12.9553 12.9553 13.3501 13.3501 13.4026 13.4026 13.4809 13.4809 13.7293 13.7293 13.7884 13.7884 14.1047 14.1047 14.2041 14.2041 14.2735 14.2735 14.4662 14.4662 15.2050 15.2050 15.2403 15.2403 15.3027 15.3027 15.3805 15.3805 15.8232 15.8232 15.9863 15.9863 16.3867 16.3867 17.3051 17.3051 17.8165 17.8165 17.9624 17.9624 19.5049 19.5049 19.9407 19.9407 k = 0.0000 0.0000 0.0840 ( 2743 PWs) bands (ev): -57.7708 -57.7708 -29.1778 -29.1778 -19.4152 -19.4152 -19.3916 -19.3916 7.0791 7.0791 11.9406 11.9406 12.0616 12.0616 12.7737 12.7737 12.8250 12.8250 12.9433 12.9433 12.9612 12.9612 13.3104 13.3104 13.4072 13.4072 13.5145 13.5145 13.7301 13.7301 13.7881 13.7881 14.1741 14.1741 14.2018 14.2018 14.2773 14.2773 14.4738 14.4738 15.1952 15.1952 15.2347 15.2347 15.3029 15.3029 15.3881 15.3881 15.8144 15.8144 15.9820 15.9820 16.3874 16.3874 17.3056 17.3056 17.8113 17.8113 17.9667 17.9667 19.4066 19.4066 19.9326 19.9326 k = 0.0000 0.0000 0.0980 ( 2747 PWs) bands (ev): -57.7708 -57.7708 -29.1778 -29.1778 -19.4153 -19.4153 -19.3917 -19.3917 7.1024 7.1024 11.9247 11.9247 12.0371 12.0371 12.7487 12.7487 12.7979 12.7979 12.9492 12.9492 12.9682 12.9682 13.2691 13.2691 13.4155 13.4155 13.5504 13.5504 13.7315 13.7315 13.7889 13.7889 14.1966 14.1966 14.2418 14.2418 14.2860 14.2860 14.4847 14.4847 15.1852 15.1852 15.2291 15.2291 15.3022 15.3022 15.3957 15.3957 15.8040 15.8040 15.9772 15.9772 16.3879 16.3879 17.3063 17.3063 17.8039 17.8039 17.9731 17.9731 19.3022 19.3022 19.9288 19.9288 k = 0.0000 0.0000 0.1120 ( 2751 PWs) bands (ev): -57.7708 -57.7708 -29.1778 -29.1778 -19.4154 -19.4154 -19.3917 -19.3917 7.1292 7.1292 11.9065 11.9065 12.0098 12.0098 12.7202 12.7202 12.7701 12.7701 12.9556 12.9556 12.9758 12.9758 13.2289 13.2289 13.4257 13.4257 13.5875 13.5875 13.7325 13.7325 13.7914 13.7914 14.1915 14.1915 14.2756 14.2756 14.3257 14.3257 14.5014 14.5014 15.1753 15.1753 15.2235 15.2235 15.3009 15.3009 15.4031 15.4031 15.7919 15.7919 15.9721 15.9721 16.3885 16.3885 17.3070 17.3070 17.7938 17.7938 17.9819 17.9819 19.1954 19.1954 19.9277 19.9277 k = 0.0000 0.0000 0.1260 ( 2751 PWs) bands (ev): -57.7708 -57.7708 -29.1778 -29.1778 -19.4155 -19.4155 -19.3917 -19.3917 7.1596 7.1596 11.8859 11.8859 11.9799 11.9799 12.6894 12.6894 12.7417 12.7417 12.9618 12.9618 12.9834 12.9834 13.1911 13.1911 13.4375 13.4375 13.6245 13.6245 13.7329 13.7329 13.7963 13.7963 14.1849 14.1849 14.2851 14.2851 14.3825 14.3825 14.5296 14.5296 15.1658 15.1658 15.2179 15.2179 15.2988 15.2988 15.4103 15.4103 15.7783 15.7783 15.9666 15.9666 16.3888 16.3888 17.3079 17.3079 17.7813 17.7813 17.9930 17.9930 19.0885 19.0885 19.9279 19.9279 k = 0.0000 0.0000 0.1400 ( 2754 PWs) bands (ev): -57.7708 -57.7708 -29.1779 -29.1779 -19.4157 -19.4157 -19.3918 -19.3918 7.1934 7.1934 11.8632 11.8632 11.9474 11.9474 12.6575 12.6575 12.7129 12.7129 12.9670 12.9670 12.9902 12.9902 13.1570 13.1570 13.4506 13.4506 13.6591 13.6591 13.7335 13.7335 13.8041 13.8041 14.1768 14.1768 14.2930 14.2930 14.4258 14.4258 14.5765 14.5765 15.1568 15.1568 15.2123 15.2123 15.2961 15.2961 15.4171 15.4171 15.7631 15.7631 15.9610 15.9610 16.3890 16.3890 17.3090 17.3090 17.7664 17.7664 18.0061 18.0061 18.9834 18.9834 19.9288 19.9288 k = 0.0000 0.0000 0.1540 ( 2752 PWs) bands (ev): -57.7707 -57.7707 -29.1779 -29.1779 -19.4158 -19.4158 -19.3918 -19.3918 7.2306 7.2306 11.8386 11.8386 11.9121 11.9121 12.6251 12.6251 12.6838 12.6838 12.9687 12.9687 12.9964 12.9964 13.1284 13.1284 13.4650 13.4650 13.6847 13.6847 13.7404 13.7404 13.8151 13.8151 14.1673 14.1673 14.3015 14.3015 14.4538 14.4538 14.6417 14.6417 15.1487 15.1487 15.2067 15.2067 15.2927 15.2927 15.4235 15.4235 15.7465 15.7465 15.9552 15.9552 16.3889 16.3889 17.3101 17.3101 17.7493 17.7493 18.0210 18.0210 18.8814 18.8814 19.9295 19.9295 k = 0.0000 0.0000 0.1680 ( 2752 PWs) bands (ev): -57.7707 -57.7707 -29.1779 -29.1779 -19.4160 -19.4160 -19.3918 -19.3918 7.2712 7.2712 11.8123 11.8123 11.8739 11.8739 12.5927 12.5927 12.6549 12.6549 12.9631 12.9631 13.0033 13.0033 13.1075 13.1075 13.4807 13.4807 13.6916 13.6916 13.7627 13.7627 13.8291 13.8291 14.1565 14.1565 14.3107 14.3107 14.4733 14.4733 14.7174 14.7174 15.1414 15.1414 15.2012 15.2012 15.2887 15.2887 15.4297 15.4297 15.7285 15.7285 15.9495 15.9495 16.3885 16.3885 17.3114 17.3114 17.7303 17.7303 18.0374 18.0374 18.7834 18.7834 19.9295 19.9295 k = 0.0000 0.0000 0.1820 ( 2754 PWs) bands (ev): -57.7707 -57.7707 -29.1779 -29.1779 -19.4162 -19.4162 -19.3919 -19.3919 7.3152 7.3152 11.7843 11.7843 11.8328 11.8328 12.5607 12.5607 12.6265 12.6265 12.9480 12.9480 13.0121 13.0121 13.0951 13.0951 13.4975 13.4975 13.6859 13.6859 13.7939 13.7939 13.8464 13.8464 14.1444 14.1444 14.3210 14.3210 14.4891 14.4891 14.7982 14.7982 15.1353 15.1353 15.1958 15.1958 15.2842 15.2842 15.4356 15.4356 15.7091 15.7091 15.9437 15.9437 16.3877 16.3877 17.3128 17.3128 17.7096 17.7096 18.0547 18.0547 18.6904 18.6904 19.9282 19.9282 k = 0.0000 0.0000 0.1960 ( 2760 PWs) bands (ev): -57.7707 -57.7707 -29.1780 -29.1780 -19.4164 -19.4164 -19.3919 -19.3919 7.3625 7.3625 11.7541 11.7541 11.7893 11.7893 12.5294 12.5294 12.5989 12.5989 12.9254 12.9254 13.0224 13.0224 13.0896 13.0896 13.5153 13.5153 13.6749 13.6749 13.8258 13.8258 13.8675 13.8675 14.1311 14.1311 14.3321 14.3321 14.5035 14.5035 14.8808 14.8808 15.1308 15.1308 15.1906 15.1906 15.2793 15.2793 15.4414 15.4414 15.6886 15.6886 15.9381 15.9381 16.3864 16.3864 17.3144 17.3144 17.6874 17.6874 18.0724 18.0724 18.6034 18.6034 19.9249 19.9249 k = 0.0000 0.0000 0.2100 ( 2764 PWs) bands (ev): -57.7707 -57.7707 -29.1780 -29.1780 -19.4166 -19.4166 -19.3920 -19.3920 7.4131 7.4131 11.7187 11.7187 11.7464 11.7464 12.4988 12.4988 12.5725 12.5725 12.8983 12.8983 13.0339 13.0339 13.0879 13.0879 13.5343 13.5343 13.6608 13.6608 13.8549 13.8549 13.8932 13.8932 14.1167 14.1167 14.3441 14.3441 14.5175 14.5175 14.9625 14.9625 15.1290 15.1290 15.1854 15.1854 15.2743 15.2743 15.4473 15.4473 15.6669 15.6669 15.9327 15.9327 16.3848 16.3848 17.3160 17.3160 17.6639 17.6639 18.0897 18.0897 18.5234 18.5234 19.9191 19.9191 k = 0.0000 0.0000 0.2240 ( 2754 PWs) bands (ev): -57.7707 -57.7707 -29.1780 -29.1780 -19.4168 -19.4168 -19.3920 -19.3920 7.4669 7.4669 11.6724 11.6724 11.7099 11.7099 12.4693 12.4693 12.5475 12.5475 12.8693 12.8693 13.0465 13.0465 13.0878 13.0878 13.5541 13.5541 13.6446 13.6446 13.8809 13.8809 13.9227 13.9227 14.1013 14.1013 14.3570 14.3570 14.5314 14.5314 15.0366 15.0366 15.1349 15.1349 15.1805 15.1805 15.2700 15.2700 15.4536 15.4536 15.6442 15.6442 15.9275 15.9275 16.3827 16.3827 17.3178 17.3178 17.6394 17.6394 18.1052 18.1052 18.4521 18.4521 19.9101 19.9101 k = 0.0000 0.0000 0.2380 ( 2758 PWs) bands (ev): -57.7707 -57.7707 -29.1781 -29.1781 -19.4170 -19.4170 -19.3920 -19.3920 7.5239 7.5239 11.6169 11.6169 11.6784 11.6784 12.4408 12.4408 12.5239 12.5239 12.8400 12.8400 13.0599 13.0599 13.0880 13.0880 13.5747 13.5747 13.6268 13.6268 13.9054 13.9054 13.9537 13.9537 14.0848 14.0848 14.3707 14.3707 14.5455 14.5455 15.0811 15.0811 15.1657 15.1657 15.1767 15.1767 15.2687 15.2687 15.4608 15.4608 15.6207 15.6207 15.9227 15.9227 16.3802 16.3802 17.3197 17.3197 17.6140 17.6140 18.1164 18.1164 18.3919 18.3919 19.8972 19.8972 k = 0.0000 0.0000 0.2520 ( 2758 PWs) bands (ev): -57.7707 -57.7707 -29.1781 -29.1781 -19.4173 -19.4173 -19.3921 -19.3921 7.5839 7.5839 11.5553 11.5553 11.6486 11.6486 12.4134 12.4134 12.5020 12.5020 12.8111 12.8111 13.0737 13.0737 13.0881 13.0881 13.5940 13.5940 13.6097 13.6097 13.9297 13.9297 13.9845 13.9845 14.0675 14.0675 14.3852 14.3852 14.5597 14.5597 15.0918 15.0918 15.1699 15.1699 15.2147 15.2147 15.2843 15.2843 15.4699 15.4699 15.5964 15.5964 15.9182 15.9182 16.3775 16.3775 17.3217 17.3217 17.5881 17.5881 18.1193 18.1193 18.3470 18.3470 19.8798 19.8798 k = 0.0000 0.0000 0.2660 ( 2758 PWs) bands (ev): -57.7707 -57.7707 -29.1781 -29.1781 -19.4175 -19.4175 -19.3921 -19.3921 7.6470 7.6470 11.4889 11.4889 11.6198 11.6198 12.3871 12.3871 12.4817 12.4817 12.7835 12.7835 13.0833 13.0833 13.0925 13.0925 13.5842 13.5842 13.6211 13.6211 13.9542 13.9542 14.0138 14.0138 14.0499 14.0499 14.4004 14.4004 14.5742 14.5742 15.0927 15.0927 15.1650 15.1650 15.2289 15.2289 15.3377 15.3377 15.4836 15.4836 15.5716 15.5716 15.9143 15.9143 16.3749 16.3749 17.3237 17.3237 17.5617 17.5617 18.1091 18.1091 18.3220 18.3220 19.8573 19.8573 k = 0.0000 0.0000 0.2800 ( 2758 PWs) bands (ev): -57.7707 -57.7707 -29.1781 -29.1781 -19.4177 -19.4177 -19.3921 -19.3921 7.7130 7.7130 11.4179 11.4179 11.5919 11.5919 12.3618 12.3618 12.4630 12.4630 12.7573 12.7573 13.0826 13.0826 13.1069 13.1069 13.5628 13.5628 13.6438 13.6438 13.9791 13.9791 14.0269 14.0269 14.0460 14.0460 14.4162 14.4162 14.5887 14.5887 15.0910 15.0910 15.1601 15.1601 15.2273 15.2273 15.3965 15.3965 15.5089 15.5089 15.5465 15.5465 15.9108 15.9108 16.3728 16.3728 17.3258 17.3258 17.5351 17.5351 18.0862 18.0862 18.3167 18.3167 19.8290 19.8290 k = 0.0000 0.0000 0.2940 ( 2762 PWs) bands (ev): -57.7707 -57.7707 -29.1782 -29.1782 -19.4179 -19.4179 -19.3922 -19.3922 7.7818 7.7818 11.3427 11.3427 11.5647 11.5647 12.3378 12.3378 12.4459 12.4459 12.7330 12.7330 13.0794 13.0794 13.1234 13.1234 13.5401 13.5401 13.6677 13.6677 14.0031 14.0031 14.0105 14.0105 14.0704 14.0704 14.4325 14.4325 14.6034 14.6034 15.0880 15.0880 15.1551 15.1551 15.2225 15.2225 15.4352 15.4352 15.5197 15.5197 15.5580 15.5580 15.9080 15.9080 16.3718 16.3718 17.3278 17.3278 17.5087 17.5087 18.0560 18.0560 18.3251 18.3251 19.7947 19.7947 k = 0.0000 0.0000 0.3080 ( 2758 PWs) bands (ev): -57.7707 -57.7707 -29.1782 -29.1782 -19.4182 -19.4182 -19.3922 -19.3922 7.8534 7.8534 11.2636 11.2636 11.5385 11.5385 12.3148 12.3148 12.4302 12.4302 12.7107 12.7107 13.0749 13.0749 13.1408 13.1408 13.5166 13.5166 13.6922 13.6922 13.9880 13.9880 14.0312 14.0312 14.0944 14.0944 14.4492 14.4492 14.6180 14.6180 15.0840 15.0840 15.1503 15.1503 15.2172 15.2172 15.4549 15.4549 15.4948 15.4948 15.6222 15.6222 15.9058 15.9058 16.3728 16.3728 17.3297 17.3297 17.4827 17.4827 18.0246 18.0246 18.3412 18.3412 19.7540 19.7540 k = 0.0000 0.0000 0.3220 ( 2758 PWs) bands (ev): -57.7707 -57.7707 -29.1782 -29.1782 -19.4184 -19.4184 -19.3922 -19.3922 7.9277 7.9277 11.1808 11.1808 11.5133 11.5133 12.2931 12.2931 12.4158 12.4158 12.6906 12.6906 13.0693 13.0693 13.1589 13.1589 13.4928 13.4928 13.7173 13.7173 13.9671 13.9671 14.0576 14.0576 14.1162 14.1162 14.4660 14.4660 14.6325 14.6325 15.0789 15.0789 15.1458 15.1458 15.2121 15.2121 15.4593 15.4593 15.4774 15.4774 15.6899 15.6899 15.9044 15.9044 16.3772 16.3772 17.3313 17.3313 17.4575 17.4575 17.9952 17.9952 18.3614 18.3614 19.7068 19.7068 k = 0.0000 0.0000 0.3360 ( 2754 PWs) bands (ev): -57.7707 -57.7707 -29.1783 -29.1783 -19.4186 -19.4186 -19.3922 -19.3922 8.0045 8.0045 11.0946 11.0946 11.4893 11.4893 12.2725 12.2725 12.4025 12.4025 12.6728 12.6728 13.0626 13.0626 13.1776 13.1776 13.4689 13.4689 13.7426 13.7426 13.9455 13.9455 14.0842 14.0842 14.1357 14.1357 14.4830 14.4830 14.6467 14.6467 15.0726 15.0726 15.1416 15.1416 15.2075 15.2075 15.4377 15.4377 15.4837 15.4837 15.7537 15.7537 15.9038 15.9038 16.3866 16.3866 17.3324 17.3324 17.4337 17.4337 17.9696 17.9696 18.3838 18.3838 19.6531 19.6531 k = 0.0000 0.0000 0.3500 ( 2762 PWs) bands (ev): -57.7707 -57.7707 -29.1783 -29.1783 -19.4188 -19.4188 -19.3923 -19.3923 8.0837 8.0837 11.0054 11.0054 11.4664 11.4664 12.2531 12.2531 12.3904 12.3904 12.6572 12.6572 13.0550 13.0550 13.1970 13.1970 13.4451 13.4451 13.7680 13.7680 13.9237 13.9237 14.1109 14.1109 14.1529 14.1529 14.4997 14.4997 14.6607 14.6607 15.0651 15.0651 15.1378 15.1378 15.2035 15.2035 15.4118 15.4118 15.4938 15.4938 15.8091 15.8091 15.9042 15.9042 16.4029 16.4029 17.3322 17.3322 17.4121 17.4121 17.9485 17.9485 18.4070 18.4070 19.5933 19.5933 k = 0.0000 0.0000 0.3640 ( 2762 PWs) bands (ev): -57.7707 -57.7707 -29.1783 -29.1783 -19.4190 -19.4190 -19.3923 -19.3923 8.1651 8.1651 10.9136 10.9136 11.4448 11.4448 12.2350 12.2350 12.3793 12.3793 12.6441 12.6441 13.0466 13.0466 13.2169 13.2169 13.4218 13.4218 13.7930 13.7930 13.9021 13.9021 14.1373 14.1373 14.1679 14.1679 14.5161 14.5161 14.6742 14.6742 15.0566 15.0566 15.1345 15.1345 15.2002 15.2002 15.3856 15.3856 15.5045 15.5045 15.8532 15.8532 15.9059 15.9059 16.4280 16.4280 17.3296 17.3296 17.3942 17.3942 17.9323 17.9323 18.4306 18.4306 19.5276 19.5276 k = 0.0000 0.0000 0.3780 ( 2770 PWs) bands (ev): -57.7707 -57.7707 -29.1784 -29.1784 -19.4193 -19.4193 -19.3923 -19.3923 8.2485 8.2485 10.8196 10.8196 11.4245 11.4245 12.2181 12.2181 12.3690 12.3690 12.6331 12.6331 13.0374 13.0374 13.2372 13.2372 13.3991 13.3991 13.8159 13.8159 13.8825 13.8825 14.1621 14.1621 14.1819 14.1819 14.5319 14.5319 14.6871 14.6871 15.0472 15.0472 15.1315 15.1315 15.1975 15.1975 15.3595 15.3595 15.5158 15.5158 15.8829 15.8829 15.9103 15.9103 16.4625 16.4625 17.3230 17.3230 17.3820 17.3820 17.9212 17.9212 18.4540 18.4540 19.4567 19.4567 k = 0.0000 0.0000 0.3920 ( 2770 PWs) bands (ev): -57.7706 -57.7706 -29.1784 -29.1784 -19.4194 -19.4194 -19.3924 -19.3924 8.3338 8.3338 10.7237 10.7237 11.4056 11.4056 12.2025 12.2025 12.3596 12.3596 12.6244 12.6244 13.0277 13.0277 13.2577 13.2577 13.3776 13.3776 13.8282 13.8282 13.8732 13.8732 14.1802 14.1802 14.1997 14.1997 14.5469 14.5469 14.6994 14.6994 15.0373 15.0373 15.1288 15.1288 15.1956 15.1956 15.3338 15.3338 15.5279 15.5279 15.8970 15.8970 15.9186 15.9186 16.5056 16.5056 17.3118 17.3118 17.3761 17.3761 17.9154 17.9154 18.4768 18.4768 19.3813 19.3813 k = 0.0000 0.0000 0.4060 ( 2770 PWs) bands (ev): -57.7706 -57.7706 -29.1784 -29.1784 -19.4196 -19.4196 -19.3924 -19.3924 8.4206 8.4206 10.6264 10.6264 11.3882 11.3882 12.1882 12.1882 12.3510 12.3510 12.6176 12.6176 13.0176 13.0176 13.2783 13.2783 13.3577 13.3577 13.8176 13.8176 13.8865 13.8865 14.1894 14.1894 14.2234 14.2234 14.5607 14.5607 14.7110 14.7110 15.0273 15.0273 15.1263 15.1263 15.1941 15.1941 15.3086 15.3086 15.5406 15.5406 15.9024 15.9024 15.9252 15.9252 16.5551 16.5551 17.2979 17.2979 17.3750 17.3750 17.9149 17.9149 18.4987 18.4987 19.3020 19.3020 k = 0.0000 0.0000 0.4200 ( 2766 PWs) bands (ev): -57.7706 -57.7706 -29.1784 -29.1784 -19.4198 -19.4198 -19.3924 -19.3924 8.5087 8.5087 10.5283 10.5283 11.3723 11.3723 12.1752 12.1752 12.3433 12.3433 12.6127 12.6127 13.0072 13.0072 13.2974 13.2974 13.3408 13.3408 13.7972 13.7972 13.9095 13.9095 14.1939 14.1939 14.2486 14.2486 14.5731 14.5731 14.7218 14.7218 15.0176 15.0176 15.1239 15.1239 15.1931 15.1931 15.2844 15.2844 15.5542 15.5542 15.9053 15.9053 15.9262 15.9262 16.6081 16.6081 17.2835 17.2835 17.3768 17.3768 17.9200 17.9200 18.5194 18.5194 19.2199 19.2199 k = 0.0000 0.0000 0.4340 ( 2768 PWs) bands (ev): -57.7706 -57.7706 -29.1785 -29.1785 -19.4199 -19.4199 -19.3924 -19.3924 8.5975 8.5975 10.4300 10.4300 11.3580 11.3580 12.1635 12.1635 12.3362 12.3362 12.6095 12.6095 12.9968 12.9968 13.3067 13.3067 13.3355 13.3355 13.7746 13.7746 13.9344 13.9344 14.1952 14.1952 14.2735 14.2735 14.5838 14.5838 14.7319 14.7319 15.0085 15.0085 15.1217 15.1217 15.1924 15.1924 15.2612 15.2612 15.5684 15.5684 15.9056 15.9056 15.9236 15.9236 16.6615 16.6615 17.2701 17.2701 17.3803 17.3803 17.9308 17.9308 18.5386 18.5386 19.1358 19.1358 k = 0.0000 0.0000 0.4480 ( 2772 PWs) bands (ev): -57.7706 -57.7706 -29.1785 -29.1785 -19.4201 -19.4201 -19.3924 -19.3924 8.6865 8.6865 10.3322 10.3322 11.3453 11.3453 12.1532 12.1532 12.3300 12.3300 12.6076 12.6076 12.9866 12.9866 13.2977 13.2977 13.3502 13.3502 13.7515 13.7515 13.9596 13.9596 14.1937 14.1937 14.2976 14.2976 14.5925 14.5925 14.7412 14.7412 15.0003 15.0003 15.1195 15.1195 15.1917 15.1917 15.2395 15.2395 15.5833 15.5833 15.9004 15.9004 15.9219 15.9219 16.7125 16.7125 17.2583 17.2583 17.3848 17.3848 17.9475 17.9475 18.5560 18.5560 19.0509 19.0509 k = 0.0000 0.0000 0.4620 ( 2772 PWs) bands (ev): -57.7706 -57.7706 -29.1785 -29.1785 -19.4202 -19.4202 -19.3924 -19.3924 8.7748 8.7748 10.2360 10.2360 11.3342 11.3342 12.1442 12.1442 12.3246 12.3246 12.6068 12.6068 12.9768 12.9768 13.2851 13.2851 13.3702 13.3702 13.7286 13.7286 13.9845 13.9845 14.1895 14.1895 14.3205 14.3205 14.5990 14.5990 14.7497 14.7497 14.9933 14.9933 15.1175 15.1175 15.1906 15.1906 15.2202 15.2202 15.5985 15.5985 15.8894 15.8894 15.9231 15.9231 16.7590 16.7590 17.2485 17.2485 17.3901 17.3901 17.9700 17.9700 18.5714 18.5714 18.9666 18.9666 k = 0.0000 0.0000 0.4760 ( 2776 PWs) bands (ev): -57.7706 -57.7706 -29.1785 -29.1785 -19.4203 -19.4203 -19.3924 -19.3924 8.8611 8.8611 10.1428 10.1428 11.3247 11.3247 12.1366 12.1366 12.3200 12.3200 12.6069 12.6069 12.9679 12.9679 13.2736 13.2736 13.3906 13.3906 13.7063 13.7063 14.0089 14.0089 14.1829 14.1829 14.3415 14.3415 14.6033 14.6033 14.7575 14.7575 14.9876 14.9876 15.1155 15.1155 15.1873 15.1873 15.2051 15.2051 15.6139 15.6139 15.8754 15.8754 15.9253 15.9253 16.7993 16.7993 17.2408 17.2408 17.3957 17.3957 17.9980 17.9980 18.5844 18.5844 18.8845 18.8845 k = 0.0000 0.0000 0.4900 ( 2780 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4204 -19.4204 -19.3924 -19.3924 8.9434 8.9434 10.0546 10.0546 11.3170 11.3170 12.1304 12.1304 12.3162 12.3162 12.6074 12.6074 12.9599 12.9599 13.2639 13.2639 13.4103 13.4103 13.6852 13.6852 14.0325 14.0325 14.1739 14.1739 14.3603 14.3603 14.6055 14.6055 14.7643 14.7643 14.9833 14.9833 15.1136 15.1136 15.1783 15.1783 15.1983 15.1983 15.6290 15.6290 15.8604 15.8604 15.9277 15.9277 16.8323 16.8323 17.2353 17.2353 17.4012 17.4012 18.0305 18.0305 18.5946 18.5946 18.8072 18.8072 k = 0.0000 0.0000 0.5040 ( 2776 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4205 -19.4205 -19.3924 -19.3924 9.0187 9.0187 9.9748 9.9748 11.3109 11.3109 12.1255 12.1255 12.3133 12.3133 12.6082 12.6082 12.9533 12.9533 13.2562 13.2562 13.4283 13.4283 13.6661 13.6661 14.0552 14.0552 14.1626 14.1626 14.3761 14.3761 14.6061 14.6061 14.7700 14.7700 14.9804 14.9804 15.1119 15.1119 15.1672 15.1672 15.1966 15.1966 15.6430 15.6430 15.8458 15.8458 15.9298 15.9298 16.8577 16.8577 17.2316 17.2316 17.4063 17.4063 18.0654 18.0654 18.6009 18.6009 18.7385 18.7385 k = 0.0000 0.0000 0.5180 ( 2778 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4205 -19.4205 -19.3924 -19.3924 9.0817 9.0817 9.9084 9.9084 11.3066 11.3066 12.1221 12.1221 12.3111 12.3111 12.6090 12.6090 12.9484 12.9484 13.2506 13.2506 13.4434 13.4434 13.6503 13.6503 14.0766 14.0766 14.1493 14.1493 14.3882 14.3882 14.6057 14.6057 14.7743 14.7743 14.9785 14.9785 15.1104 15.1104 15.1583 15.1583 15.1960 15.1960 15.6549 15.6549 15.8333 15.8333 15.9315 15.9315 16.8753 16.8753 17.2293 17.2293 17.4103 17.4103 18.0985 18.0985 18.6008 18.6008 18.6855 18.6855 k = 0.0000 0.0000 0.5320 ( 2774 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4206 -19.4206 -19.3924 -19.3924 9.1252 9.1252 9.8629 9.8629 11.3040 11.3040 12.1200 12.1200 12.3099 12.3099 12.6096 12.6096 12.9454 12.9454 13.2473 13.2473 13.4537 13.4537 13.6396 13.6396 14.0966 14.0966 14.1342 14.1342 14.3959 14.3959 14.6051 14.6051 14.7770 14.7770 14.9776 14.9776 15.1093 15.1093 15.1528 15.1528 15.1959 15.1959 15.6631 15.6631 15.8245 15.8245 15.9325 15.9325 16.8857 16.8857 17.2282 17.2282 17.4130 17.4130 18.1235 18.1235 18.5922 18.5922 18.6570 18.6570 k = 0.0000 0.0000 0.5459 ( 2778 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4206 -19.4206 -19.3924 -19.3924 9.1409 9.1409 9.8464 9.8464 11.3031 11.3031 12.1193 12.1193 12.3094 12.3094 12.6098 12.6098 12.9443 12.9443 13.2462 13.2462 13.4574 13.4574 13.6357 13.6357 14.1108 14.1108 14.1216 14.1216 14.3985 14.3985 14.6048 14.6048 14.7780 14.7780 14.9773 14.9773 15.1089 15.1089 15.1509 15.1509 15.1958 15.1958 15.6661 15.6661 15.8214 15.8214 15.9328 15.9328 16.8891 16.8891 17.2278 17.2278 17.4139 17.4139 18.1331 18.1331 18.5856 18.5856 18.6500 18.6500 k = 0.0000 0.0000 0.5459 ( 2778 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4206 -19.4206 -19.3924 -19.3924 9.1409 9.1409 9.8464 9.8464 11.3031 11.3031 12.1193 12.1193 12.3094 12.3094 12.6098 12.6098 12.9443 12.9443 13.2462 13.2462 13.4574 13.4574 13.6357 13.6357 14.1108 14.1108 14.1216 14.1216 14.3985 14.3985 14.6048 14.6048 14.7780 14.7780 14.9773 14.9773 15.1089 15.1089 15.1509 15.1509 15.1958 15.1958 15.6661 15.6661 15.8214 15.8214 15.9328 15.9328 16.8891 16.8891 17.2278 17.2278 17.4139 17.4139 18.1331 18.1331 18.5856 18.5856 18.6500 18.6500 k =-0.0128 0.0056 0.5459 ( 2772 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4206 -19.4206 -19.3924 -19.3924 9.1426 9.1426 9.8473 9.8473 11.3033 11.3033 12.1198 12.1198 12.3069 12.3069 12.6079 12.6079 12.9470 12.9470 13.2458 13.2458 13.4549 13.4549 13.6368 13.6368 14.0631 14.0631 14.1712 14.1712 14.3986 14.3986 14.6052 14.6052 14.7780 14.7780 14.9761 14.9761 15.1098 15.1098 15.1518 15.1518 15.1967 15.1967 15.6652 15.6652 15.8223 15.8223 15.9327 15.9327 16.8875 16.8875 17.2272 17.2272 17.4124 17.4124 18.1295 18.1295 18.5852 18.5852 18.6523 18.6523 k =-0.0256 0.0112 0.5459 ( 2776 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4206 -19.4206 -19.3924 -19.3924 9.1476 9.1476 9.8499 9.8499 11.3039 11.3039 12.1213 12.1213 12.2993 12.2993 12.6024 12.6024 12.9548 12.9548 13.2447 13.2447 13.4474 13.4474 13.6399 13.6399 14.0124 14.0124 14.2274 14.2274 14.3991 14.3991 14.6066 14.6066 14.7782 14.7782 14.9730 14.9730 15.1125 15.1125 15.1545 15.1545 15.1994 15.1994 15.6628 15.6628 15.8249 15.8249 15.9322 15.9322 16.8826 16.8826 17.2255 17.2255 17.4081 17.4081 18.1190 18.1190 18.5838 18.5838 18.6588 18.6588 k =-0.0385 0.0169 0.5459 ( 2772 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4206 -19.4206 -19.3924 -19.3924 9.1558 9.1558 9.8543 9.8543 11.3048 11.3048 12.1237 12.1237 12.2873 12.2873 12.5934 12.5934 12.9670 12.9670 13.2429 13.2429 13.4357 13.4357 13.6441 13.6441 13.9641 13.9641 14.2851 14.2851 14.3998 14.3998 14.6087 14.6087 14.7786 14.7786 14.9683 14.9683 15.1164 15.1164 15.1588 15.1588 15.2038 15.2038 15.6590 15.6590 15.8291 15.8291 15.9314 15.9314 16.8741 16.8741 17.2225 17.2225 17.4008 17.4008 18.1030 18.1030 18.5816 18.5816 18.6686 18.6686 k =-0.0513 0.0225 0.5459 ( 2774 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4206 -19.4206 -19.3925 -19.3925 9.1674 9.1674 9.8604 9.8604 11.3060 11.3060 12.1269 12.1269 12.2714 12.2714 12.5815 12.5815 12.9823 12.9823 13.2408 13.2408 13.4205 13.4205 13.6485 13.6485 13.9185 13.9185 14.3438 14.3438 14.4008 14.4008 14.6116 14.6116 14.7794 14.7794 14.9628 14.9628 15.1213 15.1213 15.1647 15.1647 15.2099 15.2099 15.6543 15.6543 15.8343 15.8343 15.9303 15.9303 16.8620 16.8620 17.2183 17.2183 17.3906 17.3906 18.0831 18.0831 18.5786 18.5786 18.6805 18.6805 k =-0.0641 0.0281 0.5459 ( 2778 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4207 -19.4207 -19.3925 -19.3925 9.1822 9.1822 9.8683 9.8683 11.3076 11.3076 12.1305 12.1305 12.2527 12.2527 12.5670 12.5670 12.9994 12.9994 13.2389 13.2389 13.4024 13.4024 13.6519 13.6519 13.8763 13.8763 14.3977 14.3977 14.4077 14.4077 14.6151 14.6151 14.7806 14.7806 14.9571 14.9571 15.1266 15.1266 15.1720 15.1720 15.2173 15.2173 15.6491 15.6491 15.8404 15.8404 15.9288 15.9288 16.8459 16.8459 17.2128 17.2128 17.3774 17.3774 18.0610 18.0610 18.5749 18.5749 18.6933 18.6933 k =-0.0769 0.0337 0.5459 ( 2780 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4208 -19.4208 -19.3926 -19.3926 9.2003 9.2003 9.8778 9.8778 11.3093 11.3093 12.1338 12.1338 12.2326 12.2326 12.5502 12.5502 13.0164 13.0164 13.2379 13.2379 13.3821 13.3821 13.6532 13.6532 13.8381 13.8381 14.4021 14.4021 14.4646 14.4646 14.6190 14.6190 14.7825 14.7825 14.9519 14.9519 15.1323 15.1323 15.1809 15.1809 15.2257 15.2257 15.6438 15.6438 15.8468 15.8468 15.9271 15.9271 16.8254 16.8254 17.2058 17.2058 17.3615 17.3615 18.0386 18.0386 18.5703 18.5703 18.7060 18.7060 k =-0.0897 0.0393 0.5459 ( 2776 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4208 -19.4208 -19.3926 -19.3926 9.2216 9.2216 9.8891 9.8891 11.3113 11.3113 12.1352 12.1352 12.2134 12.2134 12.5316 12.5316 13.0311 13.0311 13.2394 13.2394 13.3599 13.3599 13.6507 13.6507 13.8050 13.8050 14.4034 14.4034 14.5246 14.5246 14.6233 14.6233 14.7854 14.7854 14.9477 14.9477 15.1382 15.1382 15.1912 15.1912 15.2349 15.2349 15.6388 15.6388 15.8535 15.8535 15.9251 15.9251 16.8001 16.8001 17.1973 17.1973 17.3432 17.3432 18.0172 18.0172 18.5651 18.5651 18.7178 18.7178 k =-0.1026 0.0450 0.5459 ( 2786 PWs) bands (ev): -57.7706 -57.7706 -29.1787 -29.1787 -19.4209 -19.4209 -19.3927 -19.3927 9.2460 9.2460 9.9021 9.9021 11.3133 11.3133 12.1308 12.1308 12.1995 12.1995 12.5115 12.5115 13.0410 13.0410 13.2450 13.2450 13.3362 13.3362 13.6429 13.6429 13.7784 13.7784 14.4044 14.4044 14.5834 14.5834 14.6287 14.6287 14.7896 14.7896 14.9447 14.9447 15.1444 15.1444 15.2032 15.2032 15.2443 15.2443 15.6344 15.6344 15.8599 15.8599 15.9228 15.9228 16.7696 16.7696 17.1868 17.1868 17.3232 17.3232 17.9980 17.9980 18.5593 18.5593 18.7281 18.7281 k =-0.1154 0.0506 0.5459 ( 2784 PWs) bands (ev): -57.7706 -57.7706 -29.1787 -29.1787 -19.4210 -19.4210 -19.3928 -19.3928 9.2735 9.2735 9.9167 9.9167 11.3154 11.3154 12.1169 12.1169 12.1953 12.1953 12.4900 12.4900 13.0441 13.0441 13.2558 13.2558 13.3119 13.3119 13.6290 13.6290 13.7589 13.7589 14.4051 14.4051 14.6243 14.6243 14.6504 14.6504 14.7957 14.7957 14.9436 14.9436 15.1507 15.1507 15.2168 15.2168 15.2538 15.2538 15.6310 15.6310 15.8659 15.8659 15.9202 15.9202 16.7336 16.7336 17.1741 17.1741 17.3024 17.3024 17.9818 17.9818 18.5529 18.5529 18.7365 18.7365 k =-0.1282 0.0562 0.5459 ( 2788 PWs) bands (ev): -57.7706 -57.7706 -29.1787 -29.1787 -19.4211 -19.4211 -19.3928 -19.3928 9.3041 9.3041 9.9330 9.9330 11.3173 11.3173 12.0952 12.0952 12.1993 12.1993 12.4675 12.4675 13.0394 13.0394 13.2680 13.2680 13.2913 13.2913 13.6096 13.6096 13.7455 13.7455 14.4053 14.4053 14.6313 14.6313 14.7027 14.7027 14.8051 14.8051 14.9443 14.9443 15.1573 15.1573 15.2323 15.2323 15.2632 15.2632 15.6287 15.6287 15.8711 15.8711 15.9175 15.9175 16.6922 16.6922 17.1587 17.1587 17.2820 17.2820 17.9688 17.9688 18.5459 18.5459 18.7428 18.7428 k =-0.1410 0.0618 0.5459 ( 2788 PWs) bands (ev): -57.7706 -57.7706 -29.1787 -29.1787 -19.4212 -19.4212 -19.3929 -19.3929 9.3377 9.3377 9.9509 9.9509 11.3191 11.3191 12.0698 12.0698 12.2079 12.2079 12.4442 12.4442 13.0274 13.0274 13.2533 13.2533 13.3024 13.3024 13.5869 13.5869 13.7358 13.7358 14.4049 14.4049 14.6348 14.6348 14.7506 14.7506 14.8218 14.8218 14.9473 14.9473 15.1641 15.1641 15.2496 15.2496 15.2725 15.2725 15.6275 15.6275 15.8752 15.8752 15.9146 15.9146 16.6454 16.6454 17.1400 17.1400 17.2632 17.2632 17.9592 17.9592 18.5386 18.5386 18.7468 18.7468 k =-0.1538 0.0675 0.5459 ( 2788 PWs) bands (ev): -57.7706 -57.7706 -29.1788 -29.1788 -19.4213 -19.4213 -19.3930 -19.3930 9.3742 9.3742 9.9704 9.9704 11.3205 11.3205 12.0429 12.0429 12.2193 12.2193 12.4203 12.4203 13.0091 13.0091 13.2269 13.2269 13.3288 13.3288 13.5628 13.5628 13.7277 13.7277 14.4035 14.4035 14.6374 14.6374 14.7834 14.7834 14.8530 14.8530 14.9526 14.9526 15.1711 15.1711 15.2681 15.2681 15.2827 15.2827 15.6276 15.6276 15.8778 15.8778 15.9116 15.9116 16.5938 16.5938 17.1179 17.1179 17.2470 17.2470 17.9529 17.9529 18.5308 18.5308 18.7486 18.7486 k =-0.1667 0.0731 0.5459 ( 2792 PWs) bands (ev): -57.7706 -57.7706 -29.1788 -29.1788 -19.4214 -19.4214 -19.3931 -19.3931 9.4134 9.4134 9.9915 9.9915 11.3216 11.3216 12.0156 12.0156 12.2324 12.2324 12.3962 12.3962 12.9856 12.9856 13.1991 13.1991 13.3591 13.3591 13.5386 13.5386 13.7199 13.7199 14.4010 14.4010 14.6395 14.6395 14.8026 14.8026 14.8956 14.8956 14.9608 14.9608 15.1784 15.1784 15.2835 15.2835 15.2988 15.2988 15.6285 15.6285 15.8783 15.8783 15.9085 15.9085 16.5385 16.5385 17.0924 17.0924 17.2339 17.2339 17.9497 17.9497 18.5228 18.5228 18.7483 18.7483 k =-0.1795 0.0787 0.5459 ( 2792 PWs) bands (ev): -57.7706 -57.7706 -29.1788 -29.1788 -19.4215 -19.4215 -19.3932 -19.3932 9.4554 9.4554 10.0142 10.0142 11.3221 11.3221 11.9886 11.9886 12.2469 12.2469 12.3719 12.3719 12.9578 12.9578 13.1709 13.1709 13.3915 13.3915 13.5151 13.5151 13.7113 13.7113 14.3972 14.3972 14.6412 14.6412 14.8173 14.8173 14.9371 14.9371 14.9744 14.9744 15.1858 15.1858 15.2937 15.2937 15.3232 15.3232 15.6302 15.6302 15.8763 15.8763 15.9054 15.9054 16.4809 16.4809 17.0639 17.0639 17.2241 17.2241 17.9491 17.9491 18.5145 18.5145 18.7458 18.7458 k =-0.1923 0.0843 0.5459 ( 2794 PWs) bands (ev): -57.7706 -57.7706 -29.1788 -29.1788 -19.4217 -19.4217 -19.3932 -19.3932 9.5000 9.5000 10.0383 10.0383 11.3220 11.3220 11.9624 11.9624 12.2623 12.2623 12.3480 12.3480 12.9264 12.9264 13.1427 13.1427 13.4246 13.4246 13.4935 13.4935 13.7017 13.7017 14.3919 14.3919 14.6426 14.6426 14.8313 14.8313 14.9643 14.9643 15.0015 15.0015 15.1933 15.1933 15.3027 15.3027 15.3525 15.3525 15.6319 15.6319 15.8710 15.8710 15.9021 15.9021 16.4228 16.4228 17.0327 17.0327 17.2177 17.2177 17.9509 17.9509 18.5061 18.5061 18.7414 18.7414 k =-0.2051 0.0899 0.5459 ( 2794 PWs) bands (ev): -57.7706 -57.7706 -29.1789 -29.1789 -19.4218 -19.4218 -19.3933 -19.3933 9.5471 9.5471 10.0638 10.0638 11.3212 11.3212 11.9371 11.9371 12.2774 12.2774 12.3256 12.3256 12.8918 12.8918 13.1147 13.1147 13.4508 13.4508 13.4805 13.4805 13.6907 13.6907 14.3850 14.3850 14.6437 14.6437 14.8458 14.8458 14.9799 14.9799 15.0375 15.0375 15.2009 15.2009 15.3120 15.3120 15.3856 15.3856 15.6328 15.6328 15.8621 15.8621 15.8984 15.8984 16.3667 16.3667 16.9992 16.9992 17.2145 17.2145 17.9546 17.9546 18.4975 18.4975 18.7351 18.7351 k =-0.2179 0.0956 0.5459 ( 2802 PWs) bands (ev): -57.7706 -57.7706 -29.1789 -29.1789 -19.4220 -19.4220 -19.3934 -19.3934 9.5964 9.5964 10.0907 10.0907 11.3196 11.3196 11.9130 11.9130 12.2841 12.2841 12.3129 12.3129 12.8545 12.8545 13.0870 13.0870 13.4430 13.4430 13.5033 13.5033 13.6783 13.6783 14.3765 14.3765 14.6446 14.6446 14.8612 14.8612 14.9932 14.9932 15.0722 15.0722 15.2086 15.2086 15.3220 15.3220 15.4219 15.4219 15.6316 15.6316 15.8489 15.8489 15.8942 15.8942 16.3151 16.3151 16.9639 16.9639 17.2148 17.2148 17.9599 17.9599 18.4889 18.4889 18.7272 18.7272 k =-0.2308 0.1012 0.5459 ( 2800 PWs) bands (ev): -57.7706 -57.7706 -29.1789 -29.1789 -19.4221 -19.4221 -19.3935 -19.3935 9.6480 9.6480 10.1190 10.1190 11.3173 11.3173 11.8901 11.8901 12.2685 12.2685 12.3238 12.3238 12.8149 12.8149 13.0599 13.0599 13.4246 13.4246 13.5379 13.5379 13.6647 13.6647 14.3665 14.3665 14.6450 14.6450 14.8778 14.8778 15.0064 15.0064 15.1031 15.1031 15.2160 15.2160 15.3329 15.3329 15.4604 15.4604 15.6264 15.6264 15.8318 15.8318 15.8897 15.8897 16.2706 16.2706 16.9269 16.9269 17.2188 17.2188 17.9664 17.9664 18.4804 18.4804 18.7178 18.7178 k =-0.2436 0.1068 0.5459 ( 2792 PWs) bands (ev): -57.7705 -57.7705 -29.1790 -29.1790 -19.4222 -19.4222 -19.3936 -19.3936 9.7015 9.7015 10.1484 10.1484 11.3143 11.3143 11.8686 11.8686 12.2466 12.2466 12.3424 12.3424 12.7733 12.7733 13.0336 13.0336 13.4060 13.4060 13.5732 13.5732 13.6503 13.6503 14.3550 14.3550 14.6448 14.6448 14.8954 14.8954 15.0197 15.0197 15.1301 15.1301 15.2229 15.2229 15.3450 15.3450 15.4993 15.4993 15.6147 15.6147 15.8128 15.8128 15.8851 15.8851 16.2351 16.2351 16.8884 16.8884 17.2270 17.2270 17.9739 17.9739 18.4718 18.4718 18.7072 18.7072 k =-0.2564 0.1124 0.5459 ( 2796 PWs) bands (ev): -57.7705 -57.7705 -29.1790 -29.1790 -19.4224 -19.4224 -19.3937 -19.3937 9.7568 9.7568 10.1790 10.1790 11.3106 11.3106 11.8484 11.8484 12.2240 12.2240 12.3629 12.3629 12.7300 12.7300 13.0080 13.0080 13.3880 13.3880 13.6043 13.6043 13.6391 13.6391 14.3423 14.3423 14.6437 14.6437 14.9141 14.9141 15.0333 15.0333 15.1536 15.1536 15.2285 15.2285 15.3582 15.3582 15.5345 15.5345 15.5967 15.5967 15.7956 15.7956 15.8804 15.8804 16.2089 16.2089 16.8487 16.8487 17.2397 17.2397 17.9821 17.9821 18.4633 18.4633 18.6953 18.6953 k =-0.2692 0.1180 0.5459 ( 2796 PWs) bands (ev): -57.7705 -57.7705 -29.1790 -29.1790 -19.4225 -19.4225 -19.3937 -19.3937 9.8136 9.8136 10.2106 10.2106 11.3065 11.3065 11.8293 11.8293 12.2016 12.2016 12.3845 12.3845 12.6854 12.6854 12.9833 12.9833 13.3707 13.3707 13.6064 13.6064 13.6558 13.6558 14.3286 14.3286 14.6414 14.6414 14.9337 14.9337 15.0472 15.0472 15.1740 15.1740 15.2314 15.2314 15.3724 15.3724 15.5405 15.5405 15.5964 15.5964 15.7832 15.7832 15.8758 15.8758 16.1914 16.1914 16.8079 16.8079 17.2574 17.2574 17.9907 17.9907 18.4548 18.4548 18.6825 18.6825 k =-0.2821 0.1237 0.5459 ( 2798 PWs) bands (ev): -57.7705 -57.7705 -29.1790 -29.1790 -19.4227 -19.4227 -19.3938 -19.3938 9.8717 9.8717 10.2431 10.2431 11.3021 11.3021 11.8112 11.8112 12.1795 12.1795 12.4070 12.4070 12.6398 12.6398 12.9597 12.9597 13.3541 13.3541 13.5899 13.5899 13.6900 13.6900 14.3141 14.3141 14.6375 14.6375 14.9543 14.9543 15.0613 15.0613 15.1914 15.1914 15.2294 15.2294 15.3869 15.3869 15.5084 15.5084 15.6261 15.6261 15.7763 15.7763 15.8714 15.8714 16.1808 16.1808 16.7664 16.7664 17.2806 17.2806 17.9995 17.9995 18.4463 18.4463 18.6689 18.6689 k =-0.2949 0.1293 0.5459 ( 2802 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4229 -19.4229 -19.3939 -19.3939 9.9307 9.9307 10.2764 10.2764 11.2978 11.2978 11.7939 11.7939 12.1578 12.1578 12.4301 12.4301 12.5936 12.5936 12.9372 12.9372 13.3381 13.3381 13.5704 13.5704 13.7262 13.7262 14.2992 14.2992 14.6319 14.6319 14.9756 14.9756 15.0755 15.0755 15.2022 15.2022 15.2229 15.2229 15.3996 15.3996 15.4746 15.4746 15.6582 15.6582 15.7733 15.7733 15.8671 15.8671 16.1758 16.1758 16.7243 16.7243 17.3096 17.3096 18.0083 18.0083 18.4378 18.4378 18.6547 18.6547 k =-0.3077 0.1349 0.5459 ( 2804 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4230 -19.4230 -19.3940 -19.3940 9.9903 9.9903 10.3102 10.3102 11.2939 11.2939 11.7771 11.7771 12.1364 12.1364 12.4536 12.4536 12.5474 12.5474 12.9159 12.9159 13.3227 13.3227 13.5497 13.5497 13.7625 13.7625 14.2840 14.2840 14.6244 14.6244 14.9976 14.9976 15.0881 15.0881 15.1863 15.1863 15.2292 15.2292 15.4041 15.4041 15.4579 15.4579 15.6871 15.6871 15.7728 15.7728 15.8632 15.8632 16.1747 16.1747 16.6821 16.6821 17.3447 17.3447 18.0170 18.0170 18.4291 18.4291 18.6401 18.6401 k =-0.3205 0.1405 0.5459 ( 2800 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4232 -19.4232 -19.3940 -19.3940 10.0502 10.0502 10.3445 10.3445 11.2908 11.2908 11.7606 11.7606 12.1152 12.1152 12.4754 12.4754 12.5036 12.5036 12.8958 12.8958 13.3079 13.3079 13.5284 13.5284 13.7988 13.7988 14.2689 14.2689 14.6149 14.6149 15.0200 15.0200 15.0904 15.0904 15.1575 15.1575 15.2422 15.2422 15.3989 15.3989 15.4642 15.4642 15.7112 15.7112 15.7737 15.7737 15.8597 15.8597 16.1767 16.1767 16.6400 16.6400 17.3861 17.3861 18.0254 18.0254 18.4204 18.4204 18.6255 18.6255 k =-0.3333 0.1462 0.5459 ( 2788 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4233 -19.4233 -19.3941 -19.3941 10.1098 10.1098 10.3788 10.3788 11.2889 11.2889 11.7442 11.7442 12.0939 12.0939 12.4526 12.4526 12.5055 12.5055 12.8769 12.8769 13.2934 13.2934 13.5067 13.5067 13.8347 13.8347 14.2542 14.2542 14.6033 14.6033 15.0425 15.0425 15.0581 15.0581 15.1511 15.1511 15.2556 15.2556 15.3949 15.3949 15.4804 15.4804 15.7296 15.7296 15.7757 15.7757 15.8566 15.8566 16.1809 16.1809 16.5984 16.5984 17.4337 17.4337 18.0334 18.0334 18.4115 18.4115 18.6111 18.6111 k =-0.3462 0.1518 0.5459 ( 2796 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4234 -19.4234 -19.3941 -19.3941 10.1687 10.1687 10.4131 10.4131 11.2888 11.2888 11.7277 11.7277 12.0721 12.0721 12.4091 12.4091 12.5296 12.5296 12.8594 12.8594 13.2792 13.2792 13.4850 13.4850 13.8703 13.8703 14.2402 14.2402 14.5896 14.5896 14.9991 14.9991 15.0662 15.0662 15.1641 15.1641 15.2687 15.2687 15.3950 15.3950 15.4994 15.4994 15.7413 15.7413 15.7789 15.7789 15.8541 15.8541 16.1866 16.1866 16.5578 16.5578 17.4873 17.4873 18.0409 18.0409 18.4024 18.4024 18.5972 18.5972 k =-0.3590 0.1574 0.5459 ( 2792 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4236 -19.4236 -19.3942 -19.3942 10.2263 10.2263 10.4469 10.4469 11.2908 11.2908 11.7109 11.7109 12.0494 12.0494 12.3668 12.3668 12.5546 12.5546 12.8432 12.8432 13.2652 13.2652 13.4636 13.4636 13.9053 13.9053 14.2271 14.2271 14.5740 14.5740 14.9336 14.9336 15.0891 15.0891 15.1821 15.1821 15.2817 15.2817 15.3977 15.3977 15.5193 15.5193 15.7464 15.7464 15.7829 15.7829 15.8520 15.8520 16.1934 16.1934 16.5184 16.5184 17.5465 17.5465 18.0478 18.0478 18.3934 18.3934 18.5842 18.5842 k =-0.3718 0.1630 0.5459 ( 2792 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4237 -19.4237 -19.3942 -19.3942 10.2820 10.2820 10.4800 10.4800 11.2955 11.2955 11.6939 11.6939 12.0251 12.0251 12.3271 12.3271 12.5796 12.5796 12.8285 12.8285 13.2512 13.2512 13.4429 13.4429 13.9396 13.9396 14.2151 14.2151 14.5565 14.5565 14.8668 14.8668 15.1117 15.1117 15.2018 15.2018 15.2948 15.2948 15.4020 15.4020 15.5390 15.5390 15.7464 15.7464 15.7865 15.7865 15.8502 15.8502 16.2010 16.2010 16.4809 16.4809 17.6105 17.6105 18.0541 18.0541 18.3846 18.3846 18.5722 18.5722 k =-0.3846 0.1686 0.5459 ( 2794 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4238 -19.4238 -19.3942 -19.3942 10.3350 10.3350 10.5119 10.5119 11.3033 11.3033 11.6768 11.6768 11.9986 11.9986 12.2908 12.2908 12.6044 12.6044 12.8151 12.8151 13.2371 13.2371 13.4233 13.4233 13.9732 13.9732 14.2046 14.2046 14.5373 14.5373 14.8015 14.8015 15.1336 15.1336 15.2219 15.2219 15.3081 15.3081 15.4069 15.4069 15.5581 15.5581 15.7429 15.7429 15.7886 15.7886 15.8484 15.8484 16.2089 16.2089 16.4455 16.4455 17.6784 17.6784 18.0598 18.0598 18.3769 18.3769 18.5616 18.5616 k =-0.3974 0.1743 0.5459 ( 2788 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4239 -19.4239 -19.3943 -19.3943 10.3848 10.3848 10.5423 10.5423 11.3144 11.3144 11.6597 11.6597 11.9694 11.9694 12.2587 12.2587 12.6286 12.6286 12.8033 12.8033 13.2229 13.2229 13.4050 13.4050 14.0059 14.0059 14.1957 14.1957 14.5163 14.5163 14.7397 14.7397 15.1545 15.1545 15.2418 15.2418 15.3220 15.3220 15.4122 15.4122 15.5760 15.5760 15.7368 15.7368 15.7891 15.7891 15.8464 15.8464 16.2167 16.2167 16.4129 16.4129 17.7487 17.7487 18.0648 18.0648 18.3710 18.3710 18.5524 18.5524 k =-0.4103 0.1799 0.5459 ( 2788 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4240 -19.4240 -19.3943 -19.3943 10.4304 10.4304 10.5707 10.5707 11.3291 11.3291 11.6432 11.6432 11.9371 11.9371 12.2313 12.2313 12.6519 12.6519 12.7931 12.7931 13.2085 13.2085 13.3885 13.3885 14.0375 14.0375 14.1887 14.1887 14.4938 14.4938 14.6825 14.6825 15.1739 15.1739 15.2607 15.2607 15.3366 15.3366 15.4175 15.4175 15.5923 15.5923 15.7286 15.7286 15.7883 15.7883 15.8439 15.8439 16.2242 16.2242 16.3836 16.3836 17.8194 17.8194 18.0692 18.0692 18.3686 18.3686 18.5447 18.5447 k =-0.4231 0.1855 0.5459 ( 2786 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4241 -19.4241 -19.3943 -19.3943 10.4712 10.4712 10.5969 10.5969 11.3470 11.3470 11.6280 11.6280 11.9019 11.9019 12.2086 12.2086 12.6737 12.6737 12.7847 12.7847 13.1942 13.1942 13.3740 13.3740 14.0677 14.0677 14.1837 14.1837 14.4700 14.4700 14.6312 14.6312 15.1912 15.1912 15.2780 15.2780 15.3522 15.3522 15.4228 15.4228 15.6065 15.6065 15.7188 15.7188 15.7866 15.7866 15.8410 15.8410 16.2307 16.2307 16.3580 16.3580 17.8879 17.8879 18.0729 18.0729 18.3719 18.3719 18.5383 18.5383 k =-0.4359 0.1911 0.5459 ( 2782 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4242 -19.4242 -19.3943 -19.3943 10.5063 10.5063 10.6205 10.6205 11.3677 11.3677 11.6151 11.6151 11.8643 11.8643 12.1904 12.1904 12.6933 12.6933 12.7781 12.7781 13.1802 13.1802 13.3617 13.3617 14.0959 14.0959 14.1809 14.1809 14.4454 14.4454 14.5865 14.5865 15.2062 15.2062 15.2933 15.2933 15.3682 15.3682 15.4282 15.4282 15.6180 15.6180 15.7083 15.7083 15.7843 15.7843 15.8380 15.8380 16.2359 16.2359 16.3368 16.3368 17.9503 17.9503 18.0759 18.0759 18.3835 18.3835 18.5334 18.5334 k =-0.4487 0.1967 0.5459 ( 2782 PWs) bands (ev): -57.7705 -57.7705 -29.1793 -29.1793 -19.4242 -19.4242 -19.3944 -19.3944 10.5353 10.5353 10.6411 10.6411 11.3896 11.3896 11.6058 11.6058 11.8254 11.8254 12.1764 12.1764 12.7098 12.7098 12.7739 12.7739 13.1671 13.1671 13.3517 13.3517 14.1216 14.1216 14.1802 14.1802 14.4209 14.4209 14.5491 14.5491 15.2186 15.2186 15.3062 15.3062 15.3838 15.3838 15.4338 15.4338 15.6263 15.6263 15.6980 15.6980 15.7819 15.7819 15.8350 15.8350 16.2391 16.2391 16.3206 16.3206 18.0026 18.0026 18.0784 18.0784 18.4062 18.4062 18.5298 18.5298 k =-0.4615 0.2024 0.5459 ( 2784 PWs) bands (ev): -57.7704 -57.7704 -29.1793 -29.1793 -19.4243 -19.4243 -19.3944 -19.3944 10.5578 10.5578 10.6582 10.6582 11.4108 11.4108 11.6018 11.6018 11.7866 11.7866 12.1661 12.1661 12.7222 12.7222 12.7723 12.7723 13.1556 13.1556 13.3439 13.3439 14.1432 14.1432 14.1819 14.1819 14.3979 14.3979 14.5193 14.5193 15.2282 15.2282 15.3166 15.3166 15.3973 15.3973 15.4400 15.4400 15.6305 15.6305 15.6896 15.6896 15.7796 15.7796 15.8324 15.8324 16.2401 16.2401 16.3094 16.3094 18.0415 18.0415 18.0802 18.0802 18.4399 18.4399 18.5276 18.5276 k =-0.4744 0.2080 0.5459 ( 2772 PWs) bands (ev): -57.7704 -57.7704 -29.1792 -29.1792 -19.4243 -19.4243 -19.3944 -19.3944 10.5736 10.5736 10.6711 10.6711 11.4283 11.4283 11.6046 11.6046 11.7502 11.7502 12.1591 12.1591 12.7296 12.7296 12.7733 12.7733 13.1466 13.1466 13.3385 13.3385 14.1587 14.1587 14.1863 14.1863 14.3786 14.3786 14.4974 14.4974 15.2350 15.2350 15.3241 15.3241 15.4072 15.4072 15.4465 15.4465 15.6307 15.6307 15.6844 15.6844 15.7778 15.7778 15.8304 15.8304 16.2395 16.2395 16.3029 16.3029 18.0666 18.0666 18.0817 18.0817 18.4786 18.4786 18.5280 18.5280 k =-0.4872 0.2136 0.5459 ( 2764 PWs) bands (ev): -57.7704 -57.7704 -29.1792 -29.1792 -19.4243 -19.4243 -19.3943 -19.3943 10.5830 10.5830 10.6792 10.6792 11.4396 11.4396 11.6128 11.6128 11.7208 11.7208 12.1550 12.1550 12.7331 12.7331 12.7753 12.7753 13.1407 13.1407 13.3352 13.3352 14.1667 14.1667 14.1920 14.1920 14.3654 14.3654 14.4839 14.4839 15.2391 15.2391 15.3288 15.3288 15.4129 15.4129 15.4520 15.4520 15.6288 15.6288 15.6821 15.6821 15.7765 15.7765 15.8291 15.8291 16.2384 16.2384 16.2998 16.2998 18.0792 18.0792 18.0833 18.0833 18.5055 18.5055 18.5358 18.5358 k =-0.5000 0.2192 0.5459 ( 2752 PWs) bands (ev): -57.7704 -57.7704 -29.1792 -29.1792 -19.4243 -19.4243 -19.3943 -19.3943 10.5861 10.5861 10.6820 10.6820 11.4434 11.4434 11.6182 11.6182 11.7082 11.7082 12.1536 12.1536 12.7341 12.7341 12.7763 12.7763 13.1387 13.1387 13.3341 13.3341 14.1690 14.1690 14.1948 14.1948 14.3606 14.3606 14.4793 14.4793 15.2404 15.2404 15.3304 15.3304 15.4147 15.4147 15.4542 15.4542 15.6277 15.6277 15.6815 15.6815 15.7761 15.7761 15.8287 15.8287 16.2379 16.2379 16.2989 16.2989 18.0814 18.0814 18.0857 18.0857 18.5114 18.5114 18.5443 18.5443 k =-0.5000 0.2192 0.5459 ( 2752 PWs) bands (ev): -57.7704 -57.7704 -29.1792 -29.1792 -19.4243 -19.4243 -19.3943 -19.3943 10.5861 10.5861 10.6820 10.6820 11.4434 11.4434 11.6182 11.6182 11.7082 11.7082 12.1536 12.1536 12.7341 12.7341 12.7763 12.7763 13.1387 13.1387 13.3341 13.3341 14.1690 14.1690 14.1948 14.1948 14.3606 14.3606 14.4793 14.4793 15.2404 15.2404 15.3304 15.3304 15.4147 15.4147 15.4542 15.4542 15.6277 15.6277 15.6815 15.6815 15.7761 15.7761 15.8287 15.8287 16.2379 16.2379 16.2989 16.2989 18.0814 18.0814 18.0857 18.0857 18.5114 18.5114 18.5443 18.5443 k =-0.4909 0.2152 0.5360 ( 2768 PWs) bands (ev): -57.7704 -57.7704 -29.1792 -29.1792 -19.4243 -19.4243 -19.3944 -19.3944 10.5829 10.5829 10.6794 10.6794 11.4397 11.4397 11.6125 11.6125 11.7210 11.7210 12.1550 12.1550 12.7332 12.7332 12.7753 12.7753 13.1408 13.1408 13.3352 13.3352 14.1664 14.1664 14.1924 14.1924 14.3653 14.3653 14.4839 14.4839 15.2391 15.2391 15.3288 15.3288 15.4130 15.4130 15.4519 15.4519 15.6289 15.6289 15.6820 15.6820 15.7765 15.7765 15.8292 15.8292 16.2384 16.2384 16.2998 16.2998 18.0791 18.0791 18.0834 18.0834 18.5055 18.5055 18.5357 18.5357 k =-0.4818 0.2113 0.5261 ( 2776 PWs) bands (ev): -57.7704 -57.7704 -29.1793 -29.1793 -19.4243 -19.4243 -19.3944 -19.3944 10.5714 10.5714 10.6732 10.6732 11.4299 11.4299 11.6019 11.6019 11.7515 11.7515 12.1590 12.1590 12.7305 12.7305 12.7724 12.7724 13.1467 13.1467 13.3385 13.3385 14.1561 14.1561 14.1900 14.1900 14.3772 14.3772 14.4978 14.4978 15.2349 15.2349 15.3243 15.3243 15.4078 15.4078 15.4453 15.4453 15.6323 15.6323 15.6833 15.6833 15.7777 15.7777 15.8305 15.8305 16.2394 16.2394 16.3030 16.3030 18.0662 18.0662 18.0822 18.0822 18.4781 18.4781 18.5279 18.5279 k =-0.4727 0.2073 0.5162 ( 2786 PWs) bands (ev): -57.7705 -57.7705 -29.1793 -29.1793 -19.4243 -19.4243 -19.3944 -19.3944 10.5480 10.5480 10.6677 10.6677 11.4171 11.4171 11.5926 11.5926 11.7901 11.7901 12.1657 12.1657 12.7260 12.7260 12.7679 12.7679 13.1564 13.1564 13.3438 13.3438 14.1377 14.1377 14.1920 14.1920 14.3921 14.3921 14.5209 14.5209 15.2279 15.2279 15.3172 15.3172 15.3992 15.3992 15.4354 15.4354 15.6368 15.6368 15.6854 15.6854 15.7793 15.7793 15.8327 15.8327 16.2390 16.2390 16.3103 16.3103 18.0415 18.0415 18.0814 18.0814 18.4380 18.4380 18.5274 18.5274 k =-0.4636 0.2033 0.5062 ( 2784 PWs) bands (ev): -57.7705 -57.7705 -29.1793 -29.1793 -19.4242 -19.4242 -19.3944 -19.3944 10.5102 10.5102 10.6660 10.6660 11.4047 11.4047 11.5857 11.5857 11.8321 11.8321 12.1749 12.1749 12.7199 12.7199 12.7621 12.7621 13.1694 13.1694 13.3512 13.3512 14.1155 14.1155 14.1973 14.1973 14.4076 14.4076 14.5523 14.5523 15.2178 15.2178 15.3080 15.3080 15.3877 15.3877 15.4234 15.4234 15.6417 15.6417 15.6878 15.6878 15.7810 15.7810 15.8357 15.8357 16.2357 16.2357 16.3232 16.3232 18.0042 18.0042 18.0804 18.0804 18.4013 18.4013 18.5294 18.5294 k =-0.4545 0.1993 0.4963 ( 2784 PWs) bands (ev): -57.7705 -57.7705 -29.1793 -29.1793 -19.4242 -19.4242 -19.3943 -19.3943 10.4585 10.4585 10.6686 10.6686 11.3948 11.3948 11.5807 11.5807 11.8750 11.8750 12.1865 12.1865 12.7122 12.7122 12.7555 12.7555 13.1852 13.1852 13.3605 13.3605 14.0922 14.0922 14.2048 14.2048 14.4231 14.4231 14.5902 14.5902 15.2045 15.2045 15.2972 15.2972 15.3737 15.3737 15.4100 15.4100 15.6462 15.6462 15.6904 15.6904 15.7824 15.7824 15.8392 15.8392 16.2289 16.2289 16.3418 16.3418 17.9551 17.9551 18.0790 18.0790 18.3740 18.3740 18.5329 18.5329 k =-0.4455 0.1953 0.4864 ( 2785 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4241 -19.4241 -19.3943 -19.3943 10.3950 10.3950 10.6746 10.6746 11.3888 11.3888 11.5770 11.5770 11.9172 11.9172 12.2005 12.2005 12.7032 12.7032 12.7484 12.7484 13.2035 13.2035 13.3715 13.3715 14.0691 14.0691 14.2143 14.2143 14.4390 14.4390 14.6331 14.6331 15.1882 15.1882 15.2848 15.2848 15.3580 15.3580 15.3959 15.3959 15.6496 15.6496 15.6929 15.6929 15.7831 15.7831 15.8430 15.8430 16.2189 16.2189 16.3656 16.3656 17.8971 17.8971 18.0771 18.0771 18.3565 18.3565 18.5377 18.5377 k =-0.4364 0.1913 0.4765 ( 2783 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4240 -19.4240 -19.3943 -19.3943 10.3219 10.3219 10.6834 10.6834 11.3869 11.3869 11.5744 11.5744 11.9578 11.9578 12.2166 12.2166 12.6932 12.6932 12.7411 12.7411 13.2237 13.2237 13.3840 13.3840 14.0471 14.0471 14.2255 14.2255 14.4554 14.4554 14.6795 14.6795 15.1691 15.1691 15.2707 15.2707 15.3417 15.3417 15.3814 15.3814 15.6516 15.6516 15.6950 15.6950 15.7829 15.7829 15.8467 15.8467 16.2063 16.2063 16.3937 16.3937 17.8341 17.8341 18.0746 18.0746 18.3466 18.3466 18.5438 18.5438 k =-0.4273 0.1873 0.4665 ( 2791 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4239 -19.4239 -19.3943 -19.3943 10.2410 10.2410 10.6944 10.6944 11.3890 11.3890 11.5728 11.5728 11.9962 11.9962 12.2346 12.2346 12.6824 12.6824 12.7336 12.7336 13.2456 13.2456 13.3980 13.3980 14.0264 14.0264 14.2382 14.2382 14.4726 14.4726 14.7283 14.7283 15.1477 15.1477 15.2545 15.2545 15.3255 15.3255 15.3669 15.3669 15.6521 15.6521 15.6964 15.6964 15.7814 15.7814 15.8500 15.8500 16.1915 16.1915 16.4254 16.4254 17.7698 17.7698 18.0714 18.0714 18.3419 18.3419 18.5515 18.5515 k =-0.4182 0.1834 0.4566 ( 2787 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4238 -19.4238 -19.3942 -19.3942 10.1539 10.1539 10.7074 10.7074 11.3948 11.3948 11.5723 11.5723 12.0322 12.0322 12.2544 12.2544 12.6713 12.6713 12.7261 12.7261 13.2689 13.2689 13.4132 13.4132 14.0072 14.0072 14.2523 14.2523 14.4905 14.4905 14.7788 14.7788 15.1244 15.1244 15.2362 15.2362 15.3097 15.3097 15.3527 15.3527 15.6511 15.6511 15.6970 15.6970 15.7781 15.7781 15.8526 15.8526 16.1748 16.1748 16.4600 16.4600 17.7068 17.7068 18.0674 18.0674 18.3403 18.3403 18.5607 18.5607 k =-0.4091 0.1794 0.4467 ( 2785 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4236 -19.4236 -19.3942 -19.3942 10.0618 10.0618 10.7221 10.7221 11.4038 11.4038 11.5728 11.5728 12.0656 12.0656 12.2757 12.2757 12.6599 12.6599 12.7186 12.7186 13.2932 13.2932 13.4295 13.4295 13.9897 13.9897 14.2674 14.2674 14.5090 14.5090 14.8300 14.8300 15.0997 15.0997 15.2160 15.2160 15.2945 15.2945 15.3392 15.3392 15.6486 15.6486 15.6966 15.6966 15.7726 15.7726 15.8546 15.8546 16.1565 16.1565 16.4967 16.4967 17.6471 17.6471 18.0625 18.0625 18.3403 18.3403 18.5717 18.5717 k =-0.4000 0.1754 0.4368 ( 2785 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4235 -19.4235 -19.3942 -19.3942 9.9658 9.9658 10.7386 10.7386 11.4155 11.4155 11.5747 11.5747 12.0966 12.0966 12.2983 12.2983 12.6487 12.6487 12.7114 12.7114 13.3183 13.3183 13.4467 13.4467 13.9737 13.9737 14.2836 14.2836 14.5279 14.5279 14.8809 14.8809 15.0739 15.0739 15.1944 15.1944 15.2797 15.2797 15.3265 15.3265 15.6447 15.6447 15.6947 15.6947 15.7646 15.7646 15.8561 15.8561 16.1370 16.1370 16.5351 16.5351 17.5923 17.5923 18.0567 18.0567 18.3409 18.3409 18.5845 18.5845 k =-0.3909 0.1714 0.4268 ( 2789 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4234 -19.4234 -19.3941 -19.3941 9.8669 9.8669 10.7566 10.7566 11.4295 11.4295 11.5781 11.5781 12.1252 12.1252 12.3220 12.3220 12.6377 12.6377 12.7043 12.7043 13.3440 13.3440 13.4647 13.4647 13.9594 13.9594 14.3004 14.3004 14.5471 14.5471 14.9303 14.9303 15.0475 15.0475 15.1720 15.1720 15.2655 15.2655 15.3148 15.3148 15.6396 15.6396 15.6912 15.6912 15.7538 15.7538 15.8573 15.8573 16.1167 16.1167 16.5745 16.5745 17.5432 17.5432 18.0498 18.0498 18.3413 18.3413 18.5992 18.5992 k =-0.3818 0.1674 0.4169 ( 2783 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4232 -19.4232 -19.3940 -19.3940 9.7657 9.7657 10.7761 10.7761 11.4451 11.4451 11.5834 11.5834 12.1518 12.1518 12.3467 12.3467 12.6271 12.6271 12.6976 12.6976 13.3700 13.3700 13.4834 13.4834 13.9465 13.9465 14.3177 14.3177 14.5663 14.5663 14.9758 14.9758 15.0213 15.0213 15.1497 15.1497 15.2527 15.2527 15.3039 15.3039 15.6334 15.6334 15.6852 15.6852 15.7405 15.7405 15.8585 15.8585 16.0958 16.0958 16.6145 16.6145 17.5005 17.5005 18.0419 18.0419 18.3411 18.3411 18.6156 18.6156 k =-0.3727 0.1634 0.4070 ( 2787 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4230 -19.4230 -19.3940 -19.3940 9.6630 9.6630 10.7970 10.7970 11.4619 11.4619 11.5908 11.5908 12.1765 12.1765 12.3721 12.3721 12.6171 12.6171 12.6913 12.6913 13.3960 13.3960 13.5027 13.5027 13.9349 13.9349 14.3353 14.3353 14.5852 14.5852 14.9907 14.9907 15.0187 15.0187 15.1290 15.1290 15.2426 15.2426 15.2937 15.2937 15.6261 15.6261 15.6756 15.6756 15.7262 15.7262 15.8597 15.8597 16.0749 16.0749 16.6548 16.6548 17.4646 17.4646 18.0330 18.0330 18.3399 18.3399 18.6337 18.6337 k =-0.3636 0.1594 0.3971 ( 2793 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4228 -19.4228 -19.3940 -19.3940 9.5592 9.5592 10.8194 10.8194 11.4793 11.4793 11.6010 11.6010 12.1995 12.1995 12.3982 12.3982 12.6077 12.6077 12.6855 12.6855 13.4220 13.4220 13.5227 13.5227 13.9246 13.9246 14.3529 14.3529 14.6035 14.6035 14.9650 14.9650 15.0431 15.0431 15.1135 15.1135 15.2372 15.2372 15.2845 15.2845 15.6177 15.6177 15.6610 15.6610 15.7129 15.7129 15.8611 15.8611 16.0545 16.0545 16.6949 16.6949 17.4357 17.4357 18.0230 18.0230 18.3376 18.3376 18.6533 18.6533 k =-0.3545 0.1555 0.3871 ( 2799 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4227 -19.4227 -19.3939 -19.3939 9.4549 9.4549 10.8430 10.8430 11.4967 11.4967 11.6141 11.6141 12.2212 12.2212 12.4249 12.4249 12.5991 12.5991 12.6802 12.6802 13.4474 13.4474 13.5432 13.5432 13.9152 13.9152 14.3703 14.3703 14.6209 14.6209 14.9383 14.9383 15.0462 15.0462 15.1084 15.1084 15.2370 15.2370 15.2783 15.2783 15.6077 15.6077 15.6418 15.6418 15.7018 15.7018 15.8627 15.8627 16.0355 16.0355 16.7347 16.7347 17.4136 17.4136 18.0121 18.0121 18.3343 18.3343 18.6744 18.6744 k =-0.3455 0.1515 0.3772 ( 2803 PWs) bands (ev): -57.7705 -57.7705 -29.1790 -29.1790 -19.4225 -19.4225 -19.3939 -19.3939 9.3505 9.3505 10.8679 10.8679 11.5136 11.5136 11.6307 11.6307 12.2417 12.2417 12.4521 12.4521 12.5914 12.5914 12.6754 12.6754 13.4721 13.4721 13.5644 13.5644 13.9066 13.9066 14.3873 14.3873 14.6369 14.6369 14.9121 14.9121 15.0326 15.0326 15.1073 15.1073 15.2344 15.2344 15.2818 15.2818 15.5944 15.5944 15.6216 15.6216 15.6925 15.6925 15.8644 15.8644 16.0188 16.0188 16.7740 16.7740 17.3980 17.3980 18.0003 18.0003 18.3299 18.3299 18.6969 18.6969 k =-0.3364 0.1475 0.3673 ( 2807 PWs) bands (ev): -57.7706 -57.7706 -29.1790 -29.1790 -19.4222 -19.4222 -19.3938 -19.3938 9.2463 9.2463 10.8939 10.8939 11.5299 11.5299 11.6506 11.6506 12.2614 12.2614 12.4797 12.4797 12.5848 12.5848 12.6714 12.6714 13.4956 13.4956 13.5863 13.5863 13.8986 13.8986 14.4036 14.4036 14.6511 14.6511 14.8866 14.8866 15.0134 15.0134 15.1029 15.1029 15.2220 15.2220 15.2963 15.2963 15.5752 15.5752 15.6054 15.6054 15.6840 15.6840 15.8663 15.8663 16.0055 16.0055 16.8128 16.8128 17.3885 17.3885 17.9879 17.9879 18.3245 18.3245 18.7205 18.7205 k =-0.3273 0.1435 0.3573 ( 2799 PWs) bands (ev): -57.7706 -57.7706 -29.1790 -29.1790 -19.4220 -19.4220 -19.3937 -19.3937 9.1426 9.1426 10.9211 10.9211 11.5456 11.5456 11.6738 11.6738 12.2805 12.2805 12.5073 12.5073 12.5796 12.5796 12.6680 12.6680 13.5177 13.5177 13.6090 13.6090 13.8908 13.8908 14.4190 14.4190 14.6627 14.6627 14.8625 14.8625 14.9930 14.9930 15.0955 15.0955 15.2018 15.2018 15.3132 15.3132 15.5525 15.5525 15.5935 15.5935 15.6758 15.6758 15.8685 15.8685 15.9969 15.9969 16.8509 16.8509 17.3845 17.3845 17.9750 17.9750 18.3181 18.3181 18.7454 18.7454 k =-0.3182 0.1395 0.3474 ( 2799 PWs) bands (ev): -57.7706 -57.7706 -29.1789 -29.1789 -19.4218 -19.4218 -19.3937 -19.3937 9.0397 9.0397 10.9494 10.9494 11.5609 11.5609 11.6998 11.6998 12.2992 12.2992 12.5333 12.5333 12.5775 12.5775 12.6654 12.6654 13.5380 13.5380 13.6327 13.6327 13.8830 13.8830 14.4333 14.4333 14.6709 14.6709 14.8403 14.8403 14.9728 14.9728 15.0872 15.0872 15.1747 15.1747 15.3265 15.3265 15.5303 15.5303 15.5832 15.5832 15.6671 15.6671 15.8711 15.8711 15.9941 15.9941 16.8885 16.8885 17.3855 17.3855 17.9619 17.9619 18.3110 18.3110 18.7712 18.7712 k =-0.3091 0.1355 0.3375 ( 2799 PWs) bands (ev): -57.7706 -57.7706 -29.1789 -29.1789 -19.4215 -19.4215 -19.3936 -19.3936 8.9379 8.9379 10.9787 10.9787 11.5762 11.5762 11.7282 11.7282 12.3178 12.3178 12.5516 12.5516 12.5846 12.5846 12.6636 12.6636 13.5564 13.5564 13.6572 13.6572 13.8748 13.8748 14.4463 14.4463 14.6748 14.6748 14.8207 14.8207 14.9532 14.9532 15.0794 15.0794 15.1409 15.1409 15.3342 15.3342 15.5107 15.5107 15.5734 15.5734 15.6576 15.6576 15.8744 15.8744 15.9980 15.9980 16.9256 16.9256 17.3909 17.3909 17.9489 17.9489 18.3032 18.3032 18.7982 18.7982 k =-0.3000 0.1315 0.3276 ( 2799 PWs) bands (ev): -57.7706 -57.7706 -29.1788 -29.1788 -19.4213 -19.4213 -19.3935 -19.3935 8.8374 8.8374 11.0090 11.0090 11.5917 11.5917 11.7585 11.7585 12.3365 12.3365 12.5562 12.5562 12.6066 12.6066 12.6629 12.6629 13.5727 13.5727 13.6825 13.6825 13.8661 13.8661 14.4578 14.4578 14.6734 14.6734 14.8044 14.8044 14.9347 14.9347 15.0723 15.0723 15.1012 15.1012 15.3360 15.3360 15.4938 15.4938 15.5635 15.5635 15.6466 15.6466 15.8783 15.8783 16.0089 16.0089 16.9623 16.9623 17.4000 17.4000 17.9364 17.9364 18.2947 18.2947 18.8261 18.8261 k =-0.2909 0.1276 0.3176 ( 2797 PWs) bands (ev): -57.7706 -57.7706 -29.1788 -29.1788 -19.4210 -19.4210 -19.3934 -19.3934 8.7383 8.7383 11.0401 11.0401 11.6076 11.6076 11.7904 11.7904 12.3556 12.3556 12.5561 12.5561 12.6338 12.6338 12.6638 12.6638 13.5869 13.5869 13.7083 13.7083 13.8565 13.8565 14.4676 14.4676 14.6664 14.6664 14.7916 14.7916 14.9172 14.9172 15.0513 15.0513 15.0720 15.0720 15.3327 15.3327 15.4796 15.4796 15.5533 15.5533 15.6340 15.6340 15.8826 15.8826 16.0263 16.0263 16.9986 16.9986 17.4122 17.4122 17.9248 17.9248 18.2859 18.2859 18.8550 18.8550 k =-0.2818 0.1236 0.3077 ( 2793 PWs) bands (ev): -57.7706 -57.7706 -29.1787 -29.1787 -19.4208 -19.4208 -19.3933 -19.3933 8.6410 8.6410 11.0722 11.0722 11.6239 11.6239 11.8237 11.8237 12.3753 12.3753 12.5557 12.5557 12.6553 12.6553 12.6733 12.6733 13.5991 13.5991 13.7345 13.7345 13.8457 13.8457 14.4753 14.4753 14.6543 14.6543 14.7814 14.7814 14.9005 14.9005 15.0031 15.0031 15.0682 15.0682 15.3245 15.3245 15.4682 15.4682 15.5425 15.5425 15.6199 15.6199 15.8870 15.8870 16.0491 16.0491 17.0346 17.0346 17.4270 17.4270 17.9147 17.9147 18.2766 18.2766 18.8850 18.8850 k =-0.2727 0.1196 0.2978 ( 2781 PWs) bands (ev): -57.7706 -57.7706 -29.1787 -29.1787 -19.4205 -19.4205 -19.3933 -19.3933 8.5455 8.5455 11.1050 11.1050 11.6408 11.6408 11.8581 11.8581 12.3958 12.3958 12.5559 12.5559 12.6609 12.6609 12.7002 12.7002 13.6092 13.6092 13.7608 13.7608 13.8338 13.8338 14.4809 14.4809 14.6382 14.6382 14.7723 14.7723 14.8827 14.8827 14.9536 14.9536 15.0678 15.0678 15.3114 15.3114 15.4604 15.4604 15.5311 15.5311 15.6049 15.6049 15.8914 15.8914 16.0758 16.0758 17.0702 17.0702 17.4438 17.4438 17.9068 17.9068 18.2672 18.2672 18.9160 18.9160 k =-0.2636 0.1156 0.2879 ( 2777 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4202 -19.4202 -19.3932 -19.3932 8.4520 8.4520 11.1386 11.1386 11.6583 11.6583 11.8934 11.8934 12.4171 12.4171 12.5570 12.5570 12.6639 12.6639 12.7311 12.7311 13.6173 13.6173 13.7868 13.7868 13.8207 13.8207 14.4839 14.4839 14.6196 14.6196 14.7627 14.7627 14.8557 14.8557 14.9138 14.9138 15.0691 15.0691 15.2937 15.2937 15.4565 15.4565 15.5192 15.5192 15.5893 15.5893 15.8957 15.8957 16.1046 16.1046 17.1052 17.1052 17.4621 17.4621 17.9017 17.9017 18.2578 18.2578 18.9479 18.9479 k =-0.2545 0.1116 0.2779 ( 2775 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4199 -19.4199 -19.3931 -19.3931 8.3607 8.3607 11.1729 11.1729 11.6762 11.6762 11.9296 11.9296 12.4394 12.4394 12.5592 12.5592 12.6673 12.6673 12.7629 12.7629 13.6234 13.6234 13.8021 13.8021 13.8167 13.8167 14.4843 14.4843 14.5991 14.5991 14.7509 14.7509 14.8110 14.8110 14.8945 14.8945 15.0710 15.0710 15.2720 15.2720 15.4565 15.4565 15.5065 15.5065 15.5739 15.5739 15.8997 15.8997 16.1342 16.1342 17.1392 17.1392 17.4814 17.4814 17.9004 17.9004 18.2485 18.2485 18.9809 18.9809 k =-0.2455 0.1076 0.2680 ( 2779 PWs) bands (ev): -57.7706 -57.7706 -29.1785 -29.1785 -19.4197 -19.4197 -19.3930 -19.3930 8.2716 8.2716 11.2079 11.2079 11.6944 11.6944 11.9667 11.9667 12.4626 12.4626 12.5626 12.5626 12.6714 12.6714 12.7951 12.7951 13.6274 13.6274 13.7873 13.7873 13.8409 13.8409 14.4818 14.4818 14.5768 14.5768 14.7336 14.7336 14.7609 14.7609 14.8878 14.8878 15.0725 15.0725 15.2481 15.2481 15.4599 15.4599 15.4932 15.4932 15.5594 15.5594 15.9037 15.9037 16.1634 16.1634 17.1718 17.1718 17.5011 17.5011 17.9036 17.9036 18.2397 18.2397 19.0149 19.0149 k =-0.2364 0.1036 0.2581 ( 2781 PWs) bands (ev): -57.7706 -57.7706 -29.1785 -29.1785 -19.4194 -19.4194 -19.3929 -19.3929 8.1850 8.1850 11.2435 11.2435 11.7130 11.7130 12.0045 12.0045 12.4866 12.4866 12.5673 12.5673 12.6763 12.6763 12.8275 12.8275 13.6295 13.6295 13.7693 13.7693 13.8664 13.8664 14.4762 14.4762 14.5521 14.5521 14.6947 14.6947 14.7299 14.7299 14.8870 14.8870 15.0715 15.0715 15.2242 15.2242 15.4653 15.4653 15.4796 15.4796 15.5462 15.5462 15.9075 15.9075 16.1914 16.1914 17.2024 17.2024 17.5209 17.5209 17.9121 17.9121 18.2317 18.2317 19.0500 19.0500 k =-0.2273 0.0996 0.2482 ( 2775 PWs) bands (ev): -57.7706 -57.7706 -29.1784 -29.1784 -19.4191 -19.4191 -19.3928 -19.3928 8.1008 8.1008 11.2797 11.2797 11.7317 11.7317 12.0432 12.0432 12.5110 12.5110 12.5739 12.5739 12.6820 12.6820 12.8599 12.8599 13.6296 13.6296 13.7498 13.7498 13.8916 13.8916 14.4669 14.4669 14.5232 14.5232 14.6465 14.6465 14.7102 14.7102 14.8898 14.8898 15.0656 15.0656 15.2035 15.2035 15.4624 15.4624 15.4752 15.4752 15.5355 15.5355 15.9113 15.9113 16.2176 16.2176 17.2303 17.2303 17.5403 17.5403 17.9262 17.9262 18.2253 18.2253 19.0860 19.0860 k =-0.2182 0.0957 0.2382 ( 2779 PWs) bands (ev): -57.7707 -57.7707 -29.1784 -29.1784 -19.4189 -19.4189 -19.3928 -19.3928 8.0193 8.0193 11.3165 11.3165 11.7504 11.7504 12.0826 12.0826 12.5351 12.5351 12.5828 12.5828 12.6886 12.6886 12.8924 12.8924 13.6276 13.6276 13.7291 13.7291 13.9164 13.9164 14.4515 14.4515 14.4897 14.4897 14.6051 14.6051 14.6903 14.6903 14.8946 14.8946 15.0526 15.0526 15.1890 15.1890 15.4477 15.4477 15.4814 15.4814 15.5287 15.5287 15.9150 15.9150 16.2418 16.2418 17.2548 17.2548 17.5593 17.5593 17.9456 17.9456 18.2215 18.2215 19.1231 19.1231 k =-0.2091 0.0917 0.2283 ( 2779 PWs) bands (ev): -57.7707 -57.7707 -29.1784 -29.1784 -19.4186 -19.4186 -19.3927 -19.3927 7.9404 7.9404 11.3538 11.3538 11.7691 11.7691 12.1230 12.1230 12.5570 12.5570 12.5958 12.5958 12.6961 12.6961 12.9247 12.9247 13.6235 13.6235 13.7075 13.7075 13.9405 13.9405 14.4198 14.4198 14.4612 14.4612 14.5729 14.5729 14.6690 14.6690 14.8993 14.8993 15.0332 15.0332 15.1817 15.1817 15.4322 15.4322 15.4843 15.4843 15.5290 15.5290 15.9186 15.9186 16.2637 16.2637 17.2755 17.2755 17.5779 17.5779 17.9689 17.9689 18.2221 18.2221 19.1611 19.1611 k =-0.2000 0.0877 0.2184 ( 2775 PWs) bands (ev): -57.7707 -57.7707 -29.1783 -29.1783 -19.4183 -19.4183 -19.3926 -19.3926 7.8644 7.8644 11.3916 11.3916 11.7876 11.7876 12.1641 12.1641 12.5749 12.5749 12.6147 12.6147 12.7044 12.7044 12.9569 12.9569 13.6171 13.6171 13.6855 13.6855 13.9639 13.9639 14.3702 14.3702 14.4425 14.4425 14.5476 14.5476 14.6461 14.6461 14.9000 14.9000 15.0125 15.0125 15.1798 15.1798 15.4168 15.4168 15.4819 15.4819 15.5374 15.5374 15.9221 15.9221 16.2834 16.2834 17.2922 17.2922 17.5962 17.5962 17.9933 17.9933 18.2299 18.2299 19.2001 19.2001 k =-0.1909 0.0837 0.2085 ( 2767 PWs) bands (ev): -57.7707 -57.7707 -29.1783 -29.1783 -19.4181 -19.4181 -19.3925 -19.3925 7.7913 7.7913 11.4298 11.4298 11.8060 11.8060 12.2062 12.2062 12.5892 12.5892 12.6386 12.6386 12.7137 12.7137 12.9887 12.9887 13.6082 13.6082 13.6639 13.6639 13.9865 13.9865 14.3135 14.3135 14.4265 14.4265 14.5261 14.5261 14.6218 14.6218 14.8900 14.8900 14.9992 14.9992 15.1809 15.1809 15.4018 15.4018 15.4764 15.4764 15.5512 15.5512 15.9256 15.9256 16.3008 16.3008 17.3048 17.3048 17.6146 17.6146 18.0145 18.0145 18.2486 18.2486 19.2400 19.2400 k =-0.1818 0.0797 0.1985 ( 2767 PWs) bands (ev): -57.7707 -57.7707 -29.1782 -29.1782 -19.4178 -19.4178 -19.3924 -19.3924 7.7210 7.7210 11.4683 11.4683 11.8240 11.8240 12.2491 12.2491 12.6021 12.6021 12.6651 12.6651 12.7239 12.7239 13.0201 13.0201 13.5962 13.5962 13.6434 13.6434 14.0081 14.0081 14.2544 14.2544 14.4110 14.4110 14.5062 14.5062 14.5961 14.5961 14.8656 14.8656 14.9985 14.9985 15.1834 15.1834 15.3877 15.3877 15.4700 15.4700 15.5678 15.5678 15.9291 15.9291 16.3161 16.3161 17.3137 17.3137 17.6330 17.6330 18.0289 18.0289 18.2812 18.2812 19.2806 19.2806 k =-0.1727 0.0757 0.1886 ( 2763 PWs) bands (ev): -57.7707 -57.7707 -29.1782 -29.1782 -19.4175 -19.4175 -19.3924 -19.3924 7.6539 7.6539 11.5071 11.5071 11.8418 11.8418 12.2928 12.2928 12.6151 12.6151 12.6922 12.6922 12.7352 12.7352 13.0511 13.0511 13.5809 13.5809 13.6250 13.6250 14.0283 14.0283 14.1949 14.1949 14.3956 14.3956 14.4865 14.4865 14.5693 14.5693 14.8309 14.8309 15.0072 15.0072 15.1861 15.1861 15.3749 15.3749 15.4636 15.4636 15.5861 15.5861 15.9326 15.9326 16.3294 16.3294 17.3194 17.3194 17.6514 17.6514 18.0357 18.0357 18.3281 18.3281 19.3220 19.3220 k =-0.1636 0.0717 0.1787 ( 2759 PWs) bands (ev): -57.7707 -57.7707 -29.1781 -29.1781 -19.4173 -19.4173 -19.3923 -19.3923 7.5898 7.5898 11.5461 11.5461 11.8592 11.8592 12.3371 12.3371 12.6286 12.6286 12.7186 12.7186 12.7480 12.7480 13.0816 13.0816 13.5626 13.5626 13.6085 13.6085 14.0461 14.0461 14.1371 14.1371 14.3804 14.3804 14.4660 14.4660 14.5414 14.5414 14.7911 14.7911 15.0208 15.0208 15.1884 15.1884 15.3634 15.3634 15.4574 15.4574 15.6056 15.6056 15.9361 15.9361 16.3409 16.3409 17.3225 17.3225 17.6698 17.6698 18.0363 18.0363 18.3870 18.3870 19.3640 19.3640 k =-0.1545 0.0678 0.1687 ( 2759 PWs) bands (ev): -57.7707 -57.7707 -29.1781 -29.1781 -19.4171 -19.4171 -19.3922 -19.3922 7.5288 7.5288 11.5851 11.5851 11.8764 11.8764 12.3819 12.3819 12.6429 12.6429 12.7423 12.7423 12.7638 12.7638 13.1114 13.1114 13.5428 13.5428 13.5934 13.5934 14.0504 14.0504 14.0923 14.0923 14.3655 14.3655 14.4440 14.4440 14.5128 14.5128 14.7492 14.7492 15.0368 15.0368 15.1901 15.1901 15.3535 15.3535 15.4514 15.4514 15.6256 15.6256 15.9396 15.9396 16.3508 16.3508 17.3236 17.3236 17.6879 17.6879 18.0326 18.0326 18.4554 18.4554 19.4064 19.4064 k =-0.1455 0.0638 0.1588 ( 2759 PWs) bands (ev): -57.7707 -57.7707 -29.1780 -29.1780 -19.4168 -19.4168 -19.3921 -19.3921 7.4711 7.4711 11.6240 11.6240 11.8932 11.8932 12.4270 12.4270 12.6581 12.6581 12.7612 12.7612 12.7840 12.7840 13.1406 13.1406 13.5228 13.5228 13.5789 13.5789 14.0079 14.0079 14.0940 14.0940 14.3507 14.3507 14.4198 14.4198 14.4836 14.4836 14.7070 14.7070 15.0540 15.0540 15.1912 15.1912 15.3453 15.3453 15.4457 15.4457 15.6460 15.6460 15.9431 15.9431 16.3591 16.3591 17.3233 17.3233 17.7055 17.7055 18.0264 18.0264 18.5309 18.5309 19.4491 19.4491 k =-0.1364 0.0598 0.1489 ( 2759 PWs) bands (ev): -57.7707 -57.7707 -29.1780 -29.1780 -19.4166 -19.4166 -19.3921 -19.3921 7.4166 7.4166 11.6626 11.6626 11.9099 11.9099 12.4721 12.4721 12.6743 12.6743 12.7769 12.7769 12.8066 12.8066 13.1688 13.1688 13.5039 13.5039 13.5645 13.5645 13.9526 13.9526 14.1085 14.1085 14.3358 14.3358 14.3930 14.3930 14.4537 14.4537 14.6661 14.6661 15.0717 15.0717 15.1918 15.1918 15.3385 15.3385 15.4402 15.4402 15.6665 15.6665 15.9467 15.9467 16.3661 16.3661 17.3220 17.3220 17.7224 17.7224 18.0188 18.0188 18.6121 18.6121 19.4919 19.4919 k =-0.1273 0.0558 0.1390 ( 2763 PWs) bands (ev): -57.7707 -57.7707 -29.1780 -29.1780 -19.4164 -19.4164 -19.3920 -19.3920 7.3654 7.3654 11.7007 11.7007 11.9264 11.9264 12.5168 12.5168 12.6914 12.6914 12.7916 12.7916 12.8290 12.8290 13.1960 13.1960 13.4871 13.4871 13.5501 13.5501 13.8970 13.8970 14.1234 14.1234 14.3199 14.3199 14.3641 14.3641 14.4227 14.4227 14.6280 14.6280 15.0894 15.0894 15.1920 15.1920 15.3331 15.3331 15.4349 15.4349 15.6868 15.6868 15.9503 15.9503 16.3719 16.3719 17.3201 17.3201 17.7385 17.7385 18.0104 18.0104 18.6979 18.6979 19.5346 19.5346 k =-0.1182 0.0518 0.1290 ( 2761 PWs) bands (ev): -57.7707 -57.7707 -29.1780 -29.1780 -19.4162 -19.4162 -19.3920 -19.3920 7.3176 7.3176 11.7379 11.7379 11.9429 11.9429 12.5606 12.5606 12.7095 12.7095 12.8061 12.8061 12.8498 12.8498 13.2218 13.2218 13.4734 13.4734 13.5361 13.5361 13.8425 13.8425 14.1375 14.1375 14.3005 14.3005 14.3354 14.3354 14.3902 14.3902 14.5938 14.5938 15.1068 15.1068 15.1925 15.1925 15.3288 15.3288 15.4296 15.4296 15.7066 15.7066 15.9540 15.9540 16.3765 16.3765 17.3179 17.3179 17.7534 17.7534 18.0019 18.0019 18.7874 18.7874 19.5768 19.5768 k =-0.1091 0.0478 0.1191 ( 2761 PWs) bands (ev): -57.7707 -57.7707 -29.1779 -29.1779 -19.4160 -19.4160 -19.3919 -19.3919 7.2732 7.2732 11.7740 11.7740 11.9594 11.9594 12.6029 12.6029 12.7286 12.7286 12.8207 12.8207 12.8685 12.8685 13.2457 13.2457 13.4636 13.4636 13.5229 13.5229 13.7893 13.7893 14.1504 14.1504 14.2733 14.2733 14.3099 14.3099 14.3572 14.3572 14.5644 14.5644 15.1236 15.1236 15.1934 15.1934 15.3253 15.3253 15.4242 15.4242 15.7257 15.7257 15.9579 15.9579 16.3801 16.3801 17.3157 17.3157 17.7671 17.7671 17.9935 17.9935 18.8798 18.8798 19.6185 19.6185 k =-0.1000 0.0438 0.1092 ( 2751 PWs) bands (ev): -57.7707 -57.7707 -29.1779 -29.1779 -19.4159 -19.4159 -19.3918 -19.3918 7.2322 7.2322 11.8083 11.8083 11.9762 11.9762 12.6430 12.6430 12.7486 12.7486 12.8354 12.8354 12.8848 12.8848 13.2672 13.2672 13.4577 13.4577 13.5120 13.5120 13.7379 13.7379 14.1620 14.1620 14.2381 14.2381 14.2834 14.2834 14.3283 14.3283 14.5400 14.5400 15.1396 15.1396 15.1951 15.1951 15.3223 15.3223 15.4186 15.4186 15.7438 15.7438 15.9618 15.9618 16.3828 16.3828 17.3135 17.3135 17.7794 17.7794 17.9857 17.9857 18.9746 18.9746 19.6594 19.6594 k =-0.0909 0.0399 0.0993 ( 2751 PWs) bands (ev): -57.7707 -57.7707 -29.1779 -29.1779 -19.4157 -19.4157 -19.3918 -19.3918 7.1946 7.1946 11.8405 11.8405 11.9934 11.9934 12.6802 12.6802 12.7693 12.7693 12.8500 12.8500 12.8986 12.8986 13.2864 13.2864 13.4538 13.4538 13.5065 13.5065 13.6885 13.6885 14.1713 14.1713 14.1986 14.1986 14.2486 14.2486 14.3090 14.3090 14.5201 14.5201 15.1547 15.1547 15.1980 15.1980 15.3197 15.3197 15.4128 15.4128 15.7608 15.7608 15.9659 15.9659 16.3847 16.3847 17.3115 17.3115 17.7901 17.7901 17.9787 17.9787 19.0709 19.0709 19.6993 19.6993 k =-0.0818 0.0359 0.0893 ( 2745 PWs) bands (ev): -57.7707 -57.7707 -29.1778 -29.1778 -19.4155 -19.4155 -19.3917 -19.3917 7.1605 7.1605 11.8699 11.8699 12.0112 12.0112 12.7137 12.7137 12.7907 12.7907 12.8642 12.8642 12.9100 12.9100 13.3039 13.3039 13.4479 13.4479 13.5106 13.5106 13.6414 13.6414 14.1522 14.1522 14.1822 14.1822 14.2078 14.2078 14.2967 14.2967 14.5040 14.5040 15.1684 15.1684 15.2023 15.2023 15.3173 15.3173 15.4068 15.4068 15.7765 15.7765 15.9701 15.9701 16.3859 16.3859 17.3097 17.3097 17.7992 17.7992 17.9726 17.9726 19.1681 19.1681 19.7381 19.7381 k =-0.0727 0.0319 0.0794 ( 2749 PWs) bands (ev): -57.7708 -57.7708 -29.1778 -29.1778 -19.4154 -19.4154 -19.3917 -19.3917 7.1300 7.1300 11.8961 11.8961 12.0296 12.0296 12.7428 12.7428 12.8124 12.8124 12.8778 12.8778 12.9192 12.9192 13.3213 13.3213 13.4385 13.4385 13.5250 13.5250 13.5973 13.5973 14.1065 14.1065 14.1619 14.1619 14.1908 14.1908 14.2881 14.2881 14.4910 14.4910 15.1807 15.1807 15.2081 15.2081 15.3148 15.3148 15.4004 15.4004 15.7906 15.7906 15.9744 15.9744 16.3866 16.3866 17.3082 17.3082 17.8065 17.8065 17.9676 17.9676 19.2649 19.2649 19.7758 19.7758 k =-0.0636 0.0279 0.0695 ( 2745 PWs) bands (ev): -57.7708 -57.7708 -29.1778 -29.1778 -19.4153 -19.4153 -19.3917 -19.3917 7.1030 7.1030 11.9186 11.9186 12.0487 12.0487 12.7672 12.7672 12.8340 12.8340 12.8904 12.8904 12.9263 12.9263 13.3402 13.3402 13.4273 13.4273 13.5402 13.5402 13.5633 13.5633 14.0580 14.0580 14.1178 14.1178 14.1961 14.1961 14.2817 14.2817 14.4806 14.4806 15.1914 15.1914 15.2155 15.2155 15.3123 15.3123 15.3937 15.3937 15.8031 15.8031 15.9786 15.9786 16.3869 16.3869 17.3070 17.3070 17.8122 17.8122 17.9639 17.9639 19.3600 19.3600 19.8127 19.8127 k =-0.0545 0.0239 0.0596 ( 2747 PWs) bands (ev): -57.7708 -57.7708 -29.1778 -29.1778 -19.4152 -19.4152 -19.3916 -19.3916 7.0795 7.0795 11.9373 11.9373 12.0677 12.0677 12.7869 12.7869 12.8547 12.8547 12.9019 12.9019 12.9318 12.9318 13.3619 13.3619 13.4159 13.4159 13.5129 13.5129 13.5807 13.5807 14.0081 14.0081 14.0735 14.0735 14.2004 14.2004 14.2770 14.2770 14.4722 14.4722 15.2007 15.2007 15.2240 15.2240 15.3097 15.3097 15.3868 15.3868 15.8139 15.8139 15.9827 15.9827 16.3868 16.3868 17.3060 17.3060 17.8163 17.8163 17.9612 17.9612 19.4513 19.4513 19.8493 19.8493 k =-0.0455 0.0199 0.0496 ( 2743 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4151 -19.4151 -19.3916 -19.3916 7.0596 7.0596 11.9525 11.9525 12.0861 12.0861 12.8021 12.8021 12.8739 12.8739 12.9122 12.9122 12.9359 12.9359 13.3847 13.3847 13.4069 13.4069 13.4798 13.4798 13.6120 13.6120 13.9581 13.9581 14.0294 14.0294 14.2035 14.2035 14.2737 14.2737 14.4656 14.4656 15.2089 15.2089 15.2330 15.2330 15.3068 15.3068 15.3798 15.3798 15.8229 15.8229 15.9865 15.9865 16.3865 16.3865 17.3053 17.3053 17.8190 17.8190 17.9596 17.9596 19.5357 19.5357 19.8868 19.8868 k =-0.0364 0.0159 0.0397 ( 2739 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4150 -19.4150 -19.3916 -19.3916 7.0434 7.0434 11.9644 11.9644 12.1028 12.1028 12.8130 12.8130 12.8906 12.8906 12.9212 12.9212 12.9390 12.9390 13.3900 13.3900 13.4159 13.4159 13.4544 13.4544 13.6463 13.6463 13.9093 13.9093 13.9859 13.9859 14.2056 14.2056 14.2715 14.2715 14.4605 14.4605 15.2162 15.2162 15.2418 15.2418 15.3038 15.3038 15.3731 15.3731 15.8303 15.8303 15.9900 15.9900 16.3861 16.3861 17.3047 17.3047 17.8207 17.8207 17.9586 17.9586 19.6094 19.6094 19.9261 19.9261 k =-0.0273 0.0120 0.0298 ( 2743 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4150 -19.4150 -19.3916 -19.3916 7.0307 7.0307 11.9733 11.9733 12.1169 12.1169 12.8204 12.8204 12.9040 12.9040 12.9291 12.9291 12.9417 12.9417 13.3822 13.3822 13.4155 13.4155 13.4599 13.4599 13.6818 13.6818 13.8643 13.8643 13.9429 13.9429 14.2068 14.2068 14.2701 14.2701 14.4568 14.4568 15.2225 15.2225 15.2499 15.2499 15.3006 15.3006 15.3669 15.3669 15.8359 15.8359 15.9929 15.9929 16.3856 16.3856 17.3043 17.3043 17.8217 17.8217 17.9583 17.9583 19.6681 19.6681 19.9673 19.9673 k =-0.0182 0.0080 0.0199 ( 2743 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3916 -19.3916 7.0216 7.0216 11.9795 11.9795 12.1277 12.1277 12.8249 12.8249 12.9134 12.9134 12.9347 12.9347 12.9448 12.9448 13.3746 13.3746 13.4013 13.4013 13.4858 13.4858 13.7164 13.7164 13.8273 13.8273 13.9010 13.9010 14.2075 14.2075 14.2694 14.2694 14.4542 14.4542 15.2275 15.2275 15.2569 15.2569 15.2975 15.2975 15.3619 15.3619 15.8398 15.8398 15.9951 15.9951 16.3853 16.3853 17.3041 17.3041 17.8222 17.8222 17.9582 17.9582 19.7095 19.7095 20.0069 20.0069 k =-0.0091 0.0040 0.0099 ( 2743 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3915 -19.3915 7.0162 7.0162 11.9832 11.9832 12.1344 12.1344 12.8273 12.8273 12.9188 12.9188 12.9374 12.9374 12.9481 12.9481 13.3687 13.3687 13.3920 13.3920 13.5077 13.5077 13.7427 13.7427 13.8096 13.8096 13.8610 13.8610 14.2078 14.2078 14.2690 14.2690 14.4527 14.4527 15.2306 15.2306 15.2619 15.2619 15.2950 15.2950 15.3586 15.3586 15.8422 15.8422 15.9964 15.9964 16.3850 16.3850 17.3039 17.3039 17.8224 17.8224 17.9582 17.9582 19.7335 19.7335 20.0370 20.0370 k = 0.0000 0.0000 0.0000 ( 2747 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3916 -19.3916 7.0144 7.0144 11.9844 11.9844 12.1367 12.1367 12.8280 12.8280 12.9205 12.9205 12.9381 12.9381 12.9496 12.9496 13.3664 13.3664 13.3891 13.3891 13.5164 13.5164 13.7496 13.7496 13.8245 13.8245 13.8274 13.8274 14.2079 14.2079 14.2689 14.2689 14.4522 14.4522 15.2318 15.2318 15.2638 15.2638 15.2939 15.2939 15.3574 15.3574 15.8430 15.8430 15.9969 15.9969 16.3850 16.3850 17.3039 17.3039 17.8224 17.8224 17.9582 17.9582 19.7413 19.7413 20.0484 20.0484 k = 0.0000 0.0000 0.0000 ( 2747 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3916 -19.3916 7.0144 7.0144 11.9844 11.9844 12.1367 12.1367 12.8280 12.8280 12.9205 12.9205 12.9381 12.9381 12.9496 12.9496 13.3664 13.3664 13.3891 13.3891 13.5164 13.5164 13.7496 13.7496 13.8245 13.8245 13.8274 13.8274 14.2079 14.2079 14.2689 14.2689 14.4522 14.4522 15.2318 15.2318 15.2638 15.2638 15.2939 15.2939 15.3574 15.3574 15.8430 15.8430 15.9969 15.9969 16.3850 16.3850 17.3039 17.3039 17.8224 17.8224 17.9582 17.9582 19.7413 19.7413 20.0484 20.0484 k = 0.0056 0.0127-0.0000 ( 2748 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3916 -19.3916 7.0162 7.0162 11.9859 11.9859 12.1374 12.1374 12.8247 12.8247 12.9227 12.9227 12.9245 12.9245 12.9624 12.9624 13.3606 13.3606 13.3877 13.3877 13.5222 13.5222 13.7505 13.7505 13.8261 13.8261 13.8287 13.8287 14.2083 14.2083 14.2690 14.2690 14.4517 14.4517 15.2311 15.2311 15.2632 15.2632 15.2937 15.2937 15.3567 15.3567 15.8426 15.8426 15.9947 15.9947 16.3869 16.3869 17.3046 17.3046 17.8188 17.8188 17.9543 17.9543 19.7453 19.7453 20.0527 20.0527 k = 0.0112 0.0255-0.0000 ( 2736 PWs) bands (ev): -57.7708 -57.7708 -29.1777 -29.1777 -19.4149 -19.4149 -19.3918 -19.3918 7.0216 7.0216 11.9905 11.9905 12.1395 12.1395 12.8156 12.8156 12.9052 12.9052 12.9293 12.9293 12.9787 12.9787 13.3454 13.3454 13.3836 13.3836 13.5375 13.5375 13.7533 13.7533 13.8309 13.8309 13.8326 13.8326 14.2098 14.2098 14.2696 14.2696 14.4505 14.4505 15.2293 15.2293 15.2615 15.2615 15.2930 15.2930 15.3548 15.3548 15.8415 15.8415 15.9884 15.9884 16.3925 16.3925 17.3069 17.3069 17.8082 17.8082 17.9429 17.9429 19.7570 19.7570 20.0654 20.0654 k = 0.0167 0.0382-0.0000 ( 2736 PWs) bands (ev): -57.7707 -57.7707 -29.1778 -29.1778 -19.4148 -19.4148 -19.3922 -19.3922 7.0307 7.0307 11.9981 11.9981 12.1430 12.1430 12.8021 12.8021 12.8847 12.8847 12.9382 12.9382 12.9947 12.9947 13.3244 13.3244 13.3769 13.3769 13.5586 13.5586 13.7580 13.7580 13.8386 13.8386 13.8390 13.8390 14.2121 14.2121 14.2704 14.2704 14.4486 14.4486 15.2263 15.2263 15.2587 15.2587 15.2919 15.2919 15.3516 15.3516 15.8397 15.8397 15.9782 15.9782 16.4015 16.4015 17.3106 17.3106 17.7909 17.7909 17.9243 17.9243 19.7761 19.7761 20.0861 20.0861 k = 0.0223 0.0509-0.0000 ( 2744 PWs) bands (ev): -57.7707 -57.7707 -29.1779 -29.1779 -19.4148 -19.4148 -19.3927 -19.3927 7.0434 7.0434 12.0087 12.0087 12.1478 12.1478 12.7855 12.7855 12.8628 12.8628 12.9487 12.9487 13.0103 13.0103 13.3005 13.3005 13.3678 13.3678 13.5827 13.5827 13.7647 13.7647 13.8477 13.8477 13.8488 13.8488 14.2155 14.2155 14.2714 14.2714 14.4460 14.4460 15.2220 15.2220 15.2547 15.2547 15.2902 15.2902 15.3471 15.3471 15.8373 15.8373 15.9648 15.9648 16.4134 16.4134 17.3157 17.3157 17.7674 17.7674 17.8990 17.8990 19.8019 19.8019 20.1141 20.1141 k = 0.0279 0.0637-0.0000 ( 2740 PWs) bands (ev): -57.7707 -57.7707 -29.1780 -29.1780 -19.4147 -19.4147 -19.3933 -19.3933 7.0597 7.0597 12.0223 12.0223 12.1540 12.1540 12.7664 12.7664 12.8398 12.8398 12.9601 12.9601 13.0256 13.0256 13.2752 13.2752 13.3566 13.3566 13.6083 13.6083 13.7734 13.7734 13.8587 13.8587 13.8610 13.8610 14.2198 14.2198 14.2725 14.2725 14.4429 14.4429 15.2165 15.2165 15.2495 15.2495 15.2881 15.2881 15.3413 15.3413 15.8344 15.8344 15.9485 15.9485 16.4276 16.4276 17.3219 17.3219 17.7384 17.7384 17.8678 17.8678 19.8339 19.8339 20.1488 20.1488 k = 0.0335 0.0764-0.0000 ( 2748 PWs) bands (ev): -57.7707 -57.7707 -29.1781 -29.1781 -19.4147 -19.4147 -19.3940 -19.3940 7.0796 7.0796 12.0388 12.0388 12.1614 12.1614 12.7453 12.7453 12.8156 12.8156 12.9722 12.9722 13.0407 13.0407 13.2493 13.2493 13.3437 13.3437 13.6347 13.6347 13.7840 13.7840 13.8717 13.8717 13.8748 13.8748 14.2250 14.2250 14.2734 14.2734 14.4396 14.4396 15.2099 15.2099 15.2433 15.2433 15.2854 15.2854 15.3344 15.3344 15.8311 15.8311 15.9301 15.9301 16.4435 16.4435 17.3291 17.3291 17.7044 17.7044 17.8314 17.8314 19.8711 19.8711 20.1892 20.1892 k = 0.0391 0.0891-0.0000 ( 2748 PWs) bands (ev): -57.7707 -57.7707 -29.1783 -29.1783 -19.4146 -19.4146 -19.3949 -19.3949 7.1031 7.1031 12.0581 12.0581 12.1700 12.1700 12.7225 12.7225 12.7903 12.7903 12.9849 12.9849 13.0556 13.0556 13.2234 13.2234 13.3293 13.3293 13.6613 13.6613 13.7963 13.7963 13.8864 13.8864 13.8900 13.8900 14.2311 14.2311 14.2738 14.2738 14.4363 14.4363 15.2021 15.2021 15.2359 15.2359 15.2823 15.2823 15.3262 15.3262 15.8276 15.8276 15.9098 15.9098 16.4608 16.4608 17.3370 17.3370 17.6663 17.6663 17.7907 17.7907 19.9126 19.9126 20.2344 20.2344 k = 0.0447 0.1019-0.0000 ( 2748 PWs) bands (ev): -57.7707 -57.7707 -29.1784 -29.1784 -19.4145 -19.4145 -19.3959 -19.3959 7.1301 7.1301 12.0802 12.0802 12.1797 12.1797 12.6983 12.6983 12.7639 12.7639 12.9981 12.9981 13.0704 13.0704 13.1980 13.1980 13.3138 13.3138 13.6879 13.6879 13.8102 13.8102 13.9027 13.9027 13.9062 13.9062 14.2382 14.2382 14.2733 14.2733 14.4335 14.4335 15.1931 15.1931 15.2275 15.2275 15.2785 15.2785 15.3169 15.3169 15.8240 15.8240 15.8882 15.8882 16.4791 16.4791 17.3454 17.3454 17.6248 17.6248 17.7467 17.7467 19.9576 19.9576 20.2834 20.2834 k = 0.0502 0.1146-0.0000 ( 2752 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4144 -19.4144 -19.3971 -19.3971 7.1606 7.1606 12.1049 12.1049 12.1905 12.1905 12.6729 12.6729 12.7366 12.7366 13.0119 13.0119 13.0845 13.0845 13.1739 13.1739 13.2975 13.2975 13.7141 13.7141 13.8254 13.8254 13.9204 13.9204 13.9232 13.9232 14.2462 14.2462 14.2716 14.2716 14.4315 14.4315 15.1830 15.1830 15.2179 15.2179 15.2742 15.2742 15.3066 15.3066 15.8205 15.8205 15.8655 15.8655 16.4980 16.4980 17.3537 17.3537 17.5804 17.5804 17.7002 17.7002 20.0051 20.0051 20.3352 20.3352 k = 0.0558 0.1273-0.0000 ( 2752 PWs) bands (ev): -57.7706 -57.7706 -29.1788 -29.1788 -19.4143 -19.4143 -19.3983 -19.3983 7.1947 7.1947 12.1321 12.1321 12.2022 12.2022 12.6464 12.6464 12.7084 12.7084 13.0260 13.0260 13.0962 13.0962 13.1532 13.1532 13.2809 13.2809 13.7399 13.7399 13.8416 13.8416 13.9392 13.9392 13.9407 13.9407 14.2551 14.2551 14.2682 14.2682 14.4308 14.4308 15.1718 15.1718 15.2074 15.2074 15.2693 15.2693 15.2951 15.2951 15.8173 15.8173 15.8420 15.8420 16.5174 16.5174 17.3613 17.3613 17.5339 17.5339 17.6523 17.6523 20.0543 20.0543 20.3890 20.3890 k = 0.0614 0.1401-0.0000 ( 2752 PWs) bands (ev): -57.7706 -57.7706 -29.1790 -29.1790 -19.4141 -19.4141 -19.3996 -19.3996 7.2322 7.2322 12.1616 12.1616 12.2146 12.2146 12.6190 12.6190 12.6795 12.6795 13.0404 13.0404 13.0985 13.0985 13.1431 13.1431 13.2642 13.2642 13.7651 13.7651 13.8587 13.8587 13.9586 13.9586 13.9591 13.9591 14.2626 14.2626 14.2651 14.2651 14.4319 14.4319 15.1595 15.1595 15.1958 15.1958 15.2637 15.2637 15.2828 15.2828 15.8143 15.8143 15.8179 15.8179 16.5370 16.5370 17.3674 17.3674 17.4858 17.4858 17.6042 17.6042 20.1042 20.1042 20.4438 20.4438 k = 0.0670 0.1528-0.0000 ( 2744 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4140 -19.4140 -19.4010 -19.4010 7.2732 7.2732 12.1931 12.1931 12.2277 12.2277 12.5910 12.5910 12.6500 12.6500 13.0548 13.0548 13.0855 13.0855 13.1498 13.1498 13.2480 13.2480 13.7896 13.7896 13.8764 13.8764 13.9769 13.9769 13.9795 13.9795 14.2548 14.2548 14.2757 14.2757 14.4349 14.4349 15.1463 15.1463 15.1832 15.1832 15.2576 15.2576 15.2695 15.2695 15.7931 15.7931 15.8122 15.8122 16.5568 16.5568 17.3701 17.3701 17.4364 17.4364 17.5581 17.5581 20.1541 20.1541 20.4989 20.4989 k = 0.0726 0.1655-0.0000 ( 2760 PWs) bands (ev): -57.7705 -57.7705 -29.1795 -29.1795 -19.4139 -19.4139 -19.4026 -19.4026 7.3176 7.3176 12.2264 12.2264 12.2411 12.2411 12.5627 12.5627 12.6200 12.6200 13.0665 13.0665 13.0689 13.0689 13.1642 13.1642 13.2329 13.2329 13.8133 13.8133 13.8945 13.8945 13.9953 13.9953 14.0006 14.0006 14.2446 14.2446 14.2873 14.2873 14.4400 14.4400 15.1320 15.1320 15.1697 15.1697 15.2506 15.2506 15.2556 15.2556 15.7681 15.7681 15.8105 15.8105 16.5765 16.5765 17.3659 17.3659 17.3864 17.3864 17.5177 17.5177 20.2032 20.2032 20.5533 20.5533 k = 0.0782 0.1783-0.0000 ( 2752 PWs) bands (ev): -57.7704 -57.7704 -29.1797 -29.1797 -19.4137 -19.4137 -19.4042 -19.4042 7.3653 7.3653 12.2547 12.2547 12.2610 12.2610 12.5344 12.5344 12.5896 12.5896 13.0469 13.0469 13.0816 13.0816 13.1811 13.1811 13.2200 13.2200 13.8360 13.8360 13.9129 13.9129 14.0138 14.0138 14.0221 14.0221 14.2320 14.2320 14.2998 14.2998 14.4471 14.4471 15.1169 15.1169 15.1554 15.1554 15.2399 15.2399 15.2441 15.2441 15.7428 15.7428 15.8096 15.8096 16.5961 16.5961 17.3359 17.3359 17.3493 17.3493 17.4885 17.4885 20.2507 20.2507 20.6064 20.6064 k = 0.0837 0.1910-0.0000 ( 2748 PWs) bands (ev): -57.7704 -57.7704 -29.1800 -29.1800 -19.4136 -19.4136 -19.4059 -19.4059 7.4164 7.4164 12.2681 12.2681 12.2958 12.2958 12.5070 12.5070 12.5590 12.5590 13.0281 13.0281 13.0917 13.0917 13.1994 13.1994 13.2110 13.2110 13.8578 13.8578 13.9313 13.9313 14.0325 14.0325 14.0439 14.0439 14.2173 14.2173 14.3132 14.3132 14.4561 14.4561 15.1010 15.1010 15.1402 15.1402 15.2246 15.2246 15.2359 15.2359 15.7174 15.7174 15.8096 15.8096 16.6154 16.6154 17.2853 17.2853 17.3177 17.3177 17.4734 17.4734 20.2958 20.2958 20.6572 20.6572 k = 0.0893 0.2037-0.0000 ( 2756 PWs) bands (ev): -57.7703 -57.7703 -29.1803 -29.1803 -19.4134 -19.4134 -19.4076 -19.4076 7.4707 7.4707 12.2811 12.2811 12.3289 12.3289 12.4822 12.4822 12.5283 12.5283 13.0108 13.0108 13.0973 13.0973 13.2078 13.2078 13.2185 13.2185 13.8784 13.8784 13.9496 13.9496 14.0511 14.0511 14.0659 14.0659 14.2006 14.2006 14.3274 14.3274 14.4668 14.4668 15.0842 15.0842 15.1243 15.1243 15.2085 15.2085 15.2274 15.2274 15.6918 15.6918 15.8104 15.8104 16.6345 16.6345 17.2350 17.2350 17.2751 17.2751 17.4683 17.4683 20.3378 20.3378 20.7051 20.7051 k = 0.0949 0.2165-0.0000 ( 2756 PWs) bands (ev): -57.7703 -57.7703 -29.1806 -29.1806 -19.4133 -19.4133 -19.4095 -19.4095 7.5282 7.5282 12.2931 12.2931 12.3546 12.3546 12.4655 12.4655 12.4978 12.4978 12.9955 12.9955 13.0974 13.0974 13.2118 13.2118 13.2384 13.2384 13.8978 13.8978 13.9676 13.9676 14.0696 14.0696 14.0878 14.0878 14.1823 14.1823 14.3424 14.3424 14.4791 14.4791 15.0668 15.0668 15.1078 15.1078 15.1919 15.1919 15.2184 15.2184 15.6662 15.6662 15.8121 15.8121 16.6532 16.6532 17.1852 17.1852 17.2270 17.2270 17.4677 17.4677 20.3761 20.3761 20.7493 20.7493 k = 0.1005 0.2292-0.0000 ( 2760 PWs) bands (ev): -57.7702 -57.7702 -29.1809 -29.1809 -19.4131 -19.4131 -19.4113 -19.4113 7.5889 7.5889 12.3036 12.3036 12.3611 12.3611 12.4677 12.4677 12.4683 12.4683 12.9825 12.9825 13.0929 13.0929 13.2225 13.2225 13.2588 13.2588 13.9159 13.9159 13.9853 13.9853 14.0881 14.0881 14.1095 14.1095 14.1626 14.1626 14.3582 14.3582 14.4927 14.4927 15.0488 15.0488 15.0907 15.0907 15.1749 15.1749 15.2088 15.2088 15.6406 15.6406 15.8148 15.8148 16.6712 16.6712 17.1363 17.1363 17.1764 17.1764 17.4687 17.4687 20.4098 20.4098 20.7892 20.7892 k = 0.1061 0.2419-0.0000 ( 2760 PWs) bands (ev): -57.7702 -57.7702 -29.1812 -29.1812 -19.4134 -19.4134 -19.4128 -19.4128 7.6528 7.6528 12.3116 12.3116 12.3465 12.3465 12.4388 12.4388 12.4919 12.4919 12.9720 12.9720 13.0860 13.0860 13.2378 13.2378 13.2798 13.2798 13.9326 13.9326 14.0025 14.0025 14.1064 14.1064 14.1292 14.1292 14.1435 14.1435 14.3747 14.3747 14.5074 14.5074 15.0304 15.0304 15.0732 15.0732 15.1575 15.1575 15.1988 15.1988 15.6151 15.6151 15.8185 15.8185 16.6885 16.6885 17.0886 17.0886 17.1248 17.1248 17.4697 17.4697 20.4385 20.4385 20.8240 20.8240 k = 0.1117 0.2546-0.0000 ( 2760 PWs) bands (ev): -57.7701 -57.7701 -29.1815 -29.1815 -19.4152 -19.4152 -19.4127 -19.4127 7.7197 7.7197 12.3158 12.3158 12.3219 12.3219 12.4122 12.4122 12.5245 12.5245 12.9645 12.9645 13.0791 13.0791 13.2563 13.2563 13.3013 13.3013 13.9475 13.9475 14.0191 14.0191 14.1177 14.1177 14.1246 14.1246 14.1543 14.1543 14.3920 14.3920 14.5232 14.5232 15.0115 15.0115 15.0555 15.0555 15.1400 15.1400 15.1883 15.1883 15.5896 15.5896 15.8230 15.8230 16.7044 16.7044 17.0427 17.0427 17.0731 17.0731 17.4699 17.4699 20.4615 20.4615 20.8532 20.8532 k = 0.1172 0.2674-0.0000 ( 2760 PWs) bands (ev): -57.7701 -57.7701 -29.1818 -29.1818 -19.4172 -19.4172 -19.4126 -19.4126 7.7895 7.7895 12.2938 12.2938 12.3135 12.3135 12.3902 12.3902 12.5589 12.5589 12.9602 12.9602 13.0738 13.0738 13.2768 13.2768 13.3231 13.3231 13.9604 13.9604 14.0351 14.0351 14.0957 14.0957 14.1426 14.1426 14.1751 14.1751 14.4100 14.4100 14.5399 14.5399 14.9924 14.9924 15.0376 15.0376 15.1223 15.1223 15.1773 15.1773 15.5643 15.5643 15.8285 15.8285 16.7184 16.7184 16.9995 16.9995 17.0215 17.0215 17.4689 17.4689 20.4783 20.4783 20.8760 20.8760 k = 0.1228 0.2801-0.0000 ( 2768 PWs) bands (ev): -57.7700 -57.7700 -29.1822 -29.1822 -19.4192 -19.4192 -19.4124 -19.4124 7.8623 7.8623 12.2643 12.2643 12.3016 12.3016 12.3757 12.3757 12.5918 12.5918 12.9593 12.9593 13.0717 13.0717 13.2986 13.2986 13.3453 13.3453 13.9703 13.9703 14.0503 14.0503 14.0738 14.0738 14.1604 14.1604 14.1958 14.1958 14.4286 14.4286 14.5573 14.5573 14.9732 14.9732 15.0198 15.0198 15.1046 15.1046 15.1658 15.1658 15.5393 15.5393 15.8347 15.8347 16.7287 16.7287 16.9606 16.9606 16.9705 16.9705 17.4665 17.4665 20.4885 20.4885 20.8922 20.8922 k = 0.1284 0.2928-0.0000 ( 2776 PWs) bands (ev): -57.7699 -57.7699 -29.1825 -29.1825 -19.4212 -19.4212 -19.4123 -19.4123 7.9379 7.9379 12.2342 12.2342 12.2810 12.2810 12.3677 12.3677 12.6211 12.6211 12.9619 12.9619 13.0742 13.0742 13.3213 13.3213 13.3677 13.3677 13.9752 13.9752 14.0545 14.0545 14.0649 14.0649 14.1779 14.1779 14.2160 14.2160 14.4478 14.4478 14.5752 14.5752 14.9540 14.9540 15.0023 15.0023 15.0869 15.0869 15.1537 15.1537 15.5144 15.5144 15.8418 15.8418 16.7328 16.7328 16.9200 16.9200 16.9289 16.9289 17.4624 17.4624 20.4918 20.4918 20.9012 20.9012 k = 0.1340 0.3056-0.0000 ( 2784 PWs) bands (ev): -57.7699 -57.7699 -29.1828 -29.1828 -19.4232 -19.4232 -19.4122 -19.4122 8.0163 8.0163 12.2039 12.2039 12.2556 12.2556 12.3622 12.3622 12.6452 12.6452 12.9681 12.9681 13.0825 13.0825 13.3448 13.3448 13.3902 13.3902 13.9710 13.9710 14.0421 14.0421 14.0786 14.0786 14.1950 14.1950 14.2358 14.2358 14.4674 14.4674 14.5935 14.5935 14.9349 14.9349 14.9854 14.9854 15.0695 15.0695 15.1412 15.1412 15.4899 15.4899 15.8495 15.8495 16.7268 16.7268 16.8704 16.8704 16.9082 16.9082 17.4568 17.4568 20.4880 20.4880 20.9028 20.9028 k = 0.1396 0.3183-0.0000 ( 2780 PWs) bands (ev): -57.7698 -57.7698 -29.1831 -29.1831 -19.4251 -19.4251 -19.4120 -19.4120 8.0973 8.0973 12.1736 12.1736 12.2280 12.2280 12.3566 12.3566 12.6631 12.6631 12.9776 12.9776 13.0975 13.0975 13.3687 13.3687 13.4129 13.4129 13.9555 13.9555 14.0389 14.0389 14.0915 14.0915 14.2118 14.2118 14.2549 14.2549 14.4874 14.4874 14.6119 14.6119 14.9162 14.9162 14.9694 14.9694 15.0522 15.0522 15.1280 15.1280 15.4659 15.4659 15.8578 15.8578 16.7084 16.7084 16.8216 16.8216 16.9009 16.9009 17.4496 17.4496 20.4769 20.4769 20.8967 20.8967 k = 0.1451 0.3310-0.0000 ( 2784 PWs) bands (ev): -57.7698 -57.7698 -29.1835 -29.1835 -19.4271 -19.4271 -19.4119 -19.4119 8.1810 8.1810 12.1435 12.1435 12.1996 12.1996 12.3496 12.3496 12.6743 12.6743 12.9903 12.9903 13.1192 13.1192 13.3929 13.3929 13.4355 13.4355 13.9323 13.9323 14.0413 14.0413 14.1037 14.1037 14.2281 14.2281 14.2734 14.2734 14.5076 14.5076 14.6301 14.6301 14.8980 14.8980 14.9547 14.9547 15.0354 15.0354 15.1142 15.1142 15.4422 15.4422 15.8666 15.8666 16.6799 16.6799 16.7737 16.7737 16.9051 16.9051 17.4410 17.4410 20.4587 20.4587 20.8831 20.8831 k = 0.1507 0.3438-0.0000 ( 2784 PWs) bands (ev): -57.7697 -57.7697 -29.1838 -29.1838 -19.4290 -19.4290 -19.4117 -19.4117 8.2671 8.2671 12.1137 12.1137 12.1711 12.1711 12.3410 12.3410 12.6792 12.6792 13.0059 13.0059 13.1470 13.1470 13.4172 13.4172 13.4579 13.4579 13.9051 13.9051 14.0458 14.0458 14.1150 14.1150 14.2439 14.2439 14.2911 14.2911 14.5279 14.5279 14.6476 14.6476 14.8806 14.8806 14.9418 14.9418 15.0190 15.0190 15.0997 15.0997 15.4192 15.4192 15.8759 15.8759 16.6450 16.6450 16.7267 16.7267 16.9170 16.9170 17.4311 17.4311 20.4334 20.4334 20.8618 20.8618 k = 0.1563 0.3565-0.0000 ( 2800 PWs) bands (ev): -57.7697 -57.7697 -29.1841 -29.1841 -19.4309 -19.4309 -19.4116 -19.4116 8.3556 8.3556 12.0843 12.0843 12.1427 12.1427 12.3306 12.3306 12.6785 12.6785 13.0241 13.0241 13.1797 13.1797 13.4414 13.4414 13.4802 13.4802 13.8757 13.8757 14.0506 14.0506 14.1254 14.1254 14.2592 14.2592 14.3079 14.3079 14.5478 14.5478 14.6638 14.6638 14.8642 14.8642 14.9314 14.9314 15.0033 15.0033 15.0846 15.0846 15.3968 15.3968 15.8854 15.8854 16.6068 16.6068 16.6807 16.6807 16.9335 16.9335 17.4202 17.4202 20.4013 20.4013 20.8332 20.8332 k = 0.1619 0.3692-0.0000 ( 2800 PWs) bands (ev): -57.7696 -57.7696 -29.1844 -29.1844 -19.4327 -19.4327 -19.4115 -19.4115 8.4464 8.4464 12.0552 12.0552 12.1146 12.1146 12.3184 12.3184 12.6734 12.6734 13.0444 13.0444 13.2161 13.2161 13.4656 13.4656 13.5021 13.5021 13.8448 13.8448 14.0551 14.0551 14.1351 14.1351 14.2738 14.2738 14.3238 14.3238 14.5672 14.5672 14.6781 14.6781 14.8490 14.8490 14.9242 14.9242 14.9885 14.9885 15.0687 15.0687 15.3751 15.3751 15.8952 15.8952 16.5671 16.5671 16.6358 16.6358 16.9533 16.9533 17.4087 17.4087 20.3627 20.3627 20.7975 20.7975 k = 0.1675 0.3820-0.0000 ( 2800 PWs) bands (ev): -57.7696 -57.7696 -29.1847 -29.1847 -19.4344 -19.4344 -19.4114 -19.4114 8.5394 8.5394 12.0266 12.0266 12.0869 12.0869 12.3048 12.3048 12.6648 12.6648 13.0665 13.0665 13.2547 13.2547 13.4894 13.4894 13.5236 13.5236 13.8130 13.8130 14.0590 14.0590 14.1438 14.1438 14.2877 14.2877 14.3387 14.3387 14.5854 14.5854 14.6896 14.6896 14.8354 14.8354 14.9211 14.9211 14.9748 14.9748 15.0521 15.0521 15.3543 15.3543 15.9051 15.9051 16.5268 16.5268 16.5919 16.5919 16.9754 16.9754 17.3967 17.3967 20.3178 20.3178 20.7552 20.7552 k = 0.1731 0.3947-0.0000 ( 2800 PWs) bands (ev): -57.7695 -57.7695 -29.1850 -29.1850 -19.4361 -19.4361 -19.4113 -19.4113 8.6344 8.6344 11.9986 11.9986 12.0597 12.0597 12.2898 12.2898 12.6536 12.6536 13.0899 13.0899 13.2945 13.2945 13.5128 13.5128 13.5445 13.5445 13.7803 13.7803 14.0621 14.0621 14.1517 14.1517 14.3007 14.3007 14.3524 14.3524 14.6018 14.6018 14.6976 14.6976 14.8238 14.8238 14.9228 14.9228 14.9627 14.9627 15.0350 15.0350 15.3344 15.3344 15.9150 15.9150 16.4865 16.4865 16.5492 16.5492 16.9996 16.9996 17.3848 17.3848 20.2670 20.2670 20.7070 20.7070 k = 0.1786 0.4074-0.0000 ( 2800 PWs) bands (ev): -57.7695 -57.7695 -29.1852 -29.1852 -19.4377 -19.4377 -19.4113 -19.4113 8.7313 8.7313 11.9711 11.9711 12.0331 12.0331 12.2735 12.2735 12.6404 12.6404 13.1143 13.1143 13.3345 13.3345 13.5357 13.5357 13.5648 13.5648 13.7469 13.7469 14.0645 14.0645 14.1587 14.1587 14.3129 14.3129 14.3650 14.3650 14.6157 14.6157 14.7020 14.7020 14.8143 14.8143 14.9292 14.9292 14.9527 14.9527 15.0175 15.0175 15.3156 15.3156 15.9248 15.9248 16.4466 16.4466 16.5077 16.5077 17.0255 17.0255 17.3733 17.3733 20.2105 20.2105 20.6539 20.6539 k = 0.1842 0.4202-0.0000 ( 2792 PWs) bands (ev): -57.7694 -57.7694 -29.1855 -29.1855 -19.4392 -19.4392 -19.4112 -19.4112 8.8300 8.8300 11.9442 11.9442 12.0071 12.0071 12.2561 12.2561 12.6257 12.6257 13.1394 13.1394 13.3739 13.3739 13.5579 13.5579 13.5843 13.5843 13.7129 13.7129 14.0660 14.0660 14.1648 14.1648 14.3240 14.3240 14.3761 14.3761 14.6265 14.6265 14.7031 14.7031 14.8070 14.8070 14.9393 14.9393 14.9457 14.9457 15.0007 15.0007 15.2980 15.2980 15.9344 15.9344 16.4073 16.4073 16.4675 16.4675 17.0532 17.0532 17.3627 17.3627 20.1485 20.1485 20.5969 20.5969 k = 0.1898 0.4329-0.0000 ( 2780 PWs) bands (ev): -57.7694 -57.7694 -29.1857 -29.1857 -19.4405 -19.4405 -19.4111 -19.4111 8.9303 8.9303 11.9179 11.9179 11.9819 11.9819 12.2378 12.2378 12.6097 12.6097 13.1649 13.1649 13.4123 13.4123 13.5794 13.5794 13.6029 13.6029 13.6785 13.6785 14.0666 14.0666 14.1698 14.1698 14.3340 14.3340 14.3858 14.3858 14.6336 14.6336 14.7014 14.7014 14.8015 14.8015 14.9425 14.9425 14.9487 14.9487 14.9887 14.9887 15.2816 15.2816 15.9438 15.9438 16.3688 16.3688 16.4288 16.4288 17.0827 17.0827 17.3532 17.3532 20.0810 20.0810 20.5370 20.5370 k = 0.1954 0.4456-0.0000 ( 2780 PWs) bands (ev): -57.7693 -57.7693 -29.1859 -29.1859 -19.4419 -19.4419 -19.4111 -19.4111 9.0320 9.0320 11.8923 11.8923 11.9573 11.9573 12.2186 12.2186 12.5928 12.5928 13.1903 13.1903 13.4490 13.4490 13.5999 13.5999 13.6199 13.6199 13.6445 13.6445 14.0663 14.0663 14.1738 14.1738 14.3426 14.3426 14.3939 14.3939 14.6371 14.6371 14.6979 14.6979 14.7968 14.7968 14.9432 14.9432 14.9454 14.9454 14.9934 14.9934 15.2665 15.2665 15.9528 15.9528 16.3313 16.3313 16.3916 16.3916 17.1138 17.1138 17.3453 17.3453 20.0077 20.0077 20.4749 20.4749 k = 0.2010 0.4584-0.0000 ( 2784 PWs) bands (ev): -57.7693 -57.7693 -29.1861 -29.1861 -19.4431 -19.4431 -19.4111 -19.4111 9.1350 9.1350 11.8673 11.8673 11.9335 11.9335 12.1985 12.1985 12.5751 12.5751 13.2155 13.2155 13.4838 13.4838 13.6066 13.6066 13.6195 13.6195 13.6393 13.6393 14.0649 14.0649 14.1765 14.1765 14.3497 14.3497 14.4001 14.4001 14.6376 14.6376 14.6935 14.6935 14.7918 14.7918 14.9284 14.9284 14.9516 14.9516 15.0123 15.0123 15.2529 15.2529 15.9614 15.9614 16.2950 16.2950 16.3561 16.3561 17.1466 17.1466 17.3393 17.3393 19.9281 19.9281 20.4111 20.4111 k = 0.2066 0.4711-0.0000 ( 2784 PWs) bands (ev): -57.7693 -57.7693 -29.1863 -29.1863 -19.4442 -19.4442 -19.4111 -19.4111 9.2391 9.2391 11.8431 11.8431 11.9104 11.9104 12.1776 12.1776 12.5567 12.5567 13.2402 13.2402 13.5164 13.5164 13.5715 13.5715 13.6381 13.6381 13.6545 13.6545 14.0624 14.0624 14.1780 14.1780 14.3551 14.3551 14.4044 14.4044 14.6361 14.6361 14.6887 14.6887 14.7861 14.7861 14.9097 14.9097 14.9640 14.9640 15.0364 15.0364 15.2408 15.2408 15.9695 15.9695 16.2601 16.2601 16.3225 16.3225 17.1812 17.1812 17.3354 17.3354 19.8418 19.8418 20.3459 20.3459 k = 0.2121 0.4838-0.0000 ( 2792 PWs) bands (ev): -57.7692 -57.7692 -29.1865 -29.1865 -19.4452 -19.4452 -19.4111 -19.4111 9.3441 9.3441 11.8196 11.8196 11.8881 11.8881 12.1560 12.1560 12.5377 12.5377 13.2641 13.2641 13.5357 13.5357 13.5465 13.5465 13.6555 13.6555 13.6692 13.6692 14.0587 14.0587 14.1780 14.1780 14.3586 14.3586 14.4066 14.4066 14.6333 14.6333 14.6842 14.6842 14.7794 14.7794 14.8906 14.8906 14.9811 14.9811 15.0632 15.0632 15.2304 15.2304 15.9770 15.9770 16.2267 16.2267 16.2909 16.2909 17.2173 17.2173 17.3340 17.3340 19.7479 19.7479 20.2797 20.2797 k = 0.2177 0.4966-0.0000 ( 2792 PWs) bands (ev): -57.7692 -57.7692 -29.1866 -29.1866 -19.4461 -19.4461 -19.4112 -19.4112 9.4496 9.4496 11.7968 11.7968 11.8667 11.8667 12.1336 12.1336 12.5180 12.5180 13.2868 13.2868 13.4996 13.4996 13.5742 13.5742 13.6718 13.6718 13.6829 13.6829 14.0537 14.0537 14.1765 14.1765 14.3600 14.3600 14.4064 14.4064 14.6301 14.6301 14.6802 14.6802 14.7721 14.7721 14.8719 14.8719 15.0016 15.0016 15.0917 15.0917 15.2219 15.2219 15.9840 15.9840 16.1950 16.1950 16.2616 16.2616 17.2549 17.2549 17.3352 17.3352 19.6461 19.6461 20.1989 20.1989 k = 0.2233 0.5093-0.0000 ( 2800 PWs) bands (ev): -57.7692 -57.7692 -29.1868 -29.1868 -19.4468 -19.4468 -19.4113 -19.4113 9.5556 9.5556 11.7748 11.7748 11.8461 11.8461 12.1105 12.1105 12.4978 12.4978 13.3081 13.3081 13.4636 13.4636 13.5993 13.5993 13.6869 13.6869 13.6954 13.6954 14.0472 14.0472 14.1733 14.1733 14.3591 14.3591 14.4038 14.4038 14.6272 14.6272 14.6772 14.6772 14.7647 14.7647 14.8543 14.8543 15.0244 15.0244 15.1215 15.1215 15.2156 15.2156 15.9904 15.9904 16.1652 16.1652 16.2346 16.2346 17.2938 17.2938 17.3391 17.3391 19.5367 19.5367 20.0847 20.0847 k = 0.2289 0.5220-0.0000 ( 2788 PWs) bands (ev): -57.7692 -57.7692 -29.1869 -29.1869 -19.4474 -19.4474 -19.4113 -19.4113 9.6617 9.6617 11.7535 11.7535 11.8264 11.8264 12.0866 12.0866 12.4770 12.4770 13.3271 13.3271 13.4284 13.4284 13.6218 13.6218 13.7009 13.7009 13.7068 13.7068 14.0391 14.0391 14.1683 14.1683 14.3556 14.3556 14.3987 14.3987 14.6249 14.6249 14.6752 14.6752 14.7577 14.7577 14.8381 14.8381 15.0483 15.0483 15.1523 15.1523 15.2119 15.2119 15.9961 15.9961 16.1375 16.1375 16.2104 16.2104 17.3337 17.3337 17.3457 17.3457 19.4210 19.4210 19.9802 19.9802 k = 0.2345 0.5348-0.0000 ( 2788 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4479 -19.4479 -19.4114 -19.4114 9.7676 9.7676 11.7331 11.7331 11.8075 11.8075 12.0619 12.0619 12.4555 12.4555 13.3404 13.3404 13.3971 13.3971 13.6418 13.6418 13.7137 13.7137 13.7171 13.7171 14.0296 14.0296 14.1615 14.1615 14.3495 14.3495 14.3910 14.3910 14.6236 14.6236 14.6743 14.6743 14.7514 14.7514 14.8239 14.8239 15.0720 15.0720 15.1839 15.1839 15.2116 15.2116 16.0010 16.0010 16.1121 16.1121 16.1889 16.1889 17.3550 17.3550 17.3743 17.3743 19.3010 19.3010 19.8846 19.8846 k = 0.2401 0.5475-0.0000 ( 2796 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4483 -19.4483 -19.4116 -19.4116 9.8731 9.8731 11.7134 11.7134 11.7895 11.7895 12.0364 12.0364 12.4332 12.4332 13.3335 13.3335 13.3842 13.3842 13.6592 13.6592 13.7252 13.7252 13.7263 13.7263 14.0185 14.0185 14.1528 14.1528 14.3407 14.3407 14.3807 14.3807 14.6234 14.6234 14.6747 14.6747 14.7463 14.7463 14.8120 14.8120 15.0936 15.0936 15.2159 15.2159 15.2162 15.2162 16.0052 16.0052 16.0889 16.0889 16.1705 16.1705 17.3670 17.3670 17.4149 17.4149 19.1790 19.1790 19.7964 19.7964 k = 0.2456 0.5602-0.0000 ( 2796 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4117 -19.4117 9.9778 9.9778 11.6945 11.6945 11.7724 11.7724 12.0101 12.0101 12.4102 12.4102 13.3036 13.3036 13.3923 13.3923 13.6740 13.6740 13.7339 13.7339 13.7363 13.7363 14.0062 14.0062 14.1423 14.1423 14.3292 14.3292 14.3679 14.3679 14.6245 14.6245 14.6762 14.6762 14.7429 14.7429 14.8025 14.8025 15.1113 15.1113 15.2267 15.2267 15.2488 15.2488 16.0087 16.0087 16.0683 16.0683 16.1553 16.1553 17.3816 17.3816 17.4551 17.4551 19.0576 19.0576 19.7143 19.7143 k = 0.2512 0.5730-0.0000 ( 2804 PWs) bands (ev): -57.7691 -57.7691 -29.1872 -29.1872 -19.4486 -19.4486 -19.4119 -19.4119 10.0813 10.0813 11.6764 11.6764 11.7561 11.7561 11.9830 11.9830 12.3863 12.3863 13.2679 13.2679 13.4039 13.4039 13.6863 13.6863 13.7408 13.7408 13.7460 13.7460 13.9928 13.9928 14.1301 14.1301 14.3151 14.3151 14.3526 14.3526 14.6268 14.6268 14.6788 14.6788 14.7413 14.7413 14.7956 14.7956 15.1241 15.1241 15.2445 15.2445 15.2818 15.2818 16.0114 16.0114 16.0501 16.0501 16.1432 16.1432 17.3987 17.3987 17.4937 17.4937 18.9391 18.9391 19.6372 19.6372 k = 0.2568 0.5857-0.0000 ( 2804 PWs) bands (ev): -57.7691 -57.7691 -29.1872 -29.1872 -19.4485 -19.4485 -19.4120 -19.4120 10.1834 10.1834 11.6591 11.6591 11.7407 11.7407 11.9550 11.9550 12.3614 12.3614 13.2308 13.2308 13.4147 13.4147 13.6959 13.6959 13.7464 13.7464 13.7548 13.7548 13.9788 13.9788 14.1163 14.1163 14.2984 14.2984 14.3351 14.3351 14.6304 14.6304 14.6826 14.6826 14.7421 14.7421 14.7914 14.7914 15.1326 15.1326 15.2684 15.2684 15.3150 15.3150 16.0135 16.0135 16.0347 16.0347 16.1342 16.1342 17.4180 17.4180 17.5298 17.5298 18.8257 18.8257 19.5642 19.5642 k = 0.2624 0.5984-0.0000 ( 2804 PWs) bands (ev): -57.7691 -57.7691 -29.1872 -29.1872 -19.4483 -19.4483 -19.4122 -19.4122 10.2835 10.2835 11.6426 11.6426 11.7262 11.7262 11.9261 11.9261 12.3354 12.3354 13.1930 13.1930 13.4237 13.4237 13.7028 13.7028 13.7508 13.7508 13.7627 13.7627 13.9648 13.9648 14.1014 14.1014 14.2794 14.2794 14.3154 14.3154 14.6352 14.6352 14.6873 14.6873 14.7454 14.7454 14.7898 14.7898 15.1385 15.1385 15.2966 15.2966 15.3484 15.3484 16.0151 16.0151 16.0218 16.0218 16.1282 16.1282 17.4395 17.4395 17.5616 17.5616 18.7195 18.7195 19.4947 19.4947 k = 0.2680 0.6112-0.0000 ( 2804 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4480 -19.4480 -19.4125 -19.4125 10.3813 10.3813 11.6268 11.6268 11.7125 11.7125 11.8963 11.8963 12.3083 12.3083 13.1549 13.1549 13.4302 13.4302 13.7068 13.7068 13.7539 13.7539 13.7698 13.7698 13.9513 13.9513 14.0857 14.0857 14.2584 14.2584 14.2940 14.2940 14.6412 14.6412 14.6930 14.6930 14.7516 14.7516 14.7907 14.7907 15.1433 15.1433 15.3276 15.3276 15.3817 15.3817 16.0116 16.0116 16.0167 16.0167 16.1249 16.1249 17.4628 17.4628 17.5870 17.5870 18.6231 18.6231 19.4281 19.4281 k = 0.2735 0.6239-0.0000 ( 2804 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4476 -19.4476 -19.4127 -19.4127 10.4764 10.4764 11.6119 11.6119 11.6995 11.6995 11.8657 11.8657 12.2799 12.2799 13.1166 13.1166 13.4342 13.4342 13.7077 13.7077 13.7557 13.7557 13.7759 13.7759 13.9388 13.9388 14.0697 14.0697 14.2356 14.2356 14.2710 14.2710 14.6484 14.6484 14.6994 14.6994 14.7609 14.7609 14.7940 14.7940 15.1479 15.1479 15.3603 15.3603 15.4150 15.4150 16.0041 16.0041 16.0184 16.0184 16.1238 16.1238 17.4879 17.4879 17.6036 17.6036 18.5392 18.5392 19.3643 19.3643 k = 0.2791 0.6366-0.0000 ( 2804 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4470 -19.4470 -19.4129 -19.4129 10.5684 10.5684 11.5978 11.5978 11.6873 11.6873 11.8343 11.8343 12.2501 12.2501 13.0782 13.0782 13.4354 13.4354 13.7054 13.7054 13.7561 13.7561 13.7808 13.7808 13.9281 13.9281 14.0542 14.0542 14.2115 14.2115 14.2469 14.2469 14.6565 14.6565 14.7066 14.7066 14.7736 14.7736 14.7994 14.7994 15.1532 15.1532 15.3941 15.3941 15.4480 15.4480 15.9991 15.9991 16.0204 16.0204 16.1247 16.1247 17.5145 17.5145 17.6084 17.6084 18.4705 18.4705 19.3031 19.3031 k = 0.2847 0.6494-0.0000 ( 2804 PWs) bands (ev): -57.7692 -57.7692 -29.1869 -29.1869 -19.4463 -19.4463 -19.4132 -19.4132 10.6567 10.6567 11.5844 11.5844 11.6757 11.6757 11.8022 11.8022 12.2188 12.2188 13.0397 13.0397 13.4337 13.4337 13.6995 13.6995 13.7548 13.7548 13.7843 13.7843 13.9195 13.9195 14.0397 14.0397 14.1866 14.1866 14.2221 14.2221 14.6655 14.6655 14.7144 14.7144 14.7898 14.7898 14.8067 14.8067 15.1597 15.1597 15.4283 15.4283 15.4807 15.4807 15.9967 15.9967 16.0229 16.0229 16.1272 16.1272 17.5424 17.5424 17.5990 17.5990 18.4194 18.4194 19.2443 19.2443 k = 0.2903 0.6621-0.0000 ( 2796 PWs) bands (ev): -57.7692 -57.7692 -29.1868 -29.1868 -19.4454 -19.4454 -19.4135 -19.4135 10.7410 10.7410 11.5718 11.5718 11.6644 11.6644 11.7696 11.7696 12.1860 12.1860 13.0013 13.0013 13.4292 13.4292 13.6899 13.6899 13.7515 13.7515 13.7862 13.7862 13.9135 13.9135 14.0268 14.0268 14.1617 14.1617 14.1971 14.1971 14.6752 14.6752 14.7228 14.7228 14.8092 14.8092 14.8159 14.8159 15.1682 15.1682 15.4628 15.4628 15.5129 15.5129 15.9966 15.9966 16.0259 16.0259 16.1312 16.1312 17.5713 17.5713 17.5742 17.5742 18.3867 18.3867 19.1879 19.1879 k = 0.2959 0.6748-0.0000 ( 2796 PWs) bands (ev): -57.7692 -57.7692 -29.1867 -29.1867 -19.4444 -19.4444 -19.4138 -19.4138 10.8209 10.8209 11.5600 11.5600 11.6529 11.6529 11.7373 11.7373 12.1517 12.1517 12.9630 12.9630 13.4221 13.4221 13.6762 13.6762 13.7459 13.7459 13.7858 13.7858 13.9101 13.9101 14.0162 14.0162 14.1375 14.1375 14.1728 14.1728 14.6856 14.6856 14.7317 14.7317 14.8258 14.8258 14.8326 14.8326 15.1793 15.1793 15.4973 15.4973 15.5446 15.5446 15.9988 15.9988 16.0292 16.0292 16.1367 16.1367 17.5349 17.5349 17.6011 17.6011 18.3711 18.3711 19.1342 19.1342 k = 0.3015 0.6876-0.0000 ( 2796 PWs) bands (ev): -57.7692 -57.7692 -29.1865 -29.1865 -19.4434 -19.4434 -19.4141 -19.4141 10.8960 10.8960 11.5489 11.5489 11.6399 11.6399 11.7063 11.7063 12.1157 12.1157 12.9248 12.9248 13.4127 13.4127 13.6587 13.6587 13.7377 13.7377 13.7827 13.7827 13.9095 13.9095 14.0081 14.0081 14.1149 14.1149 14.1497 14.1497 14.6964 14.6964 14.7411 14.7411 14.8376 14.8376 14.8579 14.8579 15.1942 15.1942 15.5315 15.5315 15.5756 15.5756 16.0032 16.0032 16.0326 16.0326 16.1435 16.1435 17.4836 17.4836 17.6314 17.6314 18.3693 18.3693 19.0831 19.0831 k = 0.3070 0.7003-0.0000 ( 2796 PWs) bands (ev): -57.7692 -57.7692 -29.1863 -29.1863 -19.4422 -19.4422 -19.4144 -19.4144 10.9657 10.9657 11.5387 11.5387 11.6226 11.6226 11.6797 11.6797 12.0782 12.0782 12.8870 12.8870 13.4014 13.4014 13.6374 13.6374 13.7261 13.7261 13.7765 13.7765 13.9117 13.9117 14.0027 14.0027 14.0949 14.0949 14.1285 14.1285 14.7075 14.7075 14.7511 14.7511 14.8502 14.8502 14.8850 14.8850 15.2141 15.2141 15.5652 15.5652 15.6058 15.6058 16.0096 16.0096 16.0359 16.0359 16.1516 16.1516 17.4238 17.4238 17.6622 17.6622 18.3776 18.3776 19.0351 19.0351 k = 0.3126 0.7130-0.0000 ( 2796 PWs) bands (ev): -57.7693 -57.7693 -29.1862 -29.1862 -19.4409 -19.4409 -19.4148 -19.4148 11.0299 11.0299 11.5292 11.5292 11.5978 11.5978 11.6607 11.6607 12.0393 12.0393 12.8494 12.8494 13.3885 13.3885 13.6127 13.6127 13.7109 13.7109 13.7666 13.7666 13.9164 13.9164 13.9999 13.9999 14.0783 14.0783 14.1100 14.1100 14.7191 14.7191 14.7615 14.7615 14.8636 14.8636 14.9123 14.9123 15.2407 15.2407 15.5983 15.5983 15.6353 15.6353 16.0178 16.0178 16.0389 16.0389 16.1611 16.1611 17.3583 17.3583 17.6931 17.6931 18.3920 18.3920 18.9906 18.9906 k = 0.3182 0.7257-0.0000 ( 2788 PWs) bands (ev): -57.7693 -57.7693 -29.1859 -29.1859 -19.4395 -19.4395 -19.4151 -19.4151 11.0882 11.0882 11.5205 11.5205 11.5660 11.5660 11.6487 11.6487 11.9992 11.9992 12.8123 12.8123 13.3746 13.3746 13.5849 13.5849 13.6917 13.6917 13.7529 13.7529 13.9236 13.9236 13.9995 13.9995 14.0658 14.0658 14.0945 14.0945 14.7310 14.7310 14.7724 14.7724 14.8775 14.8775 14.9385 14.9385 15.2754 15.2754 15.6307 15.6307 15.6637 15.6637 16.0279 16.0279 16.0412 16.0412 16.1719 16.1719 17.2897 17.2897 17.7239 17.7239 18.4094 18.4094 18.9502 18.9502 k = 0.3238 0.7385-0.0000 ( 2804 PWs) bands (ev): -57.7693 -57.7693 -29.1858 -29.1858 -19.4381 -19.4381 -19.4155 -19.4155 11.1401 11.1401 11.5126 11.5126 11.5305 11.5305 11.6407 11.6407 11.9581 11.9581 12.7757 12.7757 13.3600 13.3600 13.5546 13.5546 13.6685 13.6685 13.7357 13.7357 13.9331 13.9331 14.0009 14.0009 14.0575 14.0575 14.0825 14.0825 14.7433 14.7433 14.7839 14.7839 14.8918 14.8918 14.9621 14.9621 15.3197 15.3197 15.6621 15.6621 15.6912 15.6912 16.0395 16.0395 16.0427 16.0427 16.1838 16.1838 17.2195 17.2195 17.7545 17.7545 18.4267 18.4267 18.9147 18.9147 k = 0.3294 0.7512-0.0000 ( 2804 PWs) bands (ev): -57.7694 -57.7694 -29.1855 -29.1855 -19.4366 -19.4366 -19.4159 -19.4159 11.1852 11.1852 11.4930 11.4930 11.5056 11.5056 11.6350 11.6350 11.9165 11.9165 12.7397 12.7397 13.3450 13.3450 13.5222 13.5222 13.6415 13.6415 13.7155 13.7155 13.9445 13.9445 14.0040 14.0040 14.0533 14.0533 14.0738 14.0738 14.7560 14.7560 14.7959 14.7959 14.9064 14.9064 14.9824 14.9824 15.3741 15.3741 15.6926 15.6926 15.7175 15.7175 16.0434 16.0434 16.0526 16.0526 16.1966 16.1966 17.1489 17.1489 17.7845 17.7845 18.4416 18.4416 18.8851 18.8851 k = 0.3350 0.7639-0.0000 ( 2804 PWs) bands (ev): -57.7694 -57.7694 -29.1853 -29.1853 -19.4349 -19.4349 -19.4162 -19.4162 11.2232 11.2232 11.4543 11.4543 11.4996 11.4996 11.6308 11.6308 11.8750 11.8750 12.7043 12.7043 13.3301 13.3301 13.4881 13.4881 13.6109 13.6109 13.6931 13.6931 13.9578 13.9578 14.0083 14.0083 14.0530 14.0530 14.0683 14.0683 14.7692 14.7692 14.8086 14.8086 14.9211 14.9211 14.9995 14.9995 15.4381 15.4381 15.7221 15.7221 15.7427 15.7427 16.0430 16.0430 16.0672 16.0672 16.2102 16.2102 17.0787 17.0787 17.8139 17.8139 18.4519 18.4519 18.8627 18.8627 k = 0.3405 0.7767-0.0000 ( 2796 PWs) bands (ev): -57.7695 -57.7695 -29.1850 -29.1850 -19.4332 -19.4332 -19.4166 -19.4166 11.2535 11.2535 11.4150 11.4150 11.4946 11.4946 11.6277 11.6277 11.8342 11.8342 12.6697 12.6697 13.3153 13.3153 13.4526 13.4526 13.5775 13.5775 13.6693 13.6693 13.9726 13.9726 14.0135 14.0135 14.0561 14.0561 14.0655 14.0655 14.7828 14.7828 14.8218 14.8218 14.9358 14.9358 15.0136 15.0136 15.5108 15.5108 15.7508 15.7508 15.7667 15.7667 16.0417 16.0417 16.0832 16.0832 16.2242 16.2242 17.0094 17.0094 17.8424 17.8424 18.4560 18.4560 18.8483 18.8483 k = 0.3461 0.7894-0.0000 ( 2784 PWs) bands (ev): -57.7695 -57.7695 -29.1848 -29.1848 -19.4314 -19.4314 -19.4170 -19.4170 11.2753 11.2753 11.3753 11.3753 11.4906 11.4906 11.6256 11.6256 11.7953 11.7953 12.6360 12.6360 13.3009 13.3009 13.4160 13.4160 13.5417 13.5417 13.6448 13.6448 13.9889 13.9889 14.0194 14.0194 14.0619 14.0619 14.0653 14.0653 14.7970 14.7970 14.8358 14.8358 14.9505 14.9505 15.0255 15.0255 15.5903 15.5903 15.7791 15.7791 15.7893 15.7893 16.0394 16.0394 16.1007 16.1007 16.2384 16.2384 16.9412 16.9412 17.8698 17.8698 18.4533 18.4533 18.8421 18.8421 k = 0.3461 0.7894-0.0000 ( 2784 PWs) bands (ev): -57.7695 -57.7695 -29.1848 -29.1848 -19.4314 -19.4314 -19.4170 -19.4170 11.2753 11.2753 11.3753 11.3753 11.4906 11.4906 11.6256 11.6256 11.7953 11.7953 12.6360 12.6360 13.3009 13.3009 13.4160 13.4160 13.5417 13.5417 13.6448 13.6448 13.9889 13.9889 14.0194 14.0194 14.0619 14.0619 14.0653 14.0653 14.7970 14.7970 14.8358 14.8358 14.9505 14.9505 15.0255 15.0255 15.5903 15.5903 15.7791 15.7791 15.7893 15.7893 16.0394 16.0394 16.1007 16.1007 16.2384 16.2384 16.9412 16.9412 17.8698 17.8698 18.4533 18.4533 18.8421 18.8421 k = 0.3439 0.7843 0.0127 ( 2790 PWs) bands (ev): -57.7695 -57.7695 -29.1849 -29.1849 -19.4322 -19.4322 -19.4168 -19.4168 11.2680 11.2680 11.3804 11.3804 11.4967 11.4967 11.6258 11.6258 11.8162 11.8162 12.6496 12.6496 13.3022 13.3022 13.4323 13.4323 13.5555 13.5555 13.6580 13.6580 13.9816 13.9816 14.0170 14.0170 14.0547 14.0547 14.0731 14.0731 14.7893 14.7893 14.8280 14.8280 14.9476 14.9476 15.0223 15.0223 15.5508 15.5508 15.7680 15.7680 15.7822 15.7822 16.0399 16.0399 16.0937 16.0937 16.2337 16.2337 16.9705 16.9705 17.8592 17.8592 18.4505 18.4505 18.8288 18.8288 k = 0.3417 0.7792 0.0254 ( 2800 PWs) bands (ev): -57.7695 -57.7695 -29.1850 -29.1850 -19.4329 -19.4329 -19.4167 -19.4167 11.2603 11.2603 11.3668 11.3668 11.5080 11.5080 11.6297 11.6297 11.8458 11.8458 12.6637 12.6637 13.2964 13.2964 13.4494 13.4494 13.5675 13.5675 13.6777 13.6777 13.9736 13.9736 14.0132 14.0132 14.0511 14.0511 14.0864 14.0864 14.7776 14.7776 14.8174 14.8174 14.9494 14.9494 15.0212 15.0212 15.5020 15.5020 15.7564 15.7564 15.7772 15.7772 16.0390 16.0390 16.0873 16.0873 16.2305 16.2305 17.0039 17.0039 17.8490 17.8490 18.4381 18.4381 18.8188 18.8188 k = 0.3394 0.7741 0.0381 ( 2798 PWs) bands (ev): -57.7695 -57.7695 -29.1851 -29.1851 -19.4336 -19.4336 -19.4165 -19.4165 11.2518 11.2518 11.3428 11.3428 11.5155 11.5155 11.6422 11.6422 11.8804 11.8804 12.6782 12.6782 13.2860 13.2860 13.4645 13.4645 13.5791 13.5791 13.7026 13.7026 13.9652 13.9652 14.0065 14.0065 14.0535 14.0535 14.1037 14.1037 14.7621 14.7621 14.8061 14.8061 14.9535 14.9535 15.0217 15.0217 15.4490 15.4490 15.7429 15.7429 15.7726 15.7726 16.0366 16.0366 16.0816 16.0816 16.2286 16.2286 17.0403 17.0403 17.8394 17.8394 18.4181 18.4181 18.8132 18.8132 k = 0.3372 0.7690 0.0508 ( 2802 PWs) bands (ev): -57.7694 -57.7694 -29.1852 -29.1852 -19.4343 -19.4343 -19.4163 -19.4163 11.2417 11.2417 11.3146 11.3146 11.5167 11.5167 11.6622 11.6622 11.9183 11.9183 12.6931 12.6931 13.2729 13.2729 13.4757 13.4757 13.5911 13.5911 13.7314 13.7314 13.9570 13.9570 13.9978 13.9978 14.0607 14.0607 14.1249 14.1249 14.7436 14.7436 14.7953 14.7953 14.9576 14.9576 15.0230 15.0230 15.3960 15.3960 15.7277 15.7277 15.7667 15.7667 16.0324 16.0324 16.0767 16.0767 16.2278 16.2278 17.0788 17.0788 17.8305 17.8305 18.3930 18.3930 18.8098 18.8098 k = 0.3349 0.7639 0.0635 ( 2792 PWs) bands (ev): -57.7694 -57.7694 -29.1853 -29.1853 -19.4349 -19.4349 -19.4161 -19.4161 11.2278 11.2278 11.2872 11.2872 11.5143 11.5143 11.6859 11.6859 11.9583 11.9583 12.7084 12.7084 13.2581 13.2581 13.4827 13.4827 13.6035 13.6035 13.7628 13.7628 13.9495 13.9495 13.9889 13.9889 14.0707 14.0707 14.1496 14.1496 14.7233 14.7233 14.7849 14.7849 14.9598 14.9598 15.0238 15.0238 15.3468 15.3468 15.7107 15.7107 15.7584 15.7584 16.0264 16.0264 16.0727 16.0727 16.2277 16.2277 17.1184 17.1184 17.8225 17.8225 18.3653 18.3653 18.8067 18.8067 k = 0.3327 0.7588 0.0762 ( 2792 PWs) bands (ev): -57.7694 -57.7694 -29.1854 -29.1854 -19.4356 -19.4356 -19.4159 -19.4159 11.2067 11.2067 11.2653 11.2653 11.5108 11.5108 11.7099 11.7099 12.0000 12.0000 12.7240 12.7240 13.2423 13.2423 13.4862 13.4862 13.6158 13.6158 13.7954 13.7954 13.9429 13.9429 13.9809 13.9809 14.0826 14.0826 14.1776 14.1776 14.7022 14.7022 14.7748 14.7748 14.9578 14.9578 15.0228 15.0228 15.3050 15.3050 15.6922 15.6922 15.7474 15.7474 16.0187 16.0187 16.0697 16.0697 16.2282 16.2282 17.1583 17.1583 17.8157 17.8157 18.3365 18.3365 18.8029 18.8029 k = 0.3305 0.7537 0.0889 ( 2792 PWs) bands (ev): -57.7694 -57.7694 -29.1854 -29.1854 -19.4362 -19.4362 -19.4158 -19.4158 11.1780 11.1780 11.2504 11.2504 11.5075 11.5075 11.7324 11.7324 12.0430 12.0430 12.7398 12.7398 13.2261 13.2261 13.4869 13.4869 13.6275 13.6275 13.8272 13.8272 13.9377 13.9377 13.9755 13.9755 14.0956 14.0956 14.2082 14.2082 14.6811 14.6811 14.7648 14.7648 14.9483 14.9483 15.0201 15.0201 15.2741 15.2741 15.6722 15.6722 15.7338 15.7338 16.0096 16.0096 16.0674 16.0674 16.2292 16.2292 17.1974 17.1974 17.8103 17.8103 18.3079 18.3079 18.7979 18.7979 k = 0.3282 0.7486 0.1016 ( 2791 PWs) bands (ev): -57.7694 -57.7694 -29.1855 -29.1855 -19.4368 -19.4368 -19.4156 -19.4156 11.1450 11.1450 11.2398 11.2398 11.5051 11.5051 11.7527 11.7527 12.0869 12.0869 12.7559 12.7559 13.2099 13.2099 13.4858 13.4858 13.6382 13.6382 13.8547 13.8547 13.9339 13.9339 13.9754 13.9754 14.1094 14.1094 14.2406 14.2406 14.6604 14.6604 14.7550 14.7550 14.9277 14.9277 15.0177 15.0177 15.2558 15.2558 15.6509 15.6509 15.7180 15.7180 15.9993 15.9993 16.0657 16.0657 16.2303 16.2303 17.2347 17.2347 17.8064 17.8064 18.2807 18.2807 18.7915 18.7915 k = 0.3260 0.7435 0.1143 ( 2789 PWs) bands (ev): -57.7694 -57.7694 -29.1856 -29.1856 -19.4375 -19.4375 -19.4154 -19.4154 11.1106 11.1106 11.2311 11.2311 11.5038 11.5038 11.7706 11.7706 12.1312 12.1312 12.7722 12.7722 13.1940 13.1940 13.4833 13.4833 13.6479 13.6479 13.8732 13.8732 13.9309 13.9309 13.9856 13.9856 14.1239 14.1239 14.2741 14.2741 14.6404 14.6404 14.7453 14.7453 14.8957 14.8957 15.0171 15.0171 15.2487 15.2487 15.6285 15.6285 15.7006 15.7006 15.9881 15.9881 16.0643 16.0643 16.2314 16.2314 17.2692 17.2692 17.8045 17.8045 18.2555 18.2555 18.7841 18.7841 k = 0.3238 0.7384 0.1270 ( 2791 PWs) bands (ev): -57.7693 -57.7693 -29.1857 -29.1857 -19.4381 -19.4381 -19.4152 -19.4152 11.0763 11.0763 11.2234 11.2234 11.5035 11.5035 11.7861 11.7861 12.1757 12.1757 12.7888 12.7888 13.1786 13.1786 13.4799 13.4799 13.6568 13.6568 13.8812 13.8812 13.9279 13.9279 14.0075 14.0075 14.1391 14.1391 14.3079 14.3079 14.6213 14.6213 14.7357 14.7357 14.8557 14.8557 15.0182 15.0182 15.2497 15.2497 15.6051 15.6051 15.6823 15.6823 15.9762 15.9762 16.0630 16.0630 16.2323 16.2323 17.3000 17.3000 17.8047 17.8047 18.2331 18.2331 18.7757 18.7757 k = 0.3215 0.7333 0.1397 ( 2793 PWs) bands (ev): -57.7693 -57.7693 -29.1858 -29.1858 -19.4387 -19.4387 -19.4150 -19.4150 11.0428 11.0428 11.2162 11.2162 11.5042 11.5042 11.7991 11.7991 12.2199 12.2199 12.8056 12.8056 13.1640 13.1640 13.4760 13.4760 13.6650 13.6650 13.8823 13.8823 13.9249 13.9249 14.0367 14.0367 14.1552 14.1552 14.3411 14.3411 14.6035 14.6035 14.7261 14.7261 14.8119 14.8119 15.0201 15.0201 15.2553 15.2553 15.5808 15.5808 15.6638 15.6638 15.9638 15.9638 16.0617 16.0617 16.2328 16.2328 17.3263 17.3263 17.8068 17.8068 18.2142 18.2142 18.7667 18.7667 k = 0.3193 0.7282 0.1524 ( 2791 PWs) bands (ev): -57.7693 -57.7693 -29.1859 -29.1859 -19.4393 -19.4393 -19.4148 -19.4148 11.0106 11.0106 11.2094 11.2094 11.5058 11.5058 11.8099 11.8099 12.2634 12.2634 12.8227 12.8227 13.1504 13.1504 13.4719 13.4719 13.6728 13.6728 13.8797 13.8797 13.9228 13.9228 14.0678 14.0678 14.1726 14.1726 14.3727 14.3727 14.5872 14.5872 14.7156 14.7156 14.7682 14.7682 15.0224 15.0224 15.2630 15.2630 15.5560 15.5560 15.6461 15.6461 15.9510 15.9510 16.0603 16.0603 16.2330 16.2330 17.3476 17.3476 17.8107 17.8107 18.1995 18.1995 18.7572 18.7572 k = 0.3171 0.7231 0.1651 ( 2789 PWs) bands (ev): -57.7693 -57.7693 -29.1859 -29.1859 -19.4398 -19.4398 -19.4146 -19.4146 10.9800 10.9800 11.2029 11.2029 11.5080 11.5080 11.8187 11.8187 12.3058 12.3058 12.8401 12.8401 13.1381 13.1381 13.4678 13.4678 13.6804 13.6804 13.8753 13.8753 13.9218 13.9218 14.0972 14.0972 14.1922 14.1922 14.4013 14.4013 14.5726 14.5726 14.6987 14.6987 14.7323 14.7323 15.0245 15.0245 15.2708 15.2708 15.5308 15.5308 15.6300 15.6300 15.9379 15.9379 16.0588 16.0588 16.2325 16.2325 17.3639 17.3639 17.8159 17.8159 18.1894 18.1894 18.7474 18.7474 k = 0.3148 0.7180 0.1778 ( 2789 PWs) bands (ev): -57.7693 -57.7693 -29.1860 -29.1860 -19.4404 -19.4404 -19.4144 -19.4144 10.9514 10.9514 11.1967 11.1967 11.5107 11.5107 11.8255 11.8255 12.3467 12.3467 12.8580 12.8580 13.1273 13.1273 13.4641 13.4641 13.6878 13.6878 13.8700 13.8700 13.9220 13.9220 14.1229 14.1229 14.2143 14.2143 14.4251 14.4251 14.5604 14.5604 14.6668 14.6668 14.7153 14.7153 15.0263 15.0263 15.2772 15.2772 15.5056 15.5056 15.6166 15.6166 15.9247 15.9247 16.0571 16.0571 16.2315 16.2315 17.3752 17.3752 17.8215 17.8215 18.1843 18.1843 18.7375 18.7375 k = 0.3126 0.7129 0.1904 ( 2791 PWs) bands (ev): -57.7693 -57.7693 -29.1861 -29.1861 -19.4409 -19.4409 -19.4142 -19.4142 10.9248 10.9248 11.1908 11.1908 11.5136 11.5136 11.8304 11.8304 12.3857 12.3857 12.8763 12.8763 13.1183 13.1183 13.4609 13.4609 13.6952 13.6952 13.8644 13.8644 13.9233 13.9233 14.1439 14.1439 14.2387 14.2387 14.4417 14.4417 14.5504 14.5504 14.6317 14.6317 14.7078 14.7078 15.0274 15.0274 15.2811 15.2811 15.4808 15.4808 15.6065 15.6065 15.9114 15.9114 16.0552 16.0552 16.2298 16.2298 17.3823 17.3823 17.8270 17.8270 18.1844 18.1844 18.7276 18.7276 k = 0.3104 0.7078 0.2031 ( 2791 PWs) bands (ev): -57.7693 -57.7693 -29.1861 -29.1861 -19.4414 -19.4414 -19.4140 -19.4140 10.9004 10.9004 11.1853 11.1853 11.5166 11.5166 11.8337 11.8337 12.4224 12.4224 12.8954 12.8954 13.1112 13.1112 13.4584 13.4584 13.7027 13.7027 13.8586 13.8586 13.9256 13.9256 14.1607 14.1607 14.2638 14.2638 14.4487 14.4487 14.5406 14.5406 14.6047 14.6047 14.7038 14.7038 15.0276 15.0276 15.2815 15.2815 15.4567 15.4567 15.6003 15.6003 15.8982 15.8982 16.0532 16.0532 16.2274 16.2274 17.3859 17.3859 17.8317 17.8317 18.1892 18.1892 18.7179 18.7179 k = 0.3081 0.7027 0.2158 ( 2793 PWs) bands (ev): -57.7693 -57.7693 -29.1862 -29.1862 -19.4419 -19.4419 -19.4139 -19.4139 10.8784 10.8784 11.1802 11.1802 11.5195 11.5195 11.8354 11.8354 12.4562 12.4562 12.9153 12.9153 13.1063 13.1063 13.4569 13.4569 13.7103 13.7103 13.8529 13.8529 13.9288 13.9288 14.1741 14.1741 14.2876 14.2876 14.4457 14.4457 14.5264 14.5264 14.5919 14.5919 14.7026 14.7026 15.0265 15.0265 15.2781 15.2781 15.4340 15.4340 15.5983 15.5983 15.8853 15.8853 16.0511 16.0511 16.2244 16.2244 17.3869 17.3869 17.8355 17.8355 18.1982 18.1982 18.7085 18.7085 k = 0.3059 0.6976 0.2285 ( 2789 PWs) bands (ev): -57.7692 -57.7692 -29.1863 -29.1863 -19.4424 -19.4424 -19.4137 -19.4137 10.8589 10.8589 11.1755 11.1755 11.5221 11.5221 11.8355 11.8355 12.4869 12.4869 12.9365 12.9365 13.1038 13.1038 13.4564 13.4564 13.7181 13.7181 13.8475 13.8475 13.9327 13.9327 14.1850 14.1850 14.3076 14.3076 14.4353 14.4353 14.5093 14.5093 14.5903 14.5903 14.7040 14.7040 15.0238 15.0238 15.2707 15.2707 15.4132 15.4132 15.6000 15.6000 15.8729 15.8729 16.0491 16.0491 16.2206 16.2206 17.3861 17.3861 17.8382 17.8382 18.2104 18.2104 18.6994 18.6994 k = 0.3036 0.6925 0.2412 ( 2789 PWs) bands (ev): -57.7692 -57.7692 -29.1863 -29.1863 -19.4429 -19.4429 -19.4135 -19.4135 10.8419 10.8419 11.1712 11.1712 11.5241 11.5241 11.8342 11.8342 12.5138 12.5138 12.9592 12.9592 13.1038 13.1038 13.4572 13.4572 13.7260 13.7260 13.8425 13.8425 13.9373 13.9373 14.1939 14.1939 14.3207 14.3207 14.4228 14.4228 14.4943 14.4943 14.5920 14.5920 14.7077 14.7077 15.0193 15.0193 15.2596 15.2596 15.3952 15.3952 15.6048 15.6048 15.8612 15.8612 16.0473 16.0473 16.2162 16.2162 17.3845 17.3845 17.8403 17.8403 18.2246 18.2246 18.6907 18.6907 k = 0.3014 0.6874 0.2539 ( 2793 PWs) bands (ev): -57.7692 -57.7692 -29.1864 -29.1864 -19.4433 -19.4433 -19.4134 -19.4134 10.8276 10.8276 11.1675 11.1675 11.5255 11.5255 11.8314 11.8314 12.5368 12.5368 12.9838 12.9838 13.1064 13.1064 13.4593 13.4593 13.7340 13.7340 13.8379 13.8379 13.9423 13.9423 14.2010 14.2010 14.3231 14.3231 14.4145 14.4145 14.4825 14.4825 14.5932 14.5932 14.7128 14.7128 15.0128 15.0128 15.2451 15.2451 15.3804 15.3804 15.6118 15.6118 15.8506 15.8506 16.0456 16.0456 16.2110 16.2110 17.3828 17.3828 17.8420 17.8420 18.2400 18.2400 18.6825 18.6825 k = 0.2992 0.6823 0.2666 ( 2793 PWs) bands (ev): -57.7692 -57.7692 -29.1865 -29.1865 -19.4438 -19.4438 -19.4132 -19.4132 10.8159 10.8159 11.1642 11.1642 11.5261 11.5261 11.8273 11.8273 12.5557 12.5557 13.0103 13.0103 13.1116 13.1116 13.4627 13.4627 13.7418 13.7418 13.8340 13.8340 13.9477 13.9477 14.2065 14.2065 14.3147 14.3147 14.4130 14.4130 14.4734 14.4734 14.5928 14.5928 14.7181 14.7181 15.0043 15.0043 15.2279 15.2279 15.3691 15.3691 15.6199 15.6199 15.8413 15.8413 16.0443 16.0443 16.2053 16.2053 17.3818 17.3818 17.8437 17.8437 18.2554 18.2554 18.6748 18.6748 k = 0.2969 0.6772 0.2793 ( 2798 PWs) bands (ev): -57.7692 -57.7692 -29.1865 -29.1865 -19.4442 -19.4442 -19.4131 -19.4131 10.8070 10.8070 11.1615 11.1615 11.5257 11.5257 11.8218 11.8218 12.5705 12.5705 13.0390 13.0390 13.1194 13.1194 13.4677 13.4677 13.7493 13.7493 13.8310 13.8310 13.9535 13.9535 14.2099 14.2099 14.3004 14.3004 14.4147 14.4147 14.4663 14.4663 14.5907 14.5907 14.7224 14.7224 14.9937 14.9937 15.2084 15.2084 15.3614 15.3614 15.6284 15.6284 15.8338 15.8338 16.0434 16.0434 16.1988 16.1988 17.3820 17.3820 17.8457 17.8457 18.2701 18.2701 18.6675 18.6675 k = 0.2947 0.6721 0.2920 ( 2792 PWs) bands (ev): -57.7692 -57.7692 -29.1866 -29.1866 -19.4446 -19.4446 -19.4130 -19.4130 10.8009 10.8009 11.1593 11.1593 11.5243 11.5243 11.8151 11.8151 12.5813 12.5813 13.0698 13.0698 13.1297 13.1297 13.4741 13.4741 13.7560 13.7560 13.8292 13.8292 13.9595 13.9595 14.2107 14.2107 14.2856 14.2856 14.4157 14.4157 14.4610 14.4610 14.5874 14.5874 14.7247 14.7247 14.9813 14.9813 15.1874 15.1874 15.3568 15.3568 15.6365 15.6365 15.8282 15.8282 16.0431 16.0431 16.1918 16.1918 17.3841 17.3841 17.8482 17.8482 18.2835 18.2835 18.6608 18.6608 k = 0.2925 0.6671 0.3047 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1866 -29.1866 -19.4450 -19.4450 -19.4128 -19.4128 10.7975 10.7975 11.1577 11.1577 11.5217 11.5217 11.8070 11.8070 12.5886 12.5886 13.1022 13.1022 13.1428 13.1428 13.4819 13.4819 13.7614 13.7614 13.8293 13.8293 13.9657 13.9657 14.2081 14.2081 14.2736 14.2736 14.4144 14.4144 14.4567 14.4567 14.5831 14.5831 14.7245 14.7245 14.9673 14.9673 15.1654 15.1654 15.3546 15.3546 15.6436 15.6436 15.8248 15.8248 16.0433 16.0433 16.1843 16.1843 17.3886 17.3886 17.8513 17.8513 18.2951 18.2951 18.6545 18.6545 k = 0.2902 0.6620 0.3174 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1867 -29.1867 -19.4453 -19.4453 -19.4127 -19.4127 10.7970 10.7970 11.1566 11.1566 11.5179 11.5179 11.7978 11.7978 12.5928 12.5928 13.1345 13.1345 13.1599 13.1599 13.4912 13.4912 13.7648 13.7648 13.8316 13.8316 13.9720 13.9720 14.2018 14.2018 14.2659 14.2659 14.4105 14.4105 14.4526 14.4526 14.5780 14.5780 14.7213 14.7213 14.9520 14.9520 15.1428 15.1428 15.3544 15.3544 15.6497 15.6497 15.8237 15.8237 16.0441 16.0441 16.1762 16.1762 17.3957 17.3957 17.8551 17.8551 18.3046 18.3046 18.6485 18.6485 k = 0.2880 0.6569 0.3301 ( 2793 PWs) bands (ev): -57.7692 -57.7692 -29.1867 -29.1867 -19.4457 -19.4457 -19.4126 -19.4126 10.7994 10.7994 11.1561 11.1561 11.5129 11.5129 11.7873 11.7873 12.5945 12.5945 13.1614 13.1614 13.1859 13.1859 13.5019 13.5019 13.7661 13.7661 13.8364 13.8364 13.9784 13.9784 14.1928 14.1928 14.2618 14.2618 14.4042 14.4042 14.4482 14.4482 14.5722 14.5722 14.7151 14.7151 14.9355 14.9355 15.1198 15.1198 15.3554 15.3554 15.6547 15.6547 15.8247 15.8247 16.0454 16.0454 16.1676 16.1676 17.4060 17.4060 17.8598 17.8598 18.3118 18.3118 18.6427 18.6427 k = 0.2858 0.6518 0.3428 ( 2785 PWs) bands (ev): -57.7692 -57.7692 -29.1867 -29.1867 -19.4460 -19.4460 -19.4125 -19.4125 10.8045 10.8045 11.1562 11.1562 11.5067 11.5067 11.7756 11.7756 12.5940 12.5940 13.1819 13.1819 13.2212 13.2212 13.5139 13.5139 13.7653 13.7653 13.8436 13.8436 13.9848 13.9848 14.1827 14.1827 14.2597 14.2597 14.3954 14.3954 14.4437 14.4437 14.5659 14.5659 14.7061 14.7061 14.9181 14.9181 15.0966 15.0966 15.3571 15.3571 15.6588 15.6588 15.8275 15.8275 16.0471 16.0471 16.1587 16.1587 17.4195 17.4195 17.8653 17.8653 18.3165 18.3165 18.6369 18.6369 k = 0.2835 0.6467 0.3555 ( 2781 PWs) bands (ev): -57.7692 -57.7692 -29.1868 -29.1868 -19.4463 -19.4463 -19.4124 -19.4124 10.8125 10.8125 11.1569 11.1569 11.4992 11.4992 11.7627 11.7627 12.5919 12.5919 13.2014 13.2014 13.2602 13.2602 13.5272 13.5272 13.7628 13.7628 13.8527 13.8527 13.9912 13.9912 14.1729 14.1729 14.2583 14.2583 14.3838 14.3838 14.4393 14.4393 14.5589 14.5589 14.6947 14.6947 14.9000 14.9000 15.0732 15.0732 15.3591 15.3591 15.6626 15.6626 15.8315 15.8315 16.0492 16.0492 16.1494 16.1494 17.4364 17.4364 17.8717 17.8717 18.3189 18.3189 18.6308 18.6308 k = 0.2813 0.6416 0.3682 ( 2781 PWs) bands (ev): -57.7691 -57.7691 -29.1868 -29.1868 -19.4466 -19.4466 -19.4123 -19.4123 10.8233 10.8233 11.1582 11.1582 11.4905 11.4905 11.7485 11.7485 12.5885 12.5885 13.2213 13.2213 13.3009 13.3009 13.5415 13.5415 13.7591 13.7591 13.8632 13.8632 13.9976 13.9976 14.1640 14.1640 14.2567 14.2567 14.3692 14.3692 14.4357 14.4357 14.5512 14.5512 14.6813 14.6813 14.8813 14.8813 15.0498 15.0498 15.3610 15.3610 15.6664 15.6664 15.8363 15.8363 16.0515 16.0515 16.1399 16.1399 17.4566 17.4566 17.8789 17.8789 18.3191 18.3191 18.6241 18.6241 k = 0.2791 0.6365 0.3809 ( 2790 PWs) bands (ev): -57.7691 -57.7691 -29.1869 -29.1869 -19.4469 -19.4469 -19.4123 -19.4123 10.8367 10.8367 11.1601 11.1601 11.4808 11.4808 11.7331 11.7331 12.5843 12.5843 13.2418 13.2418 13.3425 13.3425 13.5568 13.5568 13.7547 13.7547 13.8746 13.8746 14.0039 14.0039 14.1563 14.1563 14.2542 14.2542 14.3517 14.3517 14.4330 14.4330 14.5424 14.5424 14.6668 14.6668 14.8622 14.8622 15.0264 15.0264 15.3627 15.3627 15.6707 15.6707 15.8414 15.8414 16.0538 16.0538 16.1304 16.1304 17.4801 17.4801 17.8871 17.8871 18.3172 18.3172 18.6164 18.6164 k = 0.2768 0.6314 0.3936 ( 2791 PWs) bands (ev): -57.7691 -57.7691 -29.1869 -29.1869 -19.4471 -19.4471 -19.4122 -19.4122 10.8529 10.8529 11.1626 11.1626 11.4701 11.4701 11.7163 11.7163 12.5794 12.5794 13.2631 13.2631 13.3847 13.3847 13.5726 13.5726 13.7501 13.7501 13.8868 13.8868 14.0104 14.0104 14.1498 14.1498 14.2502 14.2502 14.3319 14.3319 14.4311 14.4311 14.5323 14.5323 14.6521 14.6521 14.8428 14.8428 15.0032 15.0032 15.3641 15.3641 15.6757 15.6757 15.8463 15.8463 16.0560 16.0560 16.1209 16.1209 17.5064 17.5064 17.8963 17.8963 18.3134 18.3134 18.6073 18.6073 k = 0.2746 0.6263 0.4063 ( 2789 PWs) bands (ev): -57.7691 -57.7691 -29.1869 -29.1869 -19.4473 -19.4473 -19.4122 -19.4122 10.8717 10.8717 11.1656 11.1656 11.4586 11.4586 11.6981 11.6981 12.5742 12.5742 13.2849 13.2849 13.4269 13.4269 13.5885 13.5885 13.7458 13.7458 13.8995 13.8995 14.0168 14.0168 14.1444 14.1444 14.2443 14.2443 14.3105 14.3105 14.4289 14.4289 14.5210 14.5210 14.6382 14.6382 14.8232 14.8232 14.9804 14.9804 15.3651 15.3651 15.6816 15.6816 15.8505 15.8505 16.0577 16.0577 16.1118 16.1118 17.5353 17.5353 17.9066 17.9066 18.3080 18.3080 18.5964 18.5964 k = 0.2724 0.6212 0.4190 ( 2787 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4475 -19.4475 -19.4121 -19.4121 10.8930 10.8930 11.1693 11.1693 11.4464 11.4464 11.6785 11.6785 12.5689 12.5689 13.3071 13.3071 13.4688 13.4688 13.6035 13.6035 13.7427 13.7427 13.9126 13.9126 14.0233 14.0233 14.1400 14.1400 14.2359 14.2359 14.2887 14.2887 14.4247 14.4247 14.5097 14.5097 14.6260 14.6260 14.8035 14.8035 14.9583 14.9583 15.3658 15.3658 15.6886 15.6886 15.8539 15.8539 16.0587 16.0587 16.1034 16.1034 17.5659 17.5659 17.9182 17.9182 18.3011 18.3011 18.5834 18.5834 k = 0.2701 0.6161 0.4317 ( 2785 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4477 -19.4477 -19.4121 -19.4121 10.9166 10.9166 11.1735 11.1735 11.4338 11.4338 11.6574 11.6574 12.5636 12.5636 13.3297 13.3297 13.5098 13.5098 13.6164 13.6164 13.7423 13.7423 13.9259 13.9259 14.0298 14.0298 14.1363 14.1363 14.2242 14.2242 14.2680 14.2680 14.4155 14.4155 14.5010 14.5010 14.6160 14.6160 14.7839 14.7839 14.9372 14.9372 15.3662 15.3662 15.6966 15.6966 15.8561 15.8561 16.0586 16.0586 16.0962 16.0962 17.5976 17.5976 17.9314 17.9314 18.2930 18.2930 18.5678 18.5678 k = 0.2679 0.6110 0.4444 ( 2789 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4479 -19.4479 -19.4121 -19.4121 10.9424 10.9424 11.1782 11.1782 11.4211 11.4211 11.6346 11.6346 12.5585 12.5585 13.3524 13.3524 13.5494 13.5494 13.6251 13.6251 13.7463 13.7463 13.9393 13.9393 14.0365 14.0365 14.1332 14.1332 14.2085 14.2085 14.2495 14.2495 14.3987 14.3987 14.4977 14.4977 14.6083 14.6083 14.7644 14.7644 14.9174 14.9174 15.3663 15.3663 15.7058 15.7058 15.8568 15.8568 16.0569 16.0569 16.0907 16.0907 17.6293 17.6293 17.9466 17.9466 18.2839 18.2839 18.5495 18.5495 k = 0.2656 0.6059 0.4571 ( 2789 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4480 -19.4480 -19.4120 -19.4120 10.9701 10.9701 11.1832 11.1832 11.4085 11.4085 11.6102 11.6102 12.5537 12.5537 13.3753 13.3753 13.5863 13.5863 13.6289 13.6289 13.7559 13.7559 13.9528 13.9528 14.0432 14.0432 14.1302 14.1302 14.1902 14.1902 14.2335 14.2335 14.3745 14.3745 14.5001 14.5001 14.6025 14.6025 14.7451 14.7451 14.8992 14.8992 15.3662 15.3662 15.7160 15.7160 15.8559 15.8559 16.0537 16.0537 16.0870 16.0870 17.6597 17.6597 17.9644 17.9644 18.2740 18.2740 18.5285 18.5285 k = 0.2634 0.6008 0.4698 ( 2795 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4482 -19.4482 -19.4120 -19.4120 10.9993 10.9993 11.1885 11.1885 11.3966 11.3966 11.5842 11.5842 12.5494 12.5494 13.3982 13.3982 13.6133 13.6133 13.6343 13.6343 13.7706 13.7706 13.9661 13.9661 14.0500 14.0500 14.1270 14.1270 14.1715 14.1715 14.2188 14.2188 14.3451 14.3451 14.5064 14.5064 14.5983 14.5983 14.7262 14.7262 14.8830 14.8830 15.3661 15.3661 15.7271 15.7271 15.8532 15.8532 16.0492 16.0492 16.0849 16.0849 17.6877 17.6877 17.9850 17.9850 18.2633 18.2633 18.5053 18.5053 k = 0.2612 0.5957 0.4825 ( 2791 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4483 -19.4483 -19.4120 -19.4120 11.0296 11.0296 11.1936 11.1936 11.3860 11.3860 11.5568 11.5568 12.5455 12.5455 13.4210 13.4210 13.6122 13.6122 13.6601 13.6601 13.7882 13.7882 13.9793 13.9793 14.0570 14.0570 14.1229 14.1229 14.1556 14.1556 14.2046 14.2046 14.3128 14.3128 14.5152 14.5152 14.5955 14.5955 14.7078 14.7078 14.8690 14.8690 15.3658 15.3658 15.7392 15.7392 15.8489 15.8489 16.0442 16.0442 16.0839 16.0839 17.7120 17.7120 18.0087 18.0087 18.2522 18.2522 18.4807 18.4807 k = 0.2589 0.5906 0.4952 ( 2793 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4484 -19.4484 -19.4120 -19.4120 11.0603 11.0603 11.1978 11.1978 11.3777 11.3777 11.5281 11.5281 12.5423 12.5423 13.4435 13.4435 13.6015 13.6015 13.6883 13.6883 13.8058 13.8058 13.9918 13.9918 14.0644 14.0644 14.1179 14.1179 14.1445 14.1445 14.1906 14.1906 14.2792 14.2792 14.5252 14.5252 14.5938 14.5938 14.6903 14.6903 14.8574 14.8574 15.3656 15.3656 15.7519 15.7519 15.8428 15.8428 16.0393 16.0393 16.0833 16.0833 17.7319 17.7319 18.0348 18.0348 18.2406 18.2406 18.4562 18.4562 k = 0.2567 0.5855 0.5079 ( 2793 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.0904 11.0904 11.1998 11.1998 11.3734 11.3734 11.4989 11.4989 12.5396 12.5396 13.4658 13.4658 13.5875 13.5875 13.7129 13.7129 13.8209 13.8209 14.0029 14.0029 14.0728 14.0728 14.1137 14.1137 14.1382 14.1382 14.1774 14.1774 14.2458 14.2458 14.5354 14.5354 14.5933 14.5933 14.6741 14.6741 14.8482 14.8482 15.3653 15.3653 15.7651 15.7651 15.8351 15.8351 16.0350 16.0350 16.0830 16.0830 17.7470 17.7470 18.0619 18.0619 18.2289 18.2289 18.4336 18.4336 k = 0.2545 0.5804 0.5206 ( 2794 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.1187 11.1187 11.1980 11.1980 11.3748 11.3748 11.4699 11.4699 12.5377 12.5377 13.4875 13.4875 13.5714 13.5714 13.7321 13.7321 13.8317 13.8317 14.0112 14.0112 14.0833 14.0833 14.1125 14.1125 14.1351 14.1351 14.1656 14.1656 14.2143 14.2143 14.5442 14.5442 14.5941 14.5941 14.6601 14.6601 14.8417 14.8417 15.3651 15.3651 15.7784 15.7784 15.8260 15.8260 16.0315 16.0315 16.0828 16.0828 17.7573 17.7573 18.0872 18.0872 18.2178 18.2178 18.4149 18.4149 k = 0.2522 0.5753 0.5333 ( 2790 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.1437 11.1437 11.1906 11.1906 11.3830 11.3830 11.4437 11.4437 12.5366 12.5366 13.5079 13.5079 13.5542 13.5542 13.7445 13.7445 13.8378 13.8378 14.0159 14.0159 14.0936 14.0936 14.1150 14.1150 14.1359 14.1359 14.1558 14.1558 14.1880 14.1880 14.5502 14.5502 14.5960 14.5960 14.6497 14.6497 14.8377 14.8377 15.3650 15.3650 15.7914 15.7914 15.8157 15.8157 16.0292 16.0292 16.0827 16.0827 17.7632 17.7632 18.1063 18.1063 18.2091 18.2091 18.4025 18.4025 k = 0.2500 0.5702 0.5459 ( 2784 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.1584 11.1584 11.1820 11.1820 11.3909 11.3909 11.4294 11.4294 12.5362 12.5362 13.5205 13.5205 13.5427 13.5427 13.7487 13.7487 13.8397 13.8397 14.0173 14.0173 14.0972 14.0972 14.1185 14.1185 14.1422 14.1422 14.1466 14.1466 14.1764 14.1764 14.5522 14.5522 14.5972 14.5972 14.6457 14.6457 14.8365 14.8365 15.3650 15.3650 15.8014 15.8014 15.8067 15.8067 16.0283 16.0283 16.0827 16.0827 17.7651 17.7651 18.1135 18.1135 18.2057 18.2057 18.3981 18.3981 k = 0.2500 0.5702 0.5459 ( 2784 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.1584 11.1584 11.1820 11.1820 11.3909 11.3909 11.4294 11.4294 12.5362 12.5362 13.5205 13.5205 13.5427 13.5427 13.7487 13.7487 13.8397 13.8397 14.0173 14.0173 14.0972 14.0972 14.1185 14.1185 14.1422 14.1422 14.1466 14.1466 14.1764 14.1764 14.5522 14.5522 14.5972 14.5972 14.6457 14.6457 14.8365 14.8365 15.3650 15.3650 15.8014 15.8014 15.8067 15.8067 16.0283 16.0283 16.0827 16.0827 17.7651 17.7651 18.1135 18.1135 18.2057 18.2057 18.3981 18.3981 k = 0.2411 0.5741 0.5362 ( 2790 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.1544 11.1544 11.1789 11.1789 11.3919 11.3919 11.4360 11.4360 12.5370 12.5370 13.5198 13.5198 13.5420 13.5420 13.7445 13.7445 13.8376 13.8376 14.0165 14.0165 14.0941 14.0941 14.1125 14.1125 14.1361 14.1361 14.1559 14.1559 14.1901 14.1901 14.5502 14.5502 14.5952 14.5952 14.6503 14.6503 14.8378 14.8378 15.3648 15.3648 15.8005 15.8005 15.8064 15.8064 16.0293 16.0293 16.0826 16.0826 17.7630 17.7630 18.1093 18.1093 18.2052 18.2052 18.4038 18.4038 k = 0.2321 0.5780 0.5265 ( 2790 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.1395 11.1395 11.1745 11.1745 11.3930 11.3930 11.4552 11.4552 12.5395 12.5395 13.5173 13.5173 13.5404 13.5404 13.7329 13.7329 13.8318 13.8318 14.0135 14.0135 14.0856 14.0856 14.1035 14.1035 14.1336 14.1336 14.1659 14.1659 14.2227 14.2227 14.5441 14.5441 14.5920 14.5920 14.6613 14.6613 14.8419 14.8419 15.3643 15.3643 15.7965 15.7965 15.8071 15.8071 16.0320 16.0320 16.0824 16.0824 17.7569 17.7569 18.0980 18.0980 18.2032 18.2032 18.4198 18.4198 k = 0.2232 0.5819 0.5167 ( 2794 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4120 -19.4120 11.1147 11.1147 11.1722 11.1722 11.3930 11.3930 11.4842 11.4842 12.5437 12.5437 13.5123 13.5123 13.5384 13.5384 13.7153 13.7153 13.8230 13.8230 14.0074 14.0074 14.0759 14.0759 14.0966 14.0966 14.1333 14.1333 14.1765 14.1765 14.2647 14.2647 14.5345 14.5345 14.5908 14.5908 14.6751 14.6751 14.8489 14.8489 15.3635 15.3635 15.7891 15.7891 15.8093 15.8093 16.0357 16.0357 16.0827 16.0827 17.7468 17.7468 18.0822 18.0822 18.1992 18.1992 18.4439 18.4439 k = 0.2143 0.5858 0.5070 ( 2798 PWs) bands (ev): -57.7691 -57.7691 -29.1872 -29.1872 -19.4486 -19.4486 -19.4120 -19.4120 11.0844 11.0844 11.1711 11.1711 11.3920 11.3920 11.5194 11.5194 12.5495 12.5495 13.5042 13.5042 13.5366 13.5366 13.6943 13.6943 13.8119 13.8119 13.9976 13.9976 14.0680 14.0680 14.0909 14.0909 14.1341 14.1341 14.1876 14.1876 14.3120 14.3120 14.5234 14.5234 14.5922 14.5922 14.6898 14.6898 14.8590 14.8590 15.3623 15.3623 15.7792 15.7792 15.8125 15.8125 16.0389 16.0389 16.0843 16.0843 17.7331 17.7331 18.0640 18.0640 18.1929 18.1929 18.4735 18.4735 k = 0.2054 0.5898 0.4972 ( 2796 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4120 -19.4120 11.0515 11.0515 11.1703 11.1703 11.3902 11.3902 11.5585 11.5585 12.5570 12.5570 13.4929 13.4929 13.5347 13.5347 13.6720 13.6720 13.7989 13.7989 13.9840 13.9840 14.0621 14.0621 14.0863 14.0863 14.1355 14.1355 14.1989 14.1989 14.3612 14.3612 14.5131 14.5131 14.5961 14.5961 14.7048 14.7048 14.8725 14.8725 15.3607 15.3607 15.7675 15.7675 15.8164 15.8164 16.0402 16.0402 16.0883 16.0883 17.7162 17.7162 18.0451 18.0451 18.1844 18.1844 18.5064 18.5064 k = 0.1964 0.5937 0.4875 ( 2794 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4120 -19.4120 11.0176 11.0176 11.1697 11.1697 11.3878 11.3878 11.5999 11.5999 12.5661 12.5661 13.4786 13.4786 13.5322 13.5322 13.6506 13.6506 13.7844 13.7844 13.9674 13.9674 14.0575 14.0575 14.0823 14.0823 14.1372 14.1372 14.2101 14.2101 14.4062 14.4062 14.5084 14.5084 14.6027 14.6027 14.7201 14.7201 14.8896 14.8896 15.3587 15.3587 15.7546 15.7546 15.8207 15.8207 16.0386 16.0386 16.0953 16.0953 17.6967 17.6967 18.0262 18.0262 18.1737 18.1737 18.5407 18.5407 k = 0.1875 0.5976 0.4777 ( 2802 PWs) bands (ev): -57.7691 -57.7691 -29.1872 -29.1872 -19.4486 -19.4486 -19.4120 -19.4120 10.9834 10.9834 11.1691 11.1691 11.3849 11.3849 11.6429 11.6429 12.5768 12.5768 13.4618 13.4618 13.5280 13.5280 13.6316 13.6316 13.7685 13.7685 13.9483 13.9483 14.0532 14.0532 14.0790 14.0790 14.1391 14.1391 14.2210 14.2210 14.4337 14.4337 14.5195 14.5195 14.6134 14.6134 14.7361 14.7361 14.9104 14.9104 15.3561 15.3561 15.7408 15.7408 15.8253 15.8253 16.0342 16.0342 16.1047 16.1047 17.6751 17.6751 18.0077 18.0077 18.1610 18.1610 18.5748 18.5748 k = 0.1786 0.6015 0.4680 ( 2802 PWs) bands (ev): -57.7691 -57.7691 -29.1872 -29.1872 -19.4486 -19.4486 -19.4119 -19.4119 10.9494 10.9494 11.1686 11.1686 11.3815 11.3815 11.6870 11.6870 12.5891 12.5891 13.4430 13.4430 13.5209 13.5209 13.6166 13.6166 13.7515 13.7515 13.9273 13.9273 14.0488 14.0488 14.0764 14.0764 14.1410 14.1410 14.2315 14.2315 14.4374 14.4374 14.5473 14.5473 14.6318 14.6318 14.7542 14.7542 14.9350 14.9350 15.3530 15.3530 15.7268 15.7268 15.8298 15.8298 16.0275 16.0275 16.1159 16.1159 17.6519 17.6519 17.9896 17.9896 18.1465 18.1465 18.6075 18.6075 k = 0.1696 0.6054 0.4582 ( 2796 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4119 -19.4119 10.9161 10.9161 11.1681 11.1681 11.3778 11.3778 11.7319 11.7319 12.6028 12.6028 13.4229 13.4229 13.5101 13.5101 13.6065 13.6065 13.7337 13.7337 13.9047 13.9047 14.0435 14.0435 14.0745 14.0745 14.1428 14.1428 14.2414 14.2414 14.4307 14.4307 14.5725 14.5725 14.6608 14.6608 14.7765 14.7765 14.9640 14.9640 15.3492 15.3492 15.7129 15.7129 15.8340 15.8340 16.0189 16.0189 16.1282 16.1282 17.6278 17.6278 17.9717 17.9717 18.1304 18.1304 18.6376 18.6376 k = 0.1607 0.6093 0.4485 ( 2794 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4119 -19.4119 10.8836 10.8836 11.1677 11.1677 11.3737 11.3737 11.7772 11.7772 12.6181 12.6181 13.4019 13.4019 13.4958 13.4958 13.6009 13.6009 13.7153 13.7153 13.8808 13.8808 14.0373 14.0373 14.0735 14.0735 14.1444 14.1444 14.2506 14.2506 14.4210 14.4210 14.5892 14.5892 14.6944 14.6944 14.8058 14.8058 14.9978 14.9978 15.3446 15.3446 15.6995 15.6995 15.8378 15.8378 16.0088 16.0088 16.1412 16.1412 17.6031 17.6031 17.9539 17.9539 18.1130 18.1130 18.6645 18.6645 k = 0.1518 0.6132 0.4387 ( 2790 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4119 -19.4119 10.8522 10.8522 11.1674 11.1674 11.3693 11.3693 11.8228 11.8228 12.6348 12.6348 13.3804 13.3804 13.4786 13.4786 13.5987 13.5987 13.6964 13.6964 13.8559 13.8559 14.0301 14.0301 14.0733 14.0733 14.1457 14.1457 14.2590 14.2590 14.4109 14.4109 14.6014 14.6014 14.7243 14.7243 14.8428 14.8428 15.0376 15.0376 15.3391 15.3391 15.6870 15.6870 15.8408 15.8408 15.9973 15.9973 16.1546 16.1546 17.5783 17.5783 17.9357 17.9357 18.0946 18.0946 18.6881 18.6881 k = 0.1429 0.6172 0.4290 ( 2788 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4119 -19.4119 10.8219 10.8219 11.1671 11.1671 11.3646 11.3646 11.8684 11.8684 12.6528 12.6528 13.3588 13.3588 13.4598 13.4598 13.5987 13.5987 13.6773 13.6773 13.8301 13.8301 14.0218 14.0218 14.0740 14.0740 14.1466 14.1466 14.2665 14.2665 14.4010 14.4010 14.6119 14.6119 14.7485 14.7485 14.8841 14.8841 15.0839 15.0839 15.3326 15.3326 15.6757 15.6757 15.8431 15.8431 15.9847 15.9847 16.1682 16.1682 17.5535 17.5535 17.9169 17.9169 18.0758 18.0758 18.7085 18.7085 k = 0.1339 0.6211 0.4192 ( 2788 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4118 -19.4118 10.7930 10.7930 11.1670 11.1670 11.3597 11.3597 11.9140 11.9140 12.6722 12.6722 13.3371 13.3371 13.4402 13.4402 13.5996 13.5996 13.6583 13.6583 13.8041 13.8041 14.0125 14.0125 14.0755 14.0755 14.1471 14.1471 14.2728 14.2728 14.3917 14.3917 14.6220 14.6220 14.7693 14.7693 14.9251 14.9251 15.1369 15.1369 15.3252 15.3252 15.6661 15.6661 15.8445 15.8445 15.9710 15.9710 16.1820 16.1820 17.5289 17.5289 17.8969 17.8969 18.0571 18.0571 18.7261 18.7261 k = 0.1250 0.6250 0.4095 ( 2782 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4118 -19.4118 10.7655 10.7655 11.1670 11.1670 11.3546 11.3546 11.9593 11.9593 12.6928 12.6928 13.3155 13.3155 13.4203 13.4203 13.6002 13.6002 13.6399 13.6399 13.7782 13.7782 14.0025 14.0025 14.0778 14.0778 14.1473 14.1473 14.2781 14.2781 14.3833 14.3833 14.6322 14.6322 14.7883 14.7883 14.9633 14.9633 15.1949 15.1949 15.3174 15.3174 15.6584 15.6584 15.8451 15.8451 15.9566 15.9566 16.1957 16.1957 17.5048 17.5048 17.8755 17.8755 18.0389 18.0389 18.7414 18.7414 k = 0.1161 0.6289 0.3997 ( 2784 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4118 -19.4118 10.7395 10.7395 11.1671 11.1671 11.3494 11.3494 12.0042 12.0042 12.7145 12.7145 13.2937 13.2937 13.4008 13.4008 13.5976 13.5976 13.6240 13.6240 13.7533 13.7533 13.9919 13.9919 14.0807 14.0807 14.1470 14.1470 14.2820 14.2820 14.3758 14.3758 14.6427 14.6427 14.8067 14.8067 14.9980 14.9980 15.2528 15.2528 15.3120 15.3120 15.6530 15.6530 15.8447 15.8447 15.9420 15.9420 16.2093 16.2093 17.4810 17.4810 17.8524 17.8524 18.0219 18.0219 18.7549 18.7549 k = 0.1071 0.6328 0.3900 ( 2784 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4118 -19.4118 10.7152 10.7152 11.1673 11.1673 11.3442 11.3442 12.0485 12.0485 12.7373 12.7373 13.2716 13.2716 13.3821 13.3821 13.5869 13.5869 13.6147 13.6147 13.7307 13.7307 13.9809 13.9809 14.0841 14.0841 14.1463 14.1463 14.2845 14.2845 14.3694 14.3694 14.6538 14.6538 14.8250 14.8250 15.0293 15.0293 15.2828 15.2828 15.3345 15.3345 15.6505 15.6505 15.8435 15.8435 15.9277 15.9277 16.2227 16.2227 17.4575 17.4575 17.8277 17.8277 18.0065 18.0065 18.7668 18.7668 k = 0.0982 0.6367 0.3802 ( 2788 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4118 -19.4118 10.6925 10.6925 11.1677 11.1677 11.3390 11.3390 12.0919 12.0919 12.7610 12.7610 13.2490 13.2490 13.3646 13.3646 13.5690 13.5690 13.6092 13.6092 13.7122 13.7122 13.9695 13.9695 14.0881 14.0881 14.1455 14.1455 14.2856 14.2856 14.3641 14.3641 14.6654 14.6654 14.8431 14.8431 15.0574 15.0574 15.2782 15.2782 15.3887 15.3887 15.6515 15.6515 15.8413 15.8413 15.9151 15.9151 16.2358 16.2358 17.4341 17.4341 17.8015 17.8015 17.9927 17.9927 18.7774 18.7774 k = 0.0893 0.6406 0.3705 ( 2786 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4118 -19.4118 10.6715 10.6715 11.1682 11.1682 11.3339 11.3339 12.1342 12.1342 12.7855 12.7855 13.2259 13.2259 13.3486 13.3486 13.5481 13.5481 13.6020 13.6020 13.6994 13.6994 13.9580 13.9580 14.0925 14.0925 14.1444 14.1444 14.2851 14.2851 14.3600 14.3600 14.6776 14.6776 14.8613 14.8613 15.0819 15.0819 15.2697 15.2697 15.4413 15.4413 15.6566 15.6566 15.8372 15.8372 15.9068 15.9068 16.2485 16.2485 17.4107 17.4107 17.7744 17.7744 17.9807 17.9807 18.7869 18.7869 k = 0.0804 0.6446 0.3607 ( 2786 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4118 -19.4118 10.6524 10.6524 11.1688 11.1688 11.3289 11.3289 12.1752 12.1752 12.8106 12.8106 13.2023 13.2023 13.3345 13.3345 13.5253 13.5253 13.5916 13.5916 13.6930 13.6930 13.9465 13.9465 14.0972 14.0972 14.1434 14.1434 14.2831 14.2831 14.3570 14.3570 14.6901 14.6901 14.8793 14.8793 15.1017 15.1017 15.2626 15.2626 15.4846 15.4846 15.6662 15.6662 15.8297 15.8297 15.9067 15.9067 16.2608 16.2608 17.3870 17.3870 17.7471 17.7471 17.9704 17.9704 18.7953 18.7953 k = 0.0714 0.6485 0.3510 ( 2782 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.6351 10.6351 11.1695 11.1695 11.3241 11.3241 12.2144 12.2144 12.8360 12.8360 13.1784 13.1784 13.3222 13.3222 13.5010 13.5010 13.5792 13.5792 13.6917 13.6917 13.9351 13.9351 14.1020 14.1020 14.1425 14.1425 14.2798 14.2798 14.3551 14.3551 14.7028 14.7028 14.8971 14.8971 15.1153 15.1153 15.2593 15.2593 15.5159 15.5159 15.6788 15.6788 15.8183 15.8183 15.9178 15.9178 16.2726 16.2726 17.3628 17.3628 17.7205 17.7205 17.9616 17.9616 18.8027 18.8027 k = 0.0625 0.6524 0.3412 ( 2780 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.6198 10.6198 11.1702 11.1702 11.3197 11.3197 12.2514 12.2514 12.8616 12.8616 13.1544 13.1544 13.3118 13.3118 13.4755 13.4755 13.5664 13.5664 13.6938 13.6938 13.9241 13.9241 14.1066 14.1066 14.1421 14.1421 14.2755 14.2755 14.3539 14.3539 14.7155 14.7155 14.9144 14.9144 15.1213 15.1213 15.2617 15.2617 15.5362 15.5362 15.6909 15.6909 15.8043 15.8043 15.9407 15.9407 16.2841 16.2841 17.3381 17.3381 17.6953 17.6953 17.9543 17.9543 18.8093 18.8093 k = 0.0536 0.6563 0.3315 ( 2782 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.6064 10.6064 11.1710 11.1710 11.3156 11.3156 12.2857 12.2857 12.8868 12.8868 13.1310 13.1310 13.3032 13.3032 13.4497 13.4497 13.5546 13.5546 13.6978 13.6978 13.9136 13.9136 14.1107 14.1107 14.1423 14.1423 14.2705 14.2705 14.3533 14.3533 14.7278 14.7278 14.9311 14.9311 15.1198 15.1198 15.2696 15.2696 15.5485 15.5485 15.6994 15.6994 15.7890 15.7890 15.9725 15.9725 16.2951 16.2951 17.3130 17.3130 17.6724 17.6724 17.9482 17.9482 18.8149 18.8149 k = 0.0446 0.6602 0.3217 ( 2782 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.5950 10.5950 11.1717 11.1717 11.3120 11.3120 12.3168 12.3168 12.9114 12.9114 13.1086 13.1086 13.2964 13.2964 13.4243 13.4243 13.5443 13.5443 13.7026 13.7026 13.9039 13.9039 14.1139 14.1139 14.1434 14.1434 14.2651 14.2651 14.3531 14.3531 14.7394 14.7394 14.9470 14.9470 15.1127 15.1127 15.2813 15.2813 15.5559 15.5559 15.7042 15.7042 15.7737 15.7737 16.0087 16.0087 16.3058 16.3058 17.2882 17.2882 17.6525 17.6525 17.9432 17.9432 18.8197 18.8197 k = 0.0357 0.6641 0.3120 ( 2782 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.5856 10.5856 11.1724 11.1724 11.3089 11.3089 12.3438 12.3438 12.9346 12.9346 13.0877 13.0877 13.2913 13.2913 13.4004 13.4004 13.5358 13.5358 13.7076 13.7076 13.8952 13.8952 14.1162 14.1162 14.1453 14.1453 14.2599 14.2599 14.3531 14.3531 14.7499 14.7499 14.9619 14.9619 15.1025 15.1025 15.2943 15.2943 15.5601 15.5601 15.7065 15.7065 15.7592 15.7592 16.0443 16.0443 16.3160 16.3160 17.2646 17.2646 17.6359 17.6359 17.9393 17.9393 18.8236 18.8236 k = 0.0268 0.6681 0.3022 ( 2788 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.5783 10.5783 11.1730 11.1730 11.3065 11.3065 12.3661 12.3661 12.9558 12.9558 13.0690 13.0690 13.2877 13.2877 13.3793 13.3793 13.5291 13.5291 13.7121 13.7121 13.8880 13.8880 14.1175 14.1175 14.1478 14.1478 14.2551 14.2551 14.3532 14.3532 14.7587 14.7587 14.9754 14.9754 15.0912 15.0912 15.3065 15.3065 15.5624 15.5624 15.7078 15.7078 15.7461 15.7461 16.0753 16.0753 16.3255 16.3255 17.2437 17.2437 17.6230 17.6230 17.9363 17.9363 18.8266 18.8266 k = 0.0179 0.6720 0.2925 ( 2790 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.5731 10.5731 11.1735 11.1735 11.3046 11.3046 12.3828 12.3828 12.9741 12.9741 13.0531 13.0531 13.2857 13.2857 13.3623 13.3623 13.5244 13.5244 13.7158 13.7158 13.8824 13.8824 14.1182 14.1182 14.1502 14.1502 14.2511 14.2511 14.3534 14.3534 14.7654 14.7654 14.9870 14.9870 15.0805 15.0805 15.3165 15.3165 15.5633 15.5633 15.7096 15.7096 15.7346 15.7346 16.0991 16.0991 16.3334 16.3334 17.2270 17.2270 17.6137 17.6137 17.9342 17.9342 18.8288 18.8288 k = 0.0089 0.6759 0.2827 ( 2792 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.5699 10.5699 11.1738 11.1738 11.3035 11.3035 12.3931 12.3931 12.9881 12.9881 13.0409 13.0409 13.2848 13.2848 13.3510 13.3510 13.5215 13.5215 13.7182 13.7182 13.8789 13.8789 14.1185 14.1185 14.1520 14.1520 14.2486 14.2486 14.3535 14.3535 14.7696 14.7696 14.9954 14.9954 15.0724 15.0724 15.3229 15.3229 15.5636 15.5636 15.7128 15.7128 15.7252 15.7252 16.1138 16.1138 16.3388 16.3388 17.2161 17.2161 17.6082 17.6082 17.9330 17.9330 18.8301 18.8301 k = 0.0000 0.6798 0.2730 ( 2792 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4488 -19.4488 -19.4117 -19.4117 10.5689 10.5689 11.1739 11.1739 11.3032 11.3032 12.3966 12.3966 12.9939 12.9939 13.0357 13.0357 13.2846 13.2846 13.3471 13.3471 13.5205 13.5205 13.7191 13.7191 13.8777 13.8777 14.1186 14.1186 14.1527 14.1527 14.2477 14.2477 14.3535 14.3535 14.7711 14.7711 14.9986 14.9986 15.0692 15.0692 15.3252 15.3252 15.5636 15.5636 15.7176 15.7176 15.7183 15.7183 16.1188 16.1188 16.3408 16.3408 17.2124 17.2124 17.6064 17.6064 17.9326 17.9326 18.8305 18.8305 k = 0.0000 0.6798 0.2730 ( 2792 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4488 -19.4488 -19.4117 -19.4117 10.5689 10.5689 11.1739 11.1739 11.3032 11.3032 12.3966 12.3966 12.9939 12.9939 13.0357 13.0357 13.2846 13.2846 13.3471 13.3471 13.5205 13.5205 13.7191 13.7191 13.8777 13.8777 14.1186 14.1186 14.1527 14.1527 14.2477 14.2477 14.3535 14.3535 14.7711 14.7711 14.9986 14.9986 15.0692 15.0692 15.3252 15.3252 15.5636 15.5636 15.7176 15.7176 15.7183 15.7183 16.1188 16.1188 16.3408 16.3408 17.2124 17.2124 17.6064 17.6064 17.9326 17.9326 18.8305 18.8305 k =-0.0105 0.6765 0.2812 ( 2790 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.5699 10.5699 11.1742 11.1742 11.3032 11.3032 12.3962 12.3962 12.9789 12.9789 13.0497 13.0497 13.2818 13.2818 13.3479 13.3479 13.5206 13.5206 13.7137 13.7137 13.8847 13.8847 14.1185 14.1185 14.1530 14.1530 14.2484 14.2484 14.3538 14.3538 14.7696 14.7696 14.9982 14.9982 15.0715 15.0715 15.3253 15.3253 15.5635 15.5635 15.7108 15.7108 15.7239 15.7239 16.1143 16.1143 16.3393 16.3393 17.2174 17.2174 17.6068 17.6068 17.9336 17.9336 18.8297 18.8297 k =-0.0210 0.6732 0.2895 ( 2790 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4487 -19.4487 -19.4117 -19.4117 10.5730 10.5730 11.1751 11.1751 11.3035 11.3035 12.3950 12.3950 12.9520 12.9520 13.0734 13.0734 13.2740 13.2740 13.3502 13.3502 13.5200 13.5200 13.7011 13.7011 13.9028 13.9028 14.1179 14.1179 14.1539 14.1539 14.2508 14.2508 14.3548 14.3548 14.7655 14.7655 14.9970 14.9970 15.0782 15.0782 15.3258 15.3258 15.5630 15.5630 15.7028 15.7028 15.7281 15.7281 16.1014 16.1014 16.3352 16.3352 17.2319 17.2319 17.6080 17.6080 17.9368 17.9368 18.8272 18.8272 k =-0.0315 0.6698 0.2978 ( 2786 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4486 -19.4486 -19.4117 -19.4117 10.5782 10.5782 11.1766 11.1766 11.3040 11.3040 12.3930 12.3930 12.9221 12.9221 13.0974 13.0974 13.2626 13.2626 13.3536 13.3536 13.5171 13.5171 13.6876 13.6876 13.9268 13.9268 14.1170 14.1170 14.1553 14.1553 14.2547 14.2547 14.3565 14.3565 14.7590 14.7590 14.9954 14.9954 15.0885 15.0885 15.3267 15.3267 15.5619 15.5619 15.6938 15.6938 15.7303 15.7303 16.0812 16.0812 16.3295 16.3295 17.2543 17.2543 17.6101 17.6101 17.9421 17.9421 18.8231 18.8231 k =-0.0420 0.6665 0.3061 ( 2792 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4118 -19.4118 10.5854 10.5854 11.1787 11.1787 11.3047 11.3047 12.3900 12.3900 12.8905 12.8905 13.1195 13.1195 13.2491 13.2491 13.3579 13.3579 13.5099 13.5099 13.6786 13.6786 13.9531 13.9531 14.1157 14.1157 14.1572 14.1572 14.2603 14.2603 14.3589 14.3589 14.7508 14.7508 14.9936 14.9936 15.1015 15.1015 15.3280 15.3280 15.5597 15.5597 15.6832 15.6832 15.7301 15.7301 16.0565 16.0565 16.3233 16.3233 17.2823 17.2823 17.6130 17.6130 17.9498 17.9498 18.8175 18.8175 k =-0.0524 0.6632 0.3143 ( 2786 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4483 -19.4483 -19.4118 -19.4118 10.5946 10.5946 11.1813 11.1813 11.3057 11.3057 12.3861 12.3861 12.8573 12.8573 13.1378 13.1378 13.2356 13.2356 13.3630 13.3630 13.4980 13.4980 13.6761 13.6761 13.9795 13.9795 14.1139 14.1139 14.1593 14.1593 14.2677 14.2677 14.3621 14.3621 14.7414 14.7414 14.9916 14.9916 15.1165 15.1165 15.3297 15.3297 15.5556 15.5556 15.6696 15.6696 15.7280 15.7280 16.0305 16.0305 16.3171 16.3171 17.3135 17.3135 17.6167 17.6167 17.9599 17.9599 18.8108 18.8108 k =-0.0629 0.6599 0.3226 ( 2780 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4481 -19.4481 -19.4119 -19.4119 10.6059 10.6059 11.1843 11.1843 11.3071 11.3071 12.3812 12.3812 12.8224 12.8224 13.1486 13.1486 13.2258 13.2258 13.3687 13.3687 13.4832 13.4832 13.6797 13.6797 14.0048 14.0048 14.1115 14.1115 14.1614 14.1614 14.2769 14.2769 14.3663 14.3663 14.7316 14.7316 14.9895 14.9895 15.1326 15.1326 15.3316 15.3316 15.5487 15.5487 15.6509 15.6509 15.7256 15.7256 16.0071 16.0071 16.3112 16.3112 17.3458 17.3458 17.6211 17.6211 17.9725 17.9725 18.8032 18.8032 k =-0.0734 0.6565 0.3309 ( 2780 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4479 -19.4479 -19.4120 -19.4120 10.6191 10.6191 11.1878 11.1878 11.3090 11.3090 12.3752 12.3752 12.7857 12.7857 13.1478 13.1478 13.2237 13.2237 13.3747 13.3747 13.4690 13.4690 13.6877 13.6877 14.0282 14.0282 14.1086 14.1086 14.1634 14.1634 14.2881 14.2881 14.3716 14.3716 14.7218 14.7218 14.9875 14.9875 15.1489 15.1489 15.3333 15.3333 15.5375 15.5375 15.6262 15.6262 15.7251 15.7251 15.9889 15.9889 16.3056 16.3056 17.3772 17.3772 17.6262 17.6262 17.9876 17.9876 18.7950 18.7950 k =-0.0839 0.6532 0.3392 ( 2788 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4476 -19.4476 -19.4121 -19.4121 10.6343 10.6343 11.1915 11.1915 11.3114 11.3114 12.3680 12.3680 12.7469 12.7469 13.1362 13.1362 13.2278 13.2278 13.3796 13.3796 13.4594 13.4594 13.6982 13.6982 14.0491 14.0491 14.1051 14.1051 14.1648 14.1648 14.3013 14.3013 14.3781 14.3781 14.7124 14.7124 14.9854 14.9854 15.1644 15.1644 15.3339 15.3339 15.5197 15.5197 15.5990 15.5990 15.7276 15.7276 15.9769 15.9769 16.3001 16.3001 17.4064 17.4064 17.6320 17.6320 18.0051 18.0051 18.7866 18.7866 k =-0.0944 0.6499 0.3474 ( 2787 PWs) bands (ev): -57.7691 -57.7691 -29.1869 -29.1869 -19.4473 -19.4473 -19.4122 -19.4122 10.6514 10.6514 11.1955 11.1955 11.3144 11.3144 12.3596 12.3596 12.7060 12.7060 13.1191 13.1191 13.2327 13.2327 13.3818 13.3818 13.4582 13.4582 13.7099 13.7099 14.0666 14.0666 14.1014 14.1014 14.1657 14.1657 14.3167 14.3167 14.3858 14.3858 14.7039 14.7039 14.9833 14.9833 15.1776 15.1776 15.3311 15.3311 15.4944 15.4944 15.5752 15.5752 15.7332 15.7332 15.9707 15.9707 16.2948 16.2948 17.4324 17.4324 17.6383 17.6383 18.0245 18.0245 18.7786 18.7786 k =-0.1049 0.6466 0.3557 ( 2786 PWs) bands (ev): -57.7691 -57.7691 -29.1869 -29.1869 -19.4470 -19.4470 -19.4123 -19.4123 10.6704 10.6704 11.1996 11.1996 11.3182 11.3182 12.3499 12.3499 12.6629 12.6629 13.0995 13.0995 13.2351 13.2351 13.3817 13.3817 13.4665 13.4665 13.7218 13.7218 14.0785 14.0785 14.0997 14.0997 14.1657 14.1657 14.3343 14.3343 14.3950 14.3950 14.6965 14.6965 14.9813 14.9813 15.1860 15.1860 15.3209 15.3209 15.4685 15.4685 15.5573 15.5573 15.7415 15.7415 15.9690 15.9690 16.2895 16.2895 17.4545 17.4545 17.6450 17.6450 18.0454 18.0454 18.7713 18.7713 k =-0.1154 0.6433 0.3640 ( 2788 PWs) bands (ev): -57.7691 -57.7691 -29.1869 -29.1869 -19.4466 -19.4466 -19.4125 -19.4125 10.6913 10.6913 11.2038 11.2038 11.3228 11.3228 12.3388 12.3388 12.6177 12.6177 13.0790 13.0790 13.2342 13.2342 13.3815 13.3815 13.4821 13.4821 13.7332 13.7332 14.0798 14.0798 14.1043 14.1043 14.1648 14.1648 14.3538 14.3538 14.4059 14.4059 14.6905 14.6905 14.9792 14.9792 15.1834 15.1834 15.3024 15.3024 15.4530 15.4530 15.5436 15.5436 15.7522 15.7522 15.9705 15.9705 16.2841 16.2841 17.4724 17.4724 17.6520 17.6520 18.0670 18.0670 18.7654 18.7654 k =-0.1259 0.6399 0.3722 ( 2786 PWs) bands (ev): -57.7692 -57.7692 -29.1868 -29.1868 -19.4462 -19.4462 -19.4126 -19.4126 10.7139 10.7139 11.2079 11.2079 11.3284 11.3284 12.3261 12.3261 12.5704 12.5704 13.0582 13.0582 13.2307 13.2307 13.3829 13.3829 13.5024 13.5024 13.7438 13.7438 14.0742 14.0742 14.1115 14.1115 14.1632 14.1632 14.3748 14.3748 14.4187 14.4187 14.6860 14.6860 14.9769 14.9769 15.1596 15.1596 15.2865 15.2865 15.4508 15.4508 15.5326 15.5326 15.7647 15.7647 15.9744 15.9744 16.2787 16.2787 17.4862 17.4862 17.6592 17.6592 18.0885 18.0885 18.7613 18.7613 k =-0.1364 0.6366 0.3805 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1868 -29.1868 -19.4458 -19.4458 -19.4128 -19.4128 10.7382 10.7382 11.2119 11.2119 11.3349 11.3349 12.3119 12.3119 12.5214 12.5214 13.0373 13.0373 13.2258 13.2258 13.3862 13.3862 13.5257 13.5257 13.7532 13.7532 14.0659 14.0659 14.1165 14.1165 14.1609 14.1609 14.3962 14.3962 14.4346 14.4346 14.6832 14.6832 14.9742 14.9742 15.1131 15.1131 15.2811 15.2811 15.4579 15.4579 15.5242 15.5242 15.7787 15.7787 15.9797 15.9797 16.2731 16.2731 17.4958 17.4958 17.6665 17.6665 18.1091 18.1091 18.7595 18.7595 k =-0.1468 0.6333 0.3888 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1867 -29.1867 -19.4453 -19.4453 -19.4130 -19.4130 10.7642 10.7642 11.2159 11.2159 11.3425 11.3425 12.2959 12.2959 12.4711 12.4711 13.0164 13.0164 13.2206 13.2206 13.3914 13.3914 13.5511 13.5511 13.7610 13.7610 14.0560 14.0560 14.1181 14.1181 14.1585 14.1585 14.4166 14.4166 14.4549 14.4549 14.6819 14.6819 14.9696 14.9696 15.0550 15.0550 15.2815 15.2815 15.4702 15.4702 15.5187 15.5187 15.7940 15.7940 15.9861 15.9861 16.2674 16.2674 17.5014 17.5014 17.6739 17.6739 18.1284 18.1284 18.7602 18.7602 k =-0.1573 0.6300 0.3971 ( 2792 PWs) bands (ev): -57.7692 -57.7692 -29.1866 -29.1866 -19.4449 -19.4449 -19.4131 -19.4131 10.7918 10.7918 11.2198 11.2198 11.3511 11.3511 12.2779 12.2779 12.4201 12.4201 12.9955 12.9955 13.2161 13.2161 13.3979 13.3979 13.5777 13.5777 13.7671 13.7671 14.0448 14.0448 14.1159 14.1159 14.1560 14.1560 14.4346 14.4346 14.4802 14.4802 14.6819 14.6819 14.9544 14.9544 15.0025 15.0025 15.2826 15.2826 15.4851 15.4851 15.5172 15.5172 15.8103 15.8103 15.9930 15.9930 16.2616 16.2616 17.5028 17.5028 17.6813 17.6813 18.1459 18.1459 18.7636 18.7636 k =-0.1678 0.6267 0.4053 ( 2792 PWs) bands (ev): -57.7692 -57.7692 -29.1866 -29.1866 -19.4443 -19.4443 -19.4133 -19.4133 10.8208 10.8208 11.2237 11.2237 11.3606 11.3606 12.2571 12.2571 12.3692 12.3692 12.9747 12.9747 13.2129 13.2129 13.4054 13.4054 13.6050 13.6050 13.7713 13.7713 14.0323 14.0323 14.1104 14.1104 14.1532 14.1532 14.4506 14.4506 14.5097 14.5097 14.6827 14.6827 14.9061 14.9061 14.9828 14.9828 15.2822 15.2822 15.5002 15.5002 15.5212 15.5212 15.8273 15.8273 16.0004 16.0004 16.2558 16.2558 17.5001 17.5001 17.6887 17.6887 18.1617 18.1617 18.7696 18.7696 k =-0.1783 0.6233 0.4136 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1865 -29.1865 -19.4438 -19.4438 -19.4135 -19.4135 10.8512 10.8512 11.2276 11.2276 11.3711 11.3711 12.2325 12.2325 12.3201 12.3201 12.9538 12.9538 13.2113 13.2113 13.4137 13.4137 13.6328 13.6328 13.7736 13.7736 14.0187 14.0187 14.1024 14.1024 14.1495 14.1495 14.4650 14.4650 14.5414 14.5414 14.6829 14.6829 14.8473 14.8473 14.9778 14.9778 15.2793 15.2793 15.5128 15.5128 15.5329 15.5329 15.8450 15.8450 16.0079 16.0079 16.2499 16.2499 17.4932 17.4932 17.6963 17.6963 18.1760 18.1760 18.7779 18.7779 k =-0.1888 0.6200 0.4219 ( 2788 PWs) bands (ev): -57.7692 -57.7692 -29.1864 -29.1864 -19.4432 -19.4432 -19.4137 -19.4137 10.8828 10.8828 11.2316 11.2316 11.3824 11.3824 12.2015 12.2015 12.2754 12.2754 12.9330 12.9330 13.2113 13.2113 13.4226 13.4226 13.6606 13.6606 13.7737 13.7737 14.0037 14.0037 14.0927 14.0927 14.1447 14.1447 14.4770 14.4770 14.5728 14.5728 14.6794 14.6794 14.7978 14.7978 14.9755 14.9755 15.2739 15.2739 15.5245 15.5245 15.5502 15.5502 15.8631 15.8631 16.0153 16.0153 16.2441 16.2441 17.4818 17.4818 17.7040 17.7040 18.1893 18.1893 18.7878 18.7878 k =-0.1993 0.6167 0.4301 ( 2789 PWs) bands (ev): -57.7692 -57.7692 -29.1863 -29.1863 -19.4426 -19.4426 -19.4139 -19.4139 10.9156 10.9156 11.2358 11.2358 11.3944 11.3944 12.1619 12.1619 12.2377 12.2377 12.9121 12.9121 13.2130 13.2130 13.4319 13.4319 13.6879 13.6879 13.7717 13.7717 13.9876 13.9876 14.0818 14.0818 14.1386 14.1386 14.4836 14.4836 14.5970 14.5970 14.6705 14.6705 14.7710 14.7710 14.9739 14.9739 15.2664 15.2664 15.5380 15.5380 15.5695 15.5695 15.8813 15.8813 16.0225 16.0225 16.2385 16.2385 17.4659 17.4659 17.7120 17.7120 18.2023 18.2023 18.7988 18.7988 k =-0.2098 0.6134 0.4384 ( 2789 PWs) bands (ev): -57.7692 -57.7692 -29.1862 -29.1862 -19.4419 -19.4419 -19.4141 -19.4141 10.9493 10.9493 11.2404 11.2404 11.4070 11.4070 12.1152 12.1152 12.2058 12.2058 12.8913 12.8913 13.2164 13.2164 13.4414 13.4414 13.7142 13.7142 13.7680 13.7680 13.9701 13.9701 14.0705 14.0705 14.1312 14.1312 14.4776 14.4776 14.6013 14.6013 14.6734 14.6734 14.7705 14.7705 14.9727 14.9727 15.2577 15.2577 15.5537 15.5537 15.5896 15.5896 15.8996 15.8996 16.0295 16.0295 16.2331 16.2331 17.4454 17.4454 17.7203 17.7203 18.2157 18.2157 18.8100 18.8100 k =-0.2203 0.6100 0.4467 ( 2792 PWs) bands (ev): -57.7693 -57.7693 -29.1862 -29.1862 -19.4413 -19.4413 -19.4143 -19.4143 10.9836 10.9836 11.2455 11.2455 11.4201 11.4201 12.0646 12.0646 12.1767 12.1767 12.8705 12.8705 13.2212 13.2212 13.4510 13.4510 13.7360 13.7360 13.7655 13.7655 13.9514 13.9514 14.0593 14.0593 14.1226 14.1226 14.4510 14.4510 14.5990 14.5990 14.6908 14.6908 14.7883 14.7883 14.9718 14.9718 15.2486 15.2486 15.5713 15.5713 15.6097 15.6097 15.9177 15.9177 16.0359 16.0359 16.2282 16.2282 17.4205 17.4205 17.7289 17.7289 18.2300 18.2300 18.8208 18.8208 k =-0.2307 0.6067 0.4550 ( 2794 PWs) bands (ev): -57.7693 -57.7693 -29.1861 -29.1861 -19.4406 -19.4406 -19.4146 -19.4146 11.0185 11.0185 11.2512 11.2512 11.4335 11.4335 12.0125 12.0125 12.1481 12.1481 12.8498 12.8498 13.2274 13.2274 13.4604 13.4604 13.7402 13.7402 13.7769 13.7769 13.9316 13.9316 14.0484 14.0484 14.1130 14.1130 14.4082 14.4082 14.6062 14.6062 14.7080 14.7080 14.8181 14.8181 14.9713 14.9713 15.2405 15.2405 15.5902 15.5902 15.6298 15.6298 15.9355 15.9355 16.0418 16.0418 16.2237 16.2237 17.3913 17.3913 17.7380 17.7380 18.2458 18.2458 18.8303 18.8303 k =-0.2412 0.6034 0.4632 ( 2793 PWs) bands (ev): -57.7693 -57.7693 -29.1860 -29.1860 -19.4399 -19.4399 -19.4148 -19.4148 11.0533 11.0533 11.2579 11.2579 11.4472 11.4472 11.9602 11.9602 12.1191 12.1191 12.8293 12.8293 13.2346 13.2346 13.4694 13.4694 13.7300 13.7300 13.7982 13.7982 13.9112 13.9112 14.0384 14.0384 14.1028 14.1028 14.3594 14.3594 14.6203 14.6203 14.7225 14.7225 14.8539 14.8539 14.9712 14.9712 15.2349 15.2349 15.6099 15.6099 15.6495 15.6495 15.9528 15.9528 16.0471 16.0471 16.2200 16.2200 17.3581 17.3581 17.7476 17.7476 18.2634 18.2634 18.8380 18.8380 k =-0.2517 0.6001 0.4715 ( 2795 PWs) bands (ev): -57.7693 -57.7693 -29.1859 -29.1859 -19.4391 -19.4391 -19.4150 -19.4150 11.0878 11.0878 11.2658 11.2658 11.4609 11.4609 11.9084 11.9084 12.0892 12.0892 12.8088 12.8088 13.2429 13.2429 13.4776 13.4776 13.7151 13.7151 13.8180 13.8180 13.8918 13.8918 14.0294 14.0294 14.0923 14.0923 14.3105 14.3105 14.6381 14.6381 14.7351 14.7351 14.8904 14.8904 14.9721 14.9721 15.2339 15.2339 15.6297 15.6297 15.6687 15.6687 15.9694 15.9694 16.0517 16.0517 16.2171 16.2171 17.3214 17.3214 17.7576 17.7576 18.2829 18.2829 18.8433 18.8433 k =-0.2622 0.5968 0.4798 ( 2789 PWs) bands (ev): -57.7693 -57.7693 -29.1857 -29.1857 -19.4383 -19.4383 -19.4152 -19.4152 11.1211 11.1211 11.2754 11.2754 11.4745 11.4745 11.8576 11.8576 12.0581 12.0581 12.7885 12.7885 13.2518 13.2518 13.4846 13.4846 13.6971 13.6971 13.8268 13.8268 13.8812 13.8812 14.0219 14.0219 14.0819 14.0819 14.2642 14.2642 14.6578 14.6578 14.7467 14.7467 14.9215 14.9215 14.9756 14.9756 15.2403 15.2403 15.6494 15.6494 15.6872 15.6872 15.9851 15.9851 16.0556 16.0556 16.2152 16.2152 17.2818 17.2818 17.7682 17.7682 18.3044 18.3044 18.8460 18.8460 k =-0.2727 0.5934 0.4880 ( 2788 PWs) bands (ev): -57.7693 -57.7693 -29.1856 -29.1856 -19.4376 -19.4376 -19.4154 -19.4154 11.1523 11.1523 11.2873 11.2873 11.4876 11.4876 11.8083 11.8083 12.0257 12.0257 12.7684 12.7684 13.2612 13.2612 13.4899 13.4899 13.6768 13.6768 13.8145 13.8145 13.8891 13.8891 14.0159 14.0159 14.0721 14.0721 14.2219 14.2219 14.6786 14.6786 14.7579 14.7579 14.9406 14.9406 14.9843 14.9843 15.2571 15.2571 15.6685 15.6685 15.7046 15.7046 15.9996 15.9996 16.0590 16.0590 16.2144 16.2144 17.2397 17.2397 17.7793 17.7793 18.3275 18.3275 18.8459 18.8459 k =-0.2832 0.5901 0.4963 ( 2790 PWs) bands (ev): -57.7694 -57.7694 -29.1855 -29.1855 -19.4367 -19.4367 -19.4157 -19.4157 11.1805 11.1805 11.3021 11.3021 11.4998 11.4998 11.7612 11.7612 11.9921 11.9921 12.7485 12.7485 13.2709 13.2709 13.4926 13.4926 13.6552 13.6552 13.7905 13.7905 13.9062 13.9062 14.0116 14.0116 14.0633 14.0633 14.1844 14.1844 14.6998 14.6998 14.7689 14.7689 14.9476 14.9476 14.9962 14.9962 15.2862 15.2862 15.6868 15.6868 15.7208 15.7208 16.0125 16.0125 16.0621 16.0621 16.2148 16.2148 17.1960 17.1960 17.7909 17.7909 18.3519 18.3519 18.8434 18.8434 k =-0.2937 0.5868 0.5046 ( 2794 PWs) bands (ev): -57.7694 -57.7694 -29.1854 -29.1854 -19.4359 -19.4359 -19.4159 -19.4159 11.2045 11.2045 11.3203 11.3203 11.5102 11.5102 11.7174 11.7174 11.9574 11.9574 12.7288 12.7288 13.2804 13.2804 13.4917 13.4917 13.6332 13.6332 13.7629 13.7629 13.9244 13.9244 14.0093 14.0093 14.0560 14.0560 14.1519 14.1519 14.7210 14.7210 14.7799 14.7799 14.9487 14.9487 15.0055 15.0055 15.3269 15.3269 15.7042 15.7042 15.7354 15.7354 16.0235 16.0235 16.0654 16.0654 16.2162 16.2162 17.1513 17.1513 17.8030 17.8030 18.3768 18.3768 18.8389 18.8389 k =-0.3042 0.5835 0.5129 ( 2800 PWs) bands (ev): -57.7694 -57.7694 -29.1853 -29.1853 -19.4351 -19.4351 -19.4162 -19.4162 11.2243 11.2243 11.3410 11.3410 11.5171 11.5171 11.6787 11.6787 11.9218 11.9218 12.7095 12.7095 13.2893 13.2893 13.4858 13.4858 13.6123 13.6123 13.7345 13.7345 13.9415 13.9415 14.0089 14.0089 14.0508 14.0508 14.1246 14.1246 14.7413 14.7413 14.7912 14.7912 14.9476 14.9476 15.0110 15.0110 15.3763 15.3763 15.7206 15.7206 15.7483 15.7483 16.0318 16.0318 16.0698 16.0698 16.2187 16.2187 17.1063 17.1063 17.8156 17.8156 18.4011 18.4011 18.8336 18.8336 k =-0.3147 0.5801 0.5211 ( 2800 PWs) bands (ev): -57.7694 -57.7694 -29.1852 -29.1852 -19.4342 -19.4342 -19.4164 -19.4164 11.2405 11.2405 11.3620 11.3620 11.5176 11.5176 11.6489 11.6489 11.8861 11.8861 12.6905 12.6905 13.2971 13.2971 13.4741 13.4741 13.5935 13.5935 13.7069 13.7069 13.9565 13.9565 14.0105 14.0105 14.0483 14.0483 14.1022 14.1022 14.7597 14.7597 14.8029 14.8029 14.9457 14.9457 15.0144 15.0144 15.4311 15.4311 15.7361 15.7361 15.7596 15.7596 16.0371 16.0371 16.0757 16.0757 16.2221 16.2221 17.0619 17.0619 17.8287 17.8287 18.4232 18.4232 18.8292 18.8292 k =-0.3251 0.5768 0.5294 ( 2802 PWs) bands (ev): -57.7695 -57.7695 -29.1851 -29.1851 -19.4333 -19.4333 -19.4166 -19.4166 11.2539 11.2539 11.3794 11.3794 11.5093 11.5093 11.6319 11.6319 11.8514 11.8514 12.6718 12.6718 13.3026 13.3026 13.4569 13.4569 13.5766 13.5766 13.6816 13.6816 13.9691 13.9691 14.0132 14.0132 14.0495 14.0495 14.0847 14.0847 14.7754 14.7754 14.8151 14.8151 14.9444 14.9444 15.0172 15.0172 15.4877 15.4877 15.7506 15.7506 15.7695 15.7695 16.0396 16.0396 16.0831 16.0831 16.2264 16.2264 17.0190 17.0190 17.8421 17.8421 18.4409 18.4409 18.8280 18.8280 k =-0.3356 0.5735 0.5377 ( 2794 PWs) bands (ev): -57.7695 -57.7695 -29.1849 -29.1849 -19.4324 -19.4324 -19.4168 -19.4168 11.2654 11.2654 11.3864 11.3864 11.4969 11.4969 11.6264 11.6264 11.8200 11.8200 12.6536 12.6536 13.3046 13.3046 13.4364 13.4364 13.5599 13.5599 13.6605 13.6605 13.9796 13.9796 14.0163 14.0163 14.0545 14.0545 14.0721 14.0721 14.7878 14.7878 14.8266 14.8266 14.9454 14.9454 15.0207 15.0207 15.5424 15.5424 15.7646 15.7646 15.7790 15.7790 16.0402 16.0402 16.0915 16.0915 16.2318 16.2318 16.9784 16.9784 17.8559 17.8559 18.4516 18.4516 18.8326 18.8326 k =-0.3461 0.5702 0.5459 ( 2784 PWs) bands (ev): -57.7695 -57.7695 -29.1848 -29.1848 -19.4314 -19.4314 -19.4170 -19.4170 11.2753 11.2753 11.3753 11.3753 11.4906 11.4906 11.6256 11.6256 11.7953 11.7953 12.6360 12.6360 13.3009 13.3009 13.4160 13.4160 13.5417 13.5417 13.6448 13.6448 13.9889 13.9889 14.0194 14.0194 14.0619 14.0619 14.0653 14.0653 14.7970 14.7970 14.8358 14.8358 14.9505 14.9505 15.0255 15.0255 15.5903 15.5903 15.7791 15.7791 15.7893 15.7893 16.0394 16.0394 16.1007 16.1007 16.2384 16.2384 16.9412 16.9412 17.8698 17.8698 18.4533 18.4533 18.8421 18.8421 k =-0.3461 0.5702 0.5459 ( 2784 PWs) bands (ev): -57.7695 -57.7695 -29.1848 -29.1848 -19.4314 -19.4314 -19.4170 -19.4170 11.2753 11.2753 11.3753 11.3753 11.4906 11.4906 11.6256 11.6256 11.7953 11.7953 12.6360 12.6360 13.3009 13.3009 13.4160 13.4160 13.5417 13.5417 13.6448 13.6448 13.9889 13.9889 14.0194 14.0194 14.0619 14.0619 14.0653 14.0653 14.7970 14.7970 14.8358 14.8358 14.9505 14.9505 15.0255 15.0255 15.5903 15.5903 15.7791 15.7791 15.7893 15.7893 16.0394 16.0394 16.1007 16.1007 16.2384 16.2384 16.9412 16.9412 17.8698 17.8698 18.4533 18.4533 18.8421 18.8421 k =-0.3516 0.5576 0.5459 ( 2784 PWs) bands (ev): -57.7695 -57.7695 -29.1845 -29.1845 -19.4297 -19.4297 -19.4174 -19.4174 11.2880 11.2880 11.3360 11.3360 11.4875 11.4875 11.6244 11.6244 11.7599 11.7599 12.6036 12.6036 13.2872 13.2872 13.3792 13.3792 13.5047 13.5047 13.6207 13.6207 14.0060 14.0060 14.0257 14.0257 14.0670 14.0670 14.0699 14.0699 14.8115 14.8115 14.8502 14.8502 14.9648 14.9648 15.0355 15.0355 15.6719 15.6719 15.8082 15.8082 15.8104 15.8104 16.0362 16.0362 16.1198 16.1198 16.2521 16.2521 16.8754 16.8754 17.8955 17.8955 18.4444 18.4444 18.8159 18.8159 k =-0.3571 0.5451 0.5459 ( 2788 PWs) bands (ev): -57.7696 -57.7696 -29.1842 -29.1842 -19.4279 -19.4279 -19.4178 -19.4178 11.2915 11.2915 11.2968 11.2968 11.4848 11.4848 11.6239 11.6239 11.7287 11.7287 12.5721 12.5721 13.2741 13.2741 13.3420 13.3420 13.4664 13.4664 13.5970 13.5970 14.0241 14.0241 14.0326 14.0326 14.0706 14.0706 14.0796 14.0796 14.8267 14.8267 14.8655 14.8655 14.9789 14.9789 15.0444 15.0444 15.7491 15.7491 15.8297 15.8297 15.8445 15.8445 16.0321 16.0321 16.1419 16.1419 16.2654 16.2654 16.8109 16.8109 17.9198 17.9198 18.4303 18.4303 18.7790 18.7790 k =-0.3626 0.5326 0.5459 ( 2788 PWs) bands (ev): -57.7696 -57.7696 -29.1840 -29.1840 -19.4260 -19.4260 -19.4182 -19.4182 11.2578 11.2578 11.2858 11.2858 11.4821 11.4821 11.6241 11.6241 11.7030 11.7030 12.5416 12.5416 13.2617 13.2617 13.3046 13.3046 13.4273 13.4273 13.5740 13.5740 14.0398 14.0398 14.0426 14.0426 14.0758 14.0758 14.0907 14.0907 14.8425 14.8425 14.8815 14.8815 14.9928 14.9928 15.0526 15.0526 15.8051 15.8051 15.8476 15.8476 15.9006 15.9006 16.0272 16.0272 16.1692 16.1692 16.2780 16.2780 16.7480 16.7480 17.9425 17.9425 18.4127 18.4127 18.7447 18.7447 k =-0.3681 0.5200 0.5459 ( 2784 PWs) bands (ev): -57.7697 -57.7697 -29.1837 -29.1837 -19.4242 -19.4242 -19.4186 -19.4186 11.2192 11.2192 11.2710 11.2710 11.4789 11.4789 11.6250 11.6250 11.6832 11.6832 12.5121 12.5121 13.2499 13.2499 13.2671 13.2671 13.3877 13.3877 13.5520 13.5520 14.0473 14.0473 14.0608 14.0608 14.0834 14.0834 14.1028 14.1028 14.8591 14.8591 14.8984 14.8984 15.0064 15.0064 15.0602 15.0602 15.8378 15.8378 15.8638 15.8638 15.9728 15.9728 16.0217 16.0217 16.2071 16.2071 16.2896 16.2896 16.6865 16.6865 17.9635 17.9635 18.3930 18.3930 18.7130 18.7130 k =-0.3736 0.5075 0.5459 ( 2792 PWs) bands (ev): -57.7697 -57.7697 -29.1834 -29.1834 -19.4223 -19.4223 -19.4190 -19.4190 11.1810 11.1810 11.2481 11.2481 11.4751 11.4751 11.6265 11.6265 11.6692 11.6692 12.4836 12.4836 13.2298 13.2298 13.2388 13.2388 13.3479 13.3479 13.5312 13.5312 14.0551 14.0551 14.0760 14.0760 14.0954 14.0954 14.1158 14.1158 14.8764 14.8764 14.9161 14.9161 15.0198 15.0198 15.0677 15.0677 15.8604 15.8604 15.8779 15.8779 16.0158 16.0158 16.0380 16.0380 16.2640 16.2640 16.3000 16.3000 16.6265 16.6265 17.9828 17.9828 18.3724 18.3724 18.6840 18.6840 k =-0.3791 0.4950 0.5459 ( 2792 PWs) bands (ev): -57.7698 -57.7698 -29.1832 -29.1832 -19.4205 -19.4205 -19.4193 -19.4193 11.1435 11.1435 11.2184 11.2184 11.4710 11.4710 11.6285 11.6285 11.6601 11.6601 12.4562 12.4562 13.1930 13.1930 13.2283 13.2283 13.3083 13.3083 13.5115 13.5115 14.0630 14.0630 14.0866 14.0866 14.1132 14.1132 14.1295 14.1295 14.8946 14.8946 14.9349 14.9349 15.0329 15.0329 15.0752 15.0752 15.8784 15.8784 15.8897 15.8897 16.0099 16.0099 16.0845 16.0845 16.3090 16.3090 16.3451 16.3451 16.5682 16.5682 18.0001 18.0001 18.3519 18.3519 18.6579 18.6579 k =-0.3846 0.4824 0.5459 ( 2808 PWs) bands (ev): -57.7698 -57.7698 -29.1829 -29.1829 -19.4198 -19.4198 -19.4185 -19.4185 11.1068 11.1068 11.1834 11.1834 11.4669 11.4669 11.6311 11.6311 11.6544 11.6544 12.4299 12.4299 13.1568 13.1568 13.2183 13.2183 13.2692 13.2692 13.4931 13.4931 14.0711 14.0711 14.0952 14.0952 14.1339 14.1339 14.1437 14.1437 14.9137 14.9137 14.9546 14.9546 15.0457 15.0457 15.0828 15.0828 15.8935 15.8935 15.8986 15.8986 16.0042 16.0042 16.1145 16.1145 16.3165 16.3165 16.4449 16.4449 16.5124 16.5124 18.0155 18.0155 18.3320 18.3320 18.6345 18.6345 k =-0.3901 0.4699 0.5459 ( 2804 PWs) bands (ev): -57.7699 -57.7699 -29.1826 -29.1826 -19.4202 -19.4202 -19.4167 -19.4167 11.0710 11.0710 11.1446 11.1446 11.4631 11.4631 11.6341 11.6341 11.6509 11.6509 12.4046 12.4046 13.1213 13.1213 13.2080 13.2080 13.2317 13.2317 13.4759 13.4759 14.0791 14.0791 14.1032 14.1032 14.1558 14.1558 14.1584 14.1584 14.9336 14.9336 14.9753 14.9753 15.0583 15.0583 15.0907 15.0907 15.9039 15.9039 15.9062 15.9062 15.9996 15.9996 16.1342 16.1342 16.3224 16.3224 16.4550 16.4550 16.5596 16.5596 18.0290 18.0290 18.3134 18.3134 18.6140 18.6140 k =-0.3956 0.4574 0.5459 ( 2804 PWs) bands (ev): -57.7699 -57.7699 -29.1824 -29.1824 -19.4205 -19.4205 -19.4149 -19.4149 11.0362 11.0362 11.1034 11.1034 11.4597 11.4597 11.6376 11.6376 11.6487 11.6487 12.3806 12.3806 13.0868 13.0868 13.1874 13.1874 13.2057 13.2057 13.4599 13.4599 14.0870 14.0870 14.1110 14.1110 14.1730 14.1730 14.1786 14.1786 14.9545 14.9545 14.9970 14.9970 15.0707 15.0707 15.0991 15.0991 15.9052 15.9052 15.9165 15.9165 15.9964 15.9964 16.1473 16.1473 16.3267 16.3267 16.4028 16.4028 16.6779 16.6779 18.0406 18.0406 18.2964 18.2964 18.5963 18.5963 k =-0.4011 0.4448 0.5459 ( 2796 PWs) bands (ev): -57.7700 -57.7700 -29.1821 -29.1821 -19.4208 -19.4208 -19.4130 -19.4130 11.0025 11.0025 11.0608 11.0608 11.4568 11.4568 11.6414 11.6414 11.6471 11.6471 12.3576 12.3576 13.0533 13.0533 13.1524 13.1524 13.1958 13.1958 13.4451 13.4451 14.0948 14.0948 14.1187 14.1187 14.1880 14.1880 14.2015 14.2015 14.9762 14.9762 15.0197 15.0197 15.0828 15.0828 15.1081 15.1081 15.9023 15.9023 15.9246 15.9246 15.9947 15.9947 16.1550 16.1550 16.3294 16.3294 16.3530 16.3530 16.8003 16.8003 18.0503 18.0503 18.2812 18.2812 18.5813 18.5813 k =-0.4066 0.4323 0.5459 ( 2796 PWs) bands (ev): -57.7700 -57.7700 -29.1818 -29.1818 -19.4212 -19.4212 -19.4113 -19.4113 10.9701 10.9701 11.0178 11.0178 11.4543 11.4543 11.6456 11.6456 11.6458 11.6458 12.3359 12.3359 13.0210 13.0210 13.1166 13.1166 13.1884 13.1884 13.4315 13.4315 14.1024 14.1024 14.1262 14.1262 14.2029 14.2029 14.2246 14.2246 14.9989 14.9989 15.0433 15.0433 15.0948 15.0948 15.1177 15.1177 15.8955 15.8955 15.9303 15.9303 15.9942 15.9942 16.1567 16.1567 16.3077 16.3077 16.3306 16.3306 16.9245 16.9245 18.0584 18.0584 18.2680 18.2680 18.5688 18.5688 k =-0.4121 0.4198 0.5459 ( 2792 PWs) bands (ev): -57.7701 -57.7701 -29.1815 -29.1815 -19.4215 -19.4215 -19.4096 -19.4096 10.9390 10.9390 10.9751 10.9751 11.4521 11.4521 11.6444 11.6444 11.6501 11.6501 12.3153 12.3153 12.9901 12.9901 13.0818 13.0818 13.1818 13.1818 13.4190 13.4190 14.1096 14.1096 14.1335 14.1335 14.2178 14.2178 14.2476 14.2476 15.0223 15.0223 15.0679 15.0679 15.1068 15.1068 15.1282 15.1282 15.8856 15.8856 15.9337 15.9337 15.9939 15.9939 16.1496 16.1496 16.2705 16.2705 16.3303 16.3303 17.0490 17.0490 18.0649 18.0649 18.2571 18.2571 18.5588 18.5588 k =-0.4176 0.4072 0.5459 ( 2796 PWs) bands (ev): -57.7701 -57.7701 -29.1813 -29.1813 -19.4218 -19.4218 -19.4079 -19.4079 10.9094 10.9094 10.9331 10.9331 11.4503 11.4503 11.6428 11.6428 11.6548 11.6548 12.2959 12.2959 12.9606 12.9606 13.0481 13.0481 13.1758 13.1758 13.4076 13.4076 14.1166 14.1166 14.1405 14.1405 14.2325 14.2325 14.2704 14.2704 15.0465 15.0465 15.0930 15.0930 15.1190 15.1190 15.1395 15.1395 15.8734 15.8734 15.9345 15.9345 15.9930 15.9930 16.1294 16.1294 16.2460 16.2460 16.3289 16.3289 17.1727 17.1727 18.0700 18.0700 18.2486 18.2486 18.5510 18.5510 k =-0.4231 0.3947 0.5459 ( 2796 PWs) bands (ev): -57.7701 -57.7701 -29.1811 -29.1811 -19.4221 -19.4221 -19.4063 -19.4063 10.8813 10.8813 10.8924 10.8924 11.4489 11.4489 11.6411 11.6411 11.6596 11.6596 12.2778 12.2778 12.9326 12.9326 13.0158 13.0158 13.1705 13.1705 13.3972 13.3972 14.1232 14.1232 14.1472 14.1472 14.2468 14.2468 14.2929 14.2929 15.0714 15.0714 15.1173 15.1173 15.1327 15.1327 15.1519 15.1519 15.8595 15.8595 15.9327 15.9327 15.9908 15.9908 16.0969 16.0969 16.2340 16.2340 16.3265 16.3265 17.2942 17.2942 18.0740 18.0740 18.2426 18.2426 18.5451 18.5451 k =-0.4286 0.3822 0.5459 ( 2796 PWs) bands (ev): -57.7702 -57.7702 -29.1809 -29.1809 -19.4224 -19.4224 -19.4048 -19.4048 10.8533 10.8533 10.8548 10.8548 11.4476 11.4476 11.6391 11.6391 11.6646 11.6646 12.2608 12.2608 12.9062 12.9062 12.9851 12.9851 13.1656 13.1656 13.3877 13.3877 14.1295 14.1295 14.1536 14.1536 14.2607 14.2607 14.3149 14.3149 15.0967 15.0967 15.1358 15.1358 15.1529 15.1529 15.1655 15.1655 15.8443 15.8443 15.9283 15.9283 15.9870 15.9870 16.0575 16.0575 16.2293 16.2293 16.3235 16.3235 17.4124 17.4124 18.0769 18.0769 18.2394 18.2394 18.5409 18.5409 k =-0.4341 0.3696 0.5459 ( 2804 PWs) bands (ev): -57.7702 -57.7702 -29.1807 -29.1807 -19.4227 -19.4227 -19.4034 -19.4034 10.8162 10.8162 10.8300 10.8300 11.4466 11.4466 11.6370 11.6370 11.6696 11.6696 12.2450 12.2450 12.8815 12.8815 12.9561 12.9561 13.1613 13.1613 13.3792 13.3792 14.1353 14.1353 14.1596 14.1596 14.2741 14.2741 14.3361 14.3361 15.1222 15.1222 15.1487 15.1487 15.1793 15.1793 15.1806 15.1806 15.8283 15.8283 15.9210 15.9210 15.9810 15.9810 16.0156 16.0156 16.2279 16.2279 16.3201 16.3201 17.5259 17.5259 18.0790 18.0790 18.2394 18.2394 18.5381 18.5381 k =-0.4395 0.3571 0.5459 ( 2800 PWs) bands (ev): -57.7703 -57.7703 -29.1804 -29.1804 -19.4230 -19.4230 -19.4020 -19.4020 10.7812 10.7812 10.8070 10.8070 11.4458 11.4458 11.6348 11.6348 11.6746 11.6746 12.2305 12.2305 12.8585 12.8585 12.9289 12.9289 13.1574 13.1574 13.3715 13.3715 14.1406 14.1406 14.1651 14.1651 14.2868 14.2868 14.3565 14.3565 15.1475 15.1475 15.1601 15.1601 15.1972 15.1972 15.2076 15.2076 15.8117 15.8117 15.9106 15.9106 15.9726 15.9726 15.9739 15.9739 16.2279 16.2279 16.3166 16.3166 17.6332 17.6332 18.0804 18.0804 18.2429 18.2429 18.5366 18.5366 k =-0.4450 0.3446 0.5459 ( 2800 PWs) bands (ev): -57.7703 -57.7703 -29.1803 -29.1803 -19.4232 -19.4232 -19.4007 -19.4007 10.7487 10.7487 10.7857 10.7857 11.4452 11.4452 11.6325 11.6325 11.6795 11.6795 12.2172 12.2172 12.8373 12.8373 12.9036 12.9036 13.1540 13.1540 13.3647 13.3647 14.1456 14.1456 14.1702 14.1702 14.2988 14.2988 14.3759 14.3759 15.1711 15.1711 15.1721 15.1721 15.2159 15.2159 15.2366 15.2366 15.7949 15.7949 15.8960 15.8960 15.9340 15.9340 15.9623 15.9623 16.2287 16.2287 16.3131 16.3131 17.7323 17.7323 18.0814 18.0814 18.2509 18.2509 18.5360 18.5360 k =-0.4505 0.3320 0.5459 ( 2784 PWs) bands (ev): -57.7703 -57.7703 -29.1800 -29.1800 -19.4234 -19.4234 -19.3996 -19.3996 10.7188 10.7188 10.7663 10.7663 11.4447 11.4447 11.6303 11.6303 11.6842 11.6842 12.2052 12.2052 12.8180 12.8180 12.8803 12.8803 13.1509 13.1509 13.3586 13.3586 14.1500 14.1500 14.1749 14.1749 14.3099 14.3099 14.3941 14.3941 15.1817 15.1817 15.1955 15.1955 15.2370 15.2370 15.2660 15.2660 15.7781 15.7781 15.8726 15.8726 15.9021 15.9021 15.9497 15.9497 16.2298 16.2298 16.3100 16.3100 17.8209 17.8209 18.0819 18.0819 18.2645 18.2645 18.5362 18.5362 k =-0.4560 0.3195 0.5459 ( 2784 PWs) bands (ev): -57.7703 -57.7703 -29.1799 -29.1799 -19.4236 -19.4236 -19.3985 -19.3985 10.6916 10.6916 10.7488 10.7488 11.4443 11.4443 11.6281 11.6281 11.6887 11.6887 12.1944 12.1944 12.8006 12.8006 12.8591 12.8591 13.1482 13.1482 13.3533 13.3533 14.1540 14.1540 14.1791 14.1791 14.3201 14.3201 14.4109 14.4109 15.1918 15.1918 15.2175 15.2175 15.2601 15.2601 15.2953 15.2953 15.7616 15.7616 15.8384 15.8384 15.8804 15.8804 15.9350 15.9350 16.2310 16.2310 16.3072 16.3072 17.8966 17.8966 18.0822 18.0822 18.2851 18.2851 18.5368 18.5368 k =-0.4615 0.3070 0.5459 ( 2788 PWs) bands (ev): -57.7704 -57.7704 -29.1798 -29.1798 -19.4237 -19.4237 -19.3976 -19.3976 10.6673 10.6673 10.7333 10.7333 11.4440 11.4440 11.6260 11.6260 11.6929 11.6929 12.1849 12.1849 12.7851 12.7851 12.8401 12.8401 13.1459 13.1459 13.3487 13.3487 14.1575 14.1575 14.1827 14.1827 14.3293 14.3293 14.4262 14.4262 15.2016 15.2016 15.2382 15.2382 15.2847 15.2847 15.3242 15.3242 15.7457 15.7457 15.8013 15.8013 15.8621 15.8621 15.9188 15.9188 16.2323 16.2323 16.3049 16.3049 17.9573 17.9573 18.0822 18.0822 18.3135 18.3135 18.5379 18.5379 k =-0.4670 0.2944 0.5459 ( 2784 PWs) bands (ev): -57.7704 -57.7704 -29.1796 -29.1796 -19.4239 -19.4239 -19.3967 -19.3967 10.6460 10.6460 10.7198 10.7198 11.4438 11.4438 11.6240 11.6240 11.6967 11.6967 12.1766 12.1766 12.7717 12.7717 12.8235 12.8235 13.1440 13.1440 13.3447 13.3447 14.1606 14.1606 14.1859 14.1859 14.3374 14.3374 14.4398 14.4398 15.2106 15.2106 15.2578 15.2578 15.3100 15.3100 15.3522 15.3522 15.7308 15.7308 15.7649 15.7649 15.8444 15.8444 15.9015 15.9015 16.2336 16.2336 16.3031 16.3031 18.0027 18.0027 18.0821 18.0821 18.3489 18.3489 18.5392 18.5392 k =-0.4725 0.2819 0.5459 ( 2776 PWs) bands (ev): -57.7704 -57.7704 -29.1795 -29.1795 -19.4240 -19.4240 -19.3960 -19.3960 10.6279 10.6279 10.7083 10.7083 11.4436 11.4436 11.6223 11.6223 11.7001 11.7001 12.1696 12.1696 12.7602 12.7602 12.8092 12.8092 13.1423 13.1423 13.3414 13.3414 14.1632 14.1632 14.1887 14.1887 14.3444 14.3444 14.4516 14.4516 15.2189 15.2189 15.2763 15.2763 15.3350 15.3350 15.3787 15.3787 15.7172 15.7172 15.7303 15.7303 15.8272 15.8272 15.8840 15.8840 16.2348 16.2348 16.3016 16.3016 18.0346 18.0346 18.0820 18.0820 18.3882 18.3882 18.5405 18.5405 k =-0.4780 0.2694 0.5459 ( 2788 PWs) bands (ev): -57.7704 -57.7704 -29.1794 -29.1794 -19.4241 -19.4241 -19.3955 -19.3955 10.6129 10.6129 10.6989 10.6989 11.4435 11.4435 11.6209 11.6209 11.7029 11.7029 12.1638 12.1638 12.7508 12.7508 12.7975 12.7975 13.1410 13.1410 13.3388 13.3388 14.1652 14.1652 14.1909 14.1909 14.3502 14.3502 14.4614 14.4614 15.2262 15.2262 15.2934 15.2934 15.3588 15.3588 15.4029 15.4029 15.6986 15.6986 15.7052 15.7052 15.8110 15.8110 15.8670 15.8670 16.2358 16.2358 16.3005 16.3005 18.0562 18.0562 18.0818 18.0818 18.4272 18.4272 18.5417 18.5417 k =-0.4835 0.2568 0.5459 ( 2788 PWs) bands (ev): -57.7704 -57.7704 -29.1794 -29.1794 -19.4242 -19.4242 -19.3950 -19.3950 10.6012 10.6012 10.6915 10.6915 11.4435 11.4435 11.6197 11.6197 11.7052 11.7052 12.1594 12.1594 12.7435 12.7435 12.7882 12.7882 13.1400 13.1400 13.3367 13.3367 14.1669 14.1669 14.1926 14.1926 14.3547 14.3547 14.4692 14.4692 15.2322 15.2322 15.3083 15.3083 15.3803 15.3803 15.4237 15.4237 15.6707 15.6707 15.6953 15.6953 15.7969 15.7969 15.8517 15.8517 16.2367 16.2367 16.2998 16.2998 18.0703 18.0703 18.0816 18.0816 18.4617 18.4617 18.5428 18.5428 k =-0.4890 0.2443 0.5459 ( 2776 PWs) bands (ev): -57.7704 -57.7704 -29.1793 -29.1793 -19.4243 -19.4243 -19.3946 -19.3946 10.5929 10.5929 10.6862 10.6862 11.4434 11.4434 11.6189 11.6189 11.7068 11.7068 12.1562 12.1562 12.7383 12.7383 12.7816 12.7816 13.1393 13.1393 13.3353 13.3353 14.1680 14.1680 14.1938 14.1938 14.3580 14.3580 14.4748 14.4748 15.2367 15.2367 15.3201 15.3201 15.3982 15.3982 15.4401 15.4401 15.6482 15.6482 15.6878 15.6878 15.7858 15.7858 15.8395 15.8395 16.2373 16.2373 16.2993 16.2993 18.0792 18.0792 18.0815 18.0815 18.4886 18.4886 18.5436 18.5436 k =-0.4945 0.2318 0.5459 ( 2760 PWs) bands (ev): -57.7704 -57.7704 -29.1792 -29.1792 -19.4243 -19.4243 -19.3944 -19.3944 10.5878 10.5878 10.6830 10.6830 11.4434 11.4434 11.6184 11.6184 11.7078 11.7078 12.1543 12.1543 12.7351 12.7351 12.7776 12.7776 13.1389 13.1389 13.3344 13.3344 14.1687 14.1687 14.1946 14.1946 14.3599 14.3599 14.4782 14.4782 15.2395 15.2395 15.3277 15.3277 15.4103 15.4103 15.4506 15.4506 15.6331 15.6331 15.6831 15.6831 15.7786 15.7786 15.8315 15.8315 16.2377 16.2377 16.2990 16.2990 18.0814 18.0814 18.0841 18.0841 18.5056 18.5056 18.5441 18.5441 k =-0.5000 0.2192 0.5459 ( 2752 PWs) bands (ev): -57.7704 -57.7704 -29.1792 -29.1792 -19.4243 -19.4243 -19.3943 -19.3943 10.5861 10.5861 10.6820 10.6820 11.4434 11.4434 11.6182 11.6182 11.7082 11.7082 12.1536 12.1536 12.7341 12.7341 12.7763 12.7763 13.1387 13.1387 13.3341 13.3341 14.1690 14.1690 14.1948 14.1948 14.3606 14.3606 14.4793 14.4793 15.2404 15.2404 15.3304 15.3304 15.4147 15.4147 15.4542 15.4542 15.6277 15.6277 15.6815 15.6815 15.7761 15.7761 15.8287 15.8287 16.2379 16.2379 16.2989 16.2989 18.0814 18.0814 18.0857 18.0857 18.5114 18.5114 18.5443 18.5443 k = 0.0000 0.0000 0.5459 ( 2778 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4206 -19.4206 -19.3924 -19.3924 9.1409 9.1409 9.8464 9.8464 11.3031 11.3031 12.1193 12.1193 12.3094 12.3094 12.6098 12.6098 12.9443 12.9443 13.2462 13.2462 13.4574 13.4574 13.6357 13.6357 14.1108 14.1108 14.1216 14.1216 14.3985 14.3985 14.6048 14.6048 14.7780 14.7780 14.9773 14.9773 15.1089 15.1089 15.1509 15.1509 15.1958 15.1958 15.6661 15.6661 15.8214 15.8214 15.9328 15.9328 16.8891 16.8891 17.2278 17.2278 17.4139 17.4139 18.1331 18.1331 18.5856 18.5856 18.6500 18.6500 k = 0.0056 0.0127 0.5459 ( 2770 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4205 -19.4205 -19.3925 -19.3925 9.1426 9.1426 9.8472 9.8472 11.3043 11.3043 12.1200 12.1200 12.3103 12.3103 12.6096 12.6096 12.9444 12.9444 13.2454 13.2454 13.4583 13.4583 13.6358 13.6358 14.1104 14.1104 14.1215 14.1215 14.3984 14.3984 14.6038 14.6038 14.7777 14.7777 14.9727 14.9727 15.1108 15.1108 15.1549 15.1549 15.1958 15.1958 15.6658 15.6658 15.8202 15.8202 15.9329 15.9329 16.8880 16.8880 17.2198 17.2198 17.4142 17.4142 18.1319 18.1319 18.5582 18.5582 18.6869 18.6869 k = 0.0111 0.0253 0.5459 ( 2772 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4205 -19.4205 -19.3927 -19.3927 9.1475 9.1475 9.8494 9.8494 11.3080 11.3080 12.1220 12.1220 12.3129 12.3129 12.6090 12.6090 12.9446 12.9446 13.2429 13.2429 13.4607 13.4607 13.6362 13.6362 14.1091 14.1091 14.1213 14.1213 14.3981 14.3981 14.6011 14.6011 14.7768 14.7768 14.9604 14.9604 15.1155 15.1155 15.1658 15.1658 15.1959 15.1959 15.6649 15.6649 15.8169 15.8169 15.9331 15.9331 16.8844 16.8844 17.1966 17.1966 17.4153 17.4153 18.1282 18.1282 18.5197 18.5197 18.7531 18.7531 k = 0.0167 0.0380 0.5459 ( 2772 PWs) bands (ev): -57.7706 -57.7706 -29.1786 -29.1786 -19.4205 -19.4205 -19.3930 -19.3930 9.1557 9.1557 9.8531 9.8531 11.3141 11.3141 12.1254 12.1254 12.3172 12.3172 12.6080 12.6080 12.9447 12.9447 13.2391 13.2391 13.4647 13.4647 13.6368 13.6368 14.1071 14.1071 14.1207 14.1207 14.3975 14.3975 14.5965 14.5965 14.7755 14.7755 14.9434 14.9434 15.1219 15.1219 15.1800 15.1800 15.1982 15.1982 15.6635 15.6635 15.8115 15.8115 15.9332 15.9332 16.8776 16.8776 17.1603 17.1603 17.4174 17.4174 18.1226 18.1226 18.4854 18.4854 18.8313 18.8313 k = 0.0222 0.0507 0.5459 ( 2772 PWs) bands (ev): -57.7706 -57.7706 -29.1787 -29.1787 -19.4204 -19.4204 -19.3935 -19.3935 9.1671 9.1671 9.8582 9.8582 11.3227 11.3227 12.1301 12.1301 12.3232 12.3232 12.6067 12.6067 12.9447 12.9447 13.2342 13.2342 13.4701 13.4701 13.6376 13.6376 14.1044 14.1044 14.1199 14.1199 14.3966 14.3966 14.5903 14.5903 14.7737 14.7737 14.9238 14.9238 15.1293 15.1293 15.1866 15.1866 15.2112 15.2112 15.6616 15.6616 15.8042 15.8042 15.9331 15.9331 16.8659 16.8659 17.1149 17.1149 17.4206 17.4206 18.1153 18.1153 18.4554 18.4554 18.9186 18.9186 k = 0.0278 0.0634 0.5459 ( 2782 PWs) bands (ev): -57.7706 -57.7706 -29.1788 -29.1788 -19.4204 -19.4204 -19.3941 -19.3941 9.1818 9.1818 9.8648 9.8648 11.3336 11.3336 12.1362 12.1362 12.3307 12.3307 12.6052 12.6052 12.9442 12.9442 13.2285 13.2285 13.4769 13.4769 13.6387 13.6387 14.1012 14.1012 14.1188 14.1188 14.3955 14.3955 14.5824 14.5824 14.7715 14.7715 14.9033 14.9033 15.1376 15.1376 15.1863 15.1863 15.2328 15.2328 15.6592 15.6592 15.7955 15.7955 15.9328 15.9328 16.8461 16.8461 17.0659 17.0659 17.4250 17.4250 18.1068 18.1068 18.4284 18.4284 19.0136 19.0136 k = 0.0333 0.0760 0.5459 ( 2790 PWs) bands (ev): -57.7706 -57.7706 -29.1790 -29.1790 -19.4203 -19.4203 -19.3948 -19.3948 9.1997 9.1997 9.8729 9.8729 11.3469 11.3469 12.1435 12.1435 12.3395 12.3395 12.6036 12.6036 12.9428 12.9428 13.2227 13.2227 13.4848 13.4848 13.6401 13.6401 14.0976 14.0976 14.1174 14.1174 14.3940 14.3940 14.5732 14.5732 14.7689 14.7689 14.8828 14.8828 15.1463 15.1463 15.1844 15.1844 15.2566 15.2566 15.6564 15.6564 15.7855 15.7855 15.9320 15.9320 16.8136 16.8136 17.0206 17.0206 17.4307 17.4307 18.0973 18.0973 18.4035 18.4035 19.1147 19.1147 k = 0.0389 0.0887 0.5459 ( 2790 PWs) bands (ev): -57.7705 -57.7705 -29.1791 -29.1791 -19.4202 -19.4202 -19.3957 -19.3957 9.2207 9.2207 9.8824 9.8824 11.3625 11.3625 12.1521 12.1521 12.3496 12.3496 12.6020 12.6020 12.9402 12.9402 13.2172 13.2172 13.4938 13.4938 13.6417 13.6417 14.0937 14.0937 14.1157 14.1157 14.3921 14.3921 14.5628 14.5628 14.7659 14.7659 14.8629 14.8629 15.1547 15.1547 15.1821 15.1821 15.2808 15.2808 15.6533 15.6533 15.7747 15.7747 15.9307 15.9307 16.7646 16.7646 16.9849 16.9849 17.4374 17.4374 18.0870 18.0870 18.3797 18.3797 19.2208 19.2208 k = 0.0444 0.1014 0.5459 ( 2790 PWs) bands (ev): -57.7705 -57.7705 -29.1792 -29.1792 -19.4201 -19.4201 -19.3966 -19.3966 9.2449 9.2449 9.8934 9.8934 11.3805 11.3805 12.1618 12.1618 12.3606 12.3606 12.6007 12.6007 12.9358 12.9358 13.2126 13.2126 13.5038 13.5038 13.6436 13.6436 14.0895 14.0895 14.1138 14.1138 14.3898 14.3898 14.5513 14.5513 14.7622 14.7622 14.8443 14.8443 15.1613 15.1613 15.1810 15.1810 15.3045 15.3045 15.6500 15.6500 15.7632 15.7632 15.9288 15.9288 16.7003 16.7003 16.9594 16.9594 17.4453 17.4453 18.0759 18.0759 18.3564 18.3564 19.3306 19.3306 k = 0.0500 0.1140 0.5459 ( 2790 PWs) bands (ev): -57.7705 -57.7705 -29.1794 -29.1794 -19.4199 -19.4199 -19.3977 -19.3977 9.2721 9.2721 9.9058 9.9058 11.4007 11.4007 12.1727 12.1727 12.3720 12.3720 12.6002 12.6002 12.9292 12.9292 13.2097 13.2097 13.5147 13.5147 13.6458 13.6458 14.0852 14.0852 14.1117 14.1117 14.3870 14.3870 14.5390 14.5390 14.7575 14.7575 14.8274 14.8274 15.1629 15.1629 15.1838 15.1838 15.3271 15.3271 15.6466 15.6466 15.7514 15.7514 15.9263 15.9263 16.6256 16.6256 16.9406 16.9406 17.4542 17.4542 18.0641 18.0641 18.3334 18.3334 19.4433 19.4433 k = 0.0556 0.1267 0.5459 ( 2796 PWs) bands (ev): -57.7705 -57.7705 -29.1796 -29.1796 -19.4198 -19.4198 -19.3989 -19.3989 9.3024 9.3024 9.9196 9.9196 11.4230 11.4230 12.1846 12.1846 12.3834 12.3834 12.6008 12.6008 12.9198 12.9198 13.2089 13.2089 13.5265 13.5265 13.6482 13.6482 14.0809 14.0809 14.1094 14.1094 14.3838 14.3838 14.5260 14.5260 14.7515 14.7515 14.8129 14.8129 15.1595 15.1595 15.1900 15.1900 15.3478 15.3478 15.6432 15.6432 15.7396 15.7396 15.9233 15.9233 16.5452 16.5452 16.9253 16.9253 17.4641 17.4641 18.0516 18.0516 18.3105 18.3105 19.5579 19.5579 k = 0.0611 0.1394 0.5459 ( 2798 PWs) bands (ev): -57.7704 -57.7704 -29.1798 -29.1798 -19.4196 -19.4196 -19.4002 -19.4002 9.3355 9.3355 9.9348 9.9348 11.4475 11.4475 12.1975 12.1975 12.3940 12.3940 12.6032 12.6032 12.9075 12.9075 13.2106 13.2106 13.5391 13.5391 13.6511 13.6511 14.0766 14.0766 14.1071 14.1071 14.3800 14.3800 14.5125 14.5125 14.7439 14.7439 14.8010 14.8010 15.1536 15.1536 15.1968 15.1968 15.3658 15.3658 15.6401 15.6401 15.7282 15.7282 15.9198 15.9198 16.4624 16.4624 16.9113 16.9113 17.4749 17.4749 18.0385 18.0385 18.2876 18.2876 19.6736 19.6736 k = 0.0667 0.1520 0.5459 ( 2798 PWs) bands (ev): -57.7704 -57.7704 -29.1800 -29.1800 -19.4195 -19.4195 -19.4015 -19.4015 9.3716 9.3716 9.9515 9.9515 11.4740 11.4740 12.2112 12.2112 12.4030 12.4030 12.6084 12.6084 12.8921 12.8921 13.2152 13.2152 13.5524 13.5524 13.6542 13.6542 14.0723 14.0723 14.1047 14.1047 14.3757 14.3757 14.4988 14.4988 14.7346 14.7346 14.7918 14.7918 15.1463 15.1463 15.2027 15.2027 15.3804 15.3804 15.6372 15.6372 15.7173 15.7173 15.9158 15.9158 16.3797 16.3797 16.8974 16.8974 17.4866 17.4866 18.0250 18.0250 18.2647 18.2647 19.7895 19.7895 k = 0.0722 0.1647 0.5459 ( 2798 PWs) bands (ev): -57.7703 -57.7703 -29.1803 -29.1803 -19.4193 -19.4193 -19.4029 -19.4029 9.4104 9.4104 9.9696 9.9696 11.5025 11.5025 12.2254 12.2254 12.4094 12.4094 12.6169 12.6169 12.8739 12.8739 13.2225 13.2225 13.5666 13.5666 13.6577 13.6577 14.0683 14.0683 14.1024 14.1024 14.3709 14.3709 14.4848 14.4848 14.7242 14.7242 14.7849 14.7849 15.1378 15.1378 15.2071 15.2071 15.3906 15.3906 15.6346 15.6346 15.7073 15.7073 15.9115 15.9115 16.2991 16.2991 16.8829 16.8829 17.4989 17.4989 18.0111 18.0111 18.2419 18.2419 19.9046 19.9046 k = 0.0778 0.1774 0.5459 ( 2794 PWs) bands (ev): -57.7703 -57.7703 -29.1805 -29.1805 -19.4192 -19.4192 -19.4044 -19.4044 9.4519 9.4519 9.9890 9.9890 11.5328 11.5328 12.2400 12.2400 12.4126 12.4126 12.6295 12.6295 12.8534 12.8534 13.2325 13.2325 13.5814 13.5814 13.6617 13.6617 14.0645 14.0645 14.1001 14.1001 14.3657 14.3657 14.4708 14.4708 14.7132 14.7132 14.7796 14.7796 15.1282 15.1282 15.2096 15.2096 15.3954 15.3954 15.6318 15.6318 15.6984 15.6984 15.9071 15.9071 16.2227 16.2227 16.8674 16.8674 17.5119 17.5119 17.9969 17.9969 18.2193 18.2193 20.0177 20.0177 k = 0.0833 0.1901 0.5459 ( 2802 PWs) bands (ev): -57.7703 -57.7703 -29.1808 -29.1808 -19.4191 -19.4191 -19.4060 -19.4060 9.4961 9.4961 10.0099 10.0099 11.5649 11.5649 12.2546 12.2546 12.4122 12.4122 12.6461 12.6461 12.8313 12.8313 13.2450 13.2450 13.5969 13.5969 13.6660 13.6660 14.0609 14.0609 14.0979 14.0979 14.3600 14.3600 14.4568 14.4568 14.7022 14.7022 14.7751 14.7751 15.1175 15.1175 15.2099 15.2099 15.3938 15.3938 15.6282 15.6282 15.6905 15.6905 15.9027 15.9027 16.1526 16.1526 16.8504 16.8504 17.5254 17.5254 17.9827 17.9827 18.1970 18.1970 20.1269 20.1269 k = 0.0889 0.2027 0.5459 ( 2794 PWs) bands (ev): -57.7702 -57.7702 -29.1810 -29.1810 -19.4189 -19.4189 -19.4076 -19.4076 9.5427 9.5427 10.0321 10.0321 11.5986 11.5986 12.2687 12.2687 12.4084 12.4084 12.6663 12.6663 12.8086 12.8086 13.2599 13.2599 13.6130 13.6130 13.6709 13.6709 14.0577 14.0577 14.0959 14.0959 14.3540 14.3540 14.4430 14.4430 14.6916 14.6916 14.7712 14.7712 15.1056 15.1056 15.2077 15.2077 15.3851 15.3851 15.6227 15.6227 15.6837 15.6837 15.8985 15.8985 16.0914 16.0914 16.8320 16.8320 17.5393 17.5393 17.9685 17.9685 18.1751 18.1751 20.2297 20.2297 k = 0.0944 0.2154 0.5459 ( 2794 PWs) bands (ev): -57.7702 -57.7702 -29.1813 -29.1813 -19.4189 -19.4189 -19.4091 -19.4091 9.5918 9.5918 10.0557 10.0557 11.6339 11.6339 12.2817 12.2817 12.4014 12.4014 12.6883 12.6883 12.7877 12.7877 13.2768 13.2768 13.6295 13.6295 13.6764 13.6764 14.0548 14.0548 14.0941 14.0941 14.3476 14.3476 14.4295 14.4295 14.6815 14.6815 14.7675 14.7675 15.0925 15.0925 15.2030 15.2030 15.3682 15.3682 15.6142 15.6142 15.6775 15.6775 15.8948 15.8948 16.0414 16.0414 16.8118 16.8118 17.5534 17.5534 17.9546 17.9546 18.1538 18.1538 20.3218 20.3218 k = 0.1000 0.2281 0.5459 ( 2794 PWs) bands (ev): -57.7701 -57.7701 -29.1816 -29.1816 -19.4189 -19.4189 -19.4107 -19.4107 9.6431 9.6431 10.0806 10.0806 11.6705 11.6705 12.2926 12.2926 12.3916 12.3916 12.7071 12.7071 12.7742 12.7742 13.2955 13.2955 13.6461 13.6461 13.6829 13.6829 14.0523 14.0523 14.0926 14.0926 14.3410 14.3410 14.4163 14.4163 14.6720 14.6720 14.7638 14.7638 15.0782 15.0782 15.1958 15.1958 15.3425 15.3425 15.6025 15.6025 15.6715 15.6715 15.8918 15.8918 16.0045 16.0045 16.7899 16.7899 17.5676 17.5676 17.9412 17.9412 18.1331 18.1331 20.3969 20.3969 k = 0.1056 0.2407 0.5459 ( 2798 PWs) bands (ev): -57.7701 -57.7701 -29.1819 -29.1819 -19.4191 -19.4191 -19.4121 -19.4121 9.6967 9.6967 10.1069 10.1069 11.7084 11.7084 12.3004 12.3004 12.3793 12.3793 12.7107 12.7107 12.7811 12.7811 13.3159 13.3159 13.6623 13.6623 13.6907 13.6907 14.0502 14.0502 14.0913 14.0913 14.3343 14.3343 14.4034 14.4034 14.6630 14.6630 14.7600 14.7600 15.0625 15.0625 15.1860 15.1860 15.3077 15.3077 15.5882 15.5882 15.6654 15.6654 15.8899 15.8899 15.9807 15.9807 16.7662 16.7662 17.5819 17.5819 17.9283 17.9283 18.1133 18.1133 20.4458 20.4458 k = 0.1111 0.2534 0.5459 ( 2786 PWs) bands (ev): -57.7700 -57.7700 -29.1821 -29.1821 -19.4196 -19.4196 -19.4132 -19.4132 9.7522 9.7522 10.1345 10.1345 11.7474 11.7474 12.3036 12.3036 12.3647 12.3647 12.7016 12.7016 12.8073 12.8073 13.3379 13.3379 13.6767 13.6767 13.7013 13.7013 14.0485 14.0485 14.0903 14.0903 14.3276 14.3276 14.3910 14.3910 14.6544 14.6544 14.7560 14.7560 15.0452 15.0452 15.1735 15.1735 15.2649 15.2649 15.5726 15.5726 15.6588 15.6588 15.8891 15.8891 15.9684 15.9684 16.7406 16.7406 17.5959 17.5959 17.9163 17.9163 18.0945 18.0945 20.4586 20.4586 k = 0.1167 0.2661 0.5459 ( 2782 PWs) bands (ev): -57.7699 -57.7699 -29.1824 -29.1824 -19.4204 -19.4204 -19.4140 -19.4140 9.8097 9.8097 10.1634 10.1634 11.7872 11.7872 12.3010 12.3010 12.3476 12.3476 12.6924 12.6924 12.8416 12.8416 13.3612 13.3612 13.6882 13.6882 13.7155 13.7155 14.0473 14.0473 14.0896 14.0896 14.3208 14.3208 14.3790 14.3790 14.6463 14.6463 14.7518 14.7518 15.0257 15.0257 15.1570 15.1570 15.2170 15.2170 15.5573 15.5573 15.6514 15.6514 15.8899 15.8899 15.9650 15.9650 16.7133 16.7133 17.6096 17.6096 17.9054 17.9054 18.0769 18.0769 20.4314 20.4314 k = 0.1222 0.2788 0.5459 ( 2786 PWs) bands (ev): -57.7699 -57.7699 -29.1827 -29.1827 -19.4216 -19.4216 -19.4145 -19.4145 9.8689 9.8689 10.1937 10.1937 11.8277 11.8277 12.2918 12.2918 12.3280 12.3280 12.6883 12.6883 12.8797 12.8797 13.3857 13.3857 13.6977 13.6977 13.7326 13.7326 14.0465 14.0465 14.0892 14.0892 14.3141 14.3141 14.3675 14.3675 14.6384 14.6384 14.7473 14.7473 15.0032 15.0032 15.1311 15.1311 15.1727 15.1727 15.5432 15.5432 15.6431 15.6431 15.8922 15.8922 15.9677 15.9677 16.6842 16.6842 17.6227 17.6227 17.8957 17.8957 18.0605 18.0605 20.3694 20.3694 k = 0.1278 0.2914 0.5459 ( 2786 PWs) bands (ev): -57.7698 -57.7698 -29.1830 -29.1830 -19.4231 -19.4231 -19.4147 -19.4147 9.9297 9.9297 10.2253 10.2253 11.8685 11.8685 12.2755 12.2755 12.3059 12.3059 12.6910 12.6910 12.9205 12.9205 13.4113 13.4113 13.7062 13.7062 13.7512 13.7512 14.0463 14.0463 14.0890 14.0890 14.3076 14.3076 14.3565 14.3565 14.6305 14.6305 14.7424 14.7424 14.9755 14.9755 15.0881 15.0881 15.1441 15.1441 15.5309 15.5309 15.6336 15.6336 15.8961 15.8961 15.9743 15.9743 16.6535 16.6535 17.6352 17.6352 17.8875 17.8875 18.0457 18.0457 20.2826 20.2826 k = 0.1333 0.3041 0.5459 ( 2790 PWs) bands (ev): -57.7698 -57.7698 -29.1833 -29.1833 -19.4247 -19.4247 -19.4147 -19.4147 9.9919 9.9919 10.2583 10.2583 11.9095 11.9095 12.2519 12.2519 12.2822 12.2822 12.7007 12.7007 12.9632 12.9632 13.4379 13.4379 13.7145 13.7145 13.7706 13.7706 14.0465 14.0465 14.0892 14.0892 14.3013 14.3013 14.3460 14.3460 14.6226 14.6226 14.7371 14.7371 14.9385 14.9385 15.0417 15.0417 15.1235 15.1235 15.5204 15.5204 15.6229 15.6229 15.9014 15.9014 15.9832 15.9832 16.6212 16.6212 17.6467 17.6467 17.8809 17.8809 18.0327 18.0327 20.1803 20.1803 k = 0.1389 0.3168 0.5459 ( 2790 PWs) bands (ev): -57.7697 -57.7697 -29.1836 -29.1836 -19.4264 -19.4264 -19.4146 -19.4146 10.0554 10.0554 10.2927 10.2927 11.9499 11.9499 12.2212 12.2212 12.2582 12.2582 12.7166 12.7166 13.0077 13.0077 13.4654 13.4654 13.7229 13.7229 13.7903 13.7903 14.0471 14.0471 14.0897 14.0897 14.2952 14.2952 14.3359 14.3359 14.6143 14.6143 14.7315 14.7315 14.8895 14.8895 15.0030 15.0030 15.1044 15.1044 15.5119 15.5119 15.6110 15.6110 15.9080 15.9080 15.9931 15.9931 16.5877 16.5877 17.6572 17.6572 17.8759 17.8759 18.0217 18.0217 20.0688 20.0688 k = 0.1444 0.3294 0.5459 ( 2790 PWs) bands (ev): -57.7697 -57.7697 -29.1839 -29.1839 -19.4282 -19.4282 -19.4145 -19.4145 10.1198 10.1198 10.3285 10.3285 11.9889 11.9889 12.1851 12.1851 12.2341 12.2341 12.7376 12.7376 13.0535 13.0535 13.4936 13.4936 13.7315 13.7315 13.8101 13.8101 14.0483 14.0483 14.0904 14.0904 14.2893 14.2893 14.3262 14.3262 14.6051 14.6051 14.7255 14.7255 14.8313 14.8313 14.9722 14.9722 15.0854 15.0854 15.5053 15.5053 15.5981 15.5981 15.9157 15.9157 16.0031 16.0031 16.5531 16.5531 17.6667 17.6667 17.8726 17.8726 18.0131 18.0131 19.9525 19.9525 k = 0.1500 0.3421 0.5459 ( 2794 PWs) bands (ev): -57.7696 -57.7696 -29.1842 -29.1842 -19.4299 -19.4299 -19.4143 -19.4143 10.1850 10.1850 10.3658 10.3658 12.0239 12.0239 12.1465 12.1465 12.2105 12.2105 12.7628 12.7628 13.1004 13.1004 13.5224 13.5224 13.7404 13.7404 13.8296 13.8296 14.0500 14.0500 14.0914 14.0914 14.2837 14.2837 14.3169 14.3169 14.5942 14.5942 14.7191 14.7191 14.7697 14.7697 14.9456 14.9456 15.0665 15.0665 15.5006 15.5006 15.5842 15.5842 15.9241 15.9241 16.0125 16.0125 16.5176 16.5176 17.6750 17.6750 17.8708 17.8708 18.0072 18.0072 19.8338 19.8338 k = 0.1556 0.3548 0.5459 ( 2792 PWs) bands (ev): -57.7696 -57.7696 -29.1845 -29.1845 -19.4317 -19.4317 -19.4141 -19.4141 10.2507 10.2507 10.4048 10.4048 12.0451 12.0451 12.1132 12.1132 12.1903 12.1903 12.7915 12.7915 13.1482 13.1482 13.5516 13.5516 13.7495 13.7495 13.8486 13.8486 14.0521 14.0521 14.0927 14.0927 14.2782 14.2782 14.3080 14.3080 14.5793 14.5793 14.7087 14.7087 14.7136 14.7136 14.9209 14.9209 15.0476 15.0476 15.4979 15.4979 15.5696 15.5696 15.9331 15.9331 16.0208 16.0208 16.4815 16.4815 17.6825 17.6825 17.8701 17.8701 18.0045 18.0045 19.7148 19.7148 k = 0.1611 0.3675 0.5459 ( 2784 PWs) bands (ev): -57.7695 -57.7695 -29.1847 -29.1847 -19.4333 -19.4333 -19.4139 -19.4139 10.3162 10.3162 10.4458 10.4458 12.0278 12.0278 12.1007 12.1007 12.1829 12.1829 12.8229 12.8229 13.1966 13.1966 13.5812 13.5812 13.7589 13.7589 13.8671 13.8671 14.0547 14.0547 14.0941 14.0941 14.2728 14.2728 14.2992 14.2992 14.5553 14.5553 14.6587 14.6587 14.7057 14.7057 14.8972 14.8972 15.0287 15.0287 15.4972 15.4972 15.5546 15.5546 15.9423 15.9423 16.0275 16.0275 16.4451 16.4451 17.6892 17.6892 17.8703 17.8703 18.0053 18.0053 19.5966 19.5966 k = 0.1667 0.3801 0.5459 ( 2776 PWs) bands (ev): -57.7695 -57.7695 -29.1850 -29.1850 -19.4350 -19.4350 -19.4137 -19.4137 10.3810 10.3810 10.4892 10.4892 11.9851 11.9851 12.0859 12.0859 12.1987 12.1987 12.8567 12.8567 13.2453 13.2453 13.6108 13.6108 13.7686 13.7686 13.8846 13.8846 14.0575 14.0575 14.0958 14.0958 14.2674 14.2674 14.2905 14.2905 14.5158 14.5158 14.6241 14.6241 14.6986 14.6986 14.8739 14.8739 15.0101 15.0101 15.4982 15.4982 15.5398 15.5398 15.9517 15.9517 16.0323 16.0323 16.4088 16.4088 17.6955 17.6955 17.8711 17.8711 18.0098 18.0098 19.4801 19.4801 k = 0.1722 0.3928 0.5459 ( 2776 PWs) bands (ev): -57.7694 -57.7694 -29.1852 -29.1852 -19.4366 -19.4366 -19.4135 -19.4135 10.4441 10.4441 10.5360 10.5360 11.9360 11.9360 12.0594 12.0594 12.2285 12.2285 12.8925 12.8925 13.2941 13.2941 13.6403 13.6403 13.7786 13.7786 13.9010 13.9010 14.0603 14.0603 14.0975 14.0975 14.2615 14.2615 14.2817 14.2817 14.4640 14.4640 14.6037 14.6037 14.6913 14.6913 14.8508 14.8508 14.9918 14.9918 15.4995 15.4995 15.5267 15.5267 15.9610 15.9610 16.0350 16.0350 16.3728 16.3728 17.7016 17.7016 17.8724 17.8724 18.0182 18.0182 19.3660 19.3660 k = 0.1778 0.4055 0.5459 ( 2776 PWs) bands (ev): -57.7694 -57.7694 -29.1855 -29.1855 -19.4381 -19.4381 -19.4133 -19.4133 10.5042 10.5042 10.5871 10.5871 11.8842 11.8842 12.0272 12.0272 12.2624 12.2624 12.9301 12.9301 13.3426 13.3426 13.6693 13.6693 13.7892 13.7892 13.9161 13.9161 14.0629 14.0629 14.0994 14.0994 14.2547 14.2547 14.2725 14.2725 14.4088 14.4088 14.5901 14.5901 14.6841 14.6841 14.8280 14.8280 14.9739 14.9739 15.4955 15.4955 15.5214 15.5214 15.9699 15.9699 16.0353 16.0353 16.3376 16.3376 17.7079 17.7079 17.8742 17.8742 18.0303 18.0303 19.2549 19.2549 k = 0.1833 0.4181 0.5459 ( 2780 PWs) bands (ev): -57.7693 -57.7693 -29.1857 -29.1857 -19.4395 -19.4395 -19.4131 -19.4131 10.5604 10.5604 10.6433 10.6433 11.8311 11.8311 11.9917 11.9917 12.2970 12.2970 12.9692 12.9692 13.3905 13.3905 13.6973 13.6973 13.8004 13.8004 13.9295 13.9295 14.0643 14.0643 14.1013 14.1013 14.2454 14.2454 14.2628 14.2628 14.3568 14.3568 14.5795 14.5795 14.6770 14.6770 14.8053 14.8053 14.9567 14.9567 15.4835 15.4835 15.5268 15.5268 15.9784 15.9784 16.0330 16.0330 16.3035 16.3035 17.7144 17.7144 17.8770 17.8770 18.0458 18.0458 19.1473 19.1473 k = 0.1889 0.4308 0.5459 ( 2784 PWs) bands (ev): -57.7693 -57.7693 -29.1859 -29.1859 -19.4409 -19.4409 -19.4130 -19.4130 10.6130 10.6130 10.7040 10.7040 11.7769 11.7769 11.9537 11.9537 12.3307 12.3307 13.0098 13.0098 13.4374 13.4374 13.7235 13.7235 13.8126 13.8126 13.9407 13.9407 14.0636 14.0636 14.1034 14.1034 14.2303 14.2303 14.2527 14.2527 14.3144 14.3144 14.5704 14.5704 14.6701 14.6701 14.7831 14.7831 14.9401 14.9401 15.4688 15.4688 15.5376 15.5376 15.9861 15.9861 16.0282 16.0282 16.2708 16.2708 17.7212 17.7212 17.8811 17.8811 18.0646 18.0646 19.0435 19.0435 k = 0.1944 0.4435 0.5459 ( 2780 PWs) bands (ev): -57.7693 -57.7693 -29.1861 -29.1861 -19.4422 -19.4422 -19.4128 -19.4128 10.6634 10.6634 10.7678 10.7678 11.7221 11.7221 11.9136 11.9136 12.3631 12.3631 13.0518 13.0518 13.4830 13.4830 13.7472 13.7472 13.8261 13.8261 13.9487 13.9487 14.0588 14.0588 14.1055 14.1055 14.2073 14.2073 14.2427 14.2427 14.2863 14.2863 14.5625 14.5625 14.6635 14.6635 14.7613 14.7613 14.9242 14.9242 15.4539 15.4539 15.5518 15.5518 15.9925 15.9925 16.0214 16.0214 16.2399 16.2399 17.7282 17.7282 17.8872 17.8872 18.0863 18.0863 18.9438 18.9438 k = 0.2000 0.4561 0.5459 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1863 -29.1863 -19.4434 -19.4434 -19.4127 -19.4127 10.7127 10.7127 10.8333 10.8333 11.6669 11.6669 11.8715 11.8715 12.3935 12.3935 13.0950 13.0950 13.5269 13.5269 13.7675 13.7675 13.8408 13.8408 13.9510 13.9510 14.0494 14.0494 14.1077 14.1077 14.1836 14.1836 14.2324 14.2324 14.2695 14.2695 14.5556 14.5556 14.6574 14.6574 14.7401 14.7401 14.9093 14.9093 15.4392 15.4392 15.5689 15.5689 15.9953 15.9953 16.0146 16.0146 16.2110 16.2110 17.7352 17.7352 17.8959 17.8959 18.1106 18.1106 18.8486 18.8486 k = 0.2056 0.4688 0.5459 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1865 -29.1865 -19.4444 -19.4444 -19.4125 -19.4125 10.7618 10.7618 10.8994 10.8994 11.6114 11.6114 11.8274 11.8274 12.4217 12.4217 13.1394 13.1394 13.5684 13.5684 13.7840 13.7840 13.8541 13.8541 13.9445 13.9445 14.0398 14.0398 14.1100 14.1100 14.1671 14.1671 14.2216 14.2216 14.2575 14.2575 14.5498 14.5498 14.6518 14.6518 14.7197 14.7197 14.8954 14.8954 15.4253 15.4253 15.5884 15.5884 15.9890 15.9890 16.0135 16.0135 16.1845 16.1845 17.7418 17.7418 17.9079 17.9079 18.1372 18.1372 18.7582 18.7582 k = 0.2111 0.4815 0.5459 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1866 -29.1866 -19.4454 -19.4454 -19.4124 -19.4124 10.8110 10.8110 10.9656 10.9656 11.5559 11.5559 11.7815 11.7815 12.4474 12.4474 13.1849 13.1849 13.6071 13.6071 13.7971 13.7971 13.8567 13.8567 13.9341 13.9341 14.0369 14.0369 14.1123 14.1123 14.1582 14.1582 14.2102 14.2102 14.2468 14.2468 14.5455 14.5455 14.6465 14.6465 14.7005 14.7005 14.8826 14.8826 15.4123 15.4123 15.6103 15.6103 15.9749 15.9749 16.0167 16.0167 16.1606 16.1606 17.7477 17.7477 17.9236 17.9236 18.1657 18.1657 18.6730 18.6730 k = 0.2167 0.4942 0.5459 ( 2790 PWs) bands (ev): -57.7692 -57.7692 -29.1868 -29.1868 -19.4462 -19.4462 -19.4123 -19.4123 10.8606 10.8606 11.0314 11.0314 11.5004 11.5004 11.7338 11.7338 12.4701 12.4701 13.2314 13.2314 13.6423 13.6423 13.8070 13.8070 13.8349 13.8349 13.9369 13.9369 14.0414 14.0414 14.1146 14.1146 14.1535 14.1535 14.1986 14.1986 14.2360 14.2360 14.5426 14.5426 14.6413 14.6413 14.6830 14.6830 14.8711 14.8711 15.4004 15.4004 15.6343 15.6343 15.9569 15.9569 16.0203 16.0203 16.1396 16.1396 17.7528 17.7528 17.9434 17.9434 18.1954 18.1954 18.5936 18.5936 k = 0.2222 0.5068 0.5459 ( 2786 PWs) bands (ev): -57.7691 -57.7691 -29.1869 -29.1869 -19.4469 -19.4469 -19.4122 -19.4122 10.9107 10.9107 11.0965 11.0965 11.4450 11.4450 11.6844 11.6844 12.4899 12.4899 13.2790 13.2790 13.6732 13.6732 13.7914 13.7914 13.8182 13.8182 13.9515 13.9515 14.0505 14.0505 14.1167 14.1167 14.1496 14.1496 14.1877 14.1877 14.2243 14.2243 14.5415 14.5415 14.6354 14.6354 14.6681 14.6681 14.8610 14.8610 15.3900 15.3900 15.6601 15.6601 15.9361 15.9361 16.0234 16.0234 16.1218 16.1218 17.7569 17.7569 17.9674 17.9674 18.2247 18.2247 18.5210 18.5210 k = 0.2278 0.5195 0.5459 ( 2792 PWs) bands (ev): -57.7691 -57.7691 -29.1870 -29.1870 -19.4475 -19.4475 -19.4121 -19.4121 10.9614 10.9614 11.1605 11.1605 11.3901 11.3901 11.6332 11.6332 12.5063 12.5063 13.3276 13.3276 13.6980 13.6980 13.7449 13.7449 13.8248 13.8248 13.9693 13.9693 14.0626 14.0626 14.1187 14.1187 14.1438 14.1438 14.1792 14.1792 14.2115 14.2115 14.5421 14.5421 14.6276 14.6276 14.6573 14.6573 14.8524 14.8524 15.3812 15.3812 15.6874 15.6874 15.9130 15.9130 16.0257 16.0257 16.1073 16.1073 17.7601 17.7601 17.9957 17.9957 18.2504 18.2504 18.4580 18.4580 k = 0.2333 0.5322 0.5459 ( 2796 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4480 -19.4480 -19.4121 -19.4121 11.0127 11.0127 11.2226 11.2226 11.3363 11.3363 11.5803 11.5803 12.5193 12.5193 13.3771 13.3771 13.6878 13.6878 13.7246 13.7246 13.8307 13.8307 13.9866 13.9866 14.0761 14.0761 14.1208 14.1208 14.1353 14.1353 14.1736 14.1736 14.1978 14.1978 14.5443 14.5443 14.6178 14.6178 14.6509 14.6509 14.8456 14.8456 15.3741 15.3741 15.7158 15.7158 15.8879 15.8879 16.0271 16.0271 16.0963 16.0963 17.7624 17.7624 18.0277 18.0277 18.2640 18.2640 18.4116 18.4116 k = 0.2389 0.5448 0.5459 ( 2796 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4483 -19.4483 -19.4120 -19.4120 11.0644 11.0644 11.2672 11.2672 11.2991 11.2991 11.5261 11.5261 12.5286 12.5286 13.4274 13.4274 13.6375 13.6375 13.7374 13.7374 13.8355 13.8355 14.0019 14.0019 14.0889 14.0889 14.1232 14.1232 14.1268 14.1268 14.1689 14.1689 14.1849 14.1849 14.5475 14.5475 14.6079 14.6079 14.6476 14.6476 14.8406 14.8406 15.3690 15.3690 15.7449 15.7449 15.8611 15.8611 16.0279 16.0279 16.0886 16.0886 17.7639 17.7639 18.0623 18.0623 18.2529 18.2529 18.3931 18.3931 k = 0.2444 0.5575 0.5459 ( 2792 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.1163 11.1163 11.2241 11.2241 11.3481 11.3481 11.4712 11.4712 12.5343 12.5343 13.4781 13.4781 13.5856 13.5856 13.7459 13.7459 13.8386 13.8386 14.0130 14.0130 14.0962 14.0962 14.1196 14.1196 14.1316 14.1316 14.1590 14.1590 14.1779 14.1779 14.5508 14.5508 14.6003 14.6003 14.6461 14.6461 14.8375 14.8375 15.3659 15.3659 15.7744 15.7744 15.8331 15.8331 16.0282 16.0282 16.0842 16.0842 17.7648 17.7648 18.0958 18.0958 18.2237 18.2237 18.3951 18.3951 k = 0.2500 0.5702 0.5459 ( 2784 PWs) bands (ev): -57.7691 -57.7691 -29.1871 -29.1871 -19.4485 -19.4485 -19.4120 -19.4120 11.1584 11.1584 11.1820 11.1820 11.3909 11.3909 11.4294 11.4294 12.5362 12.5362 13.5205 13.5205 13.5427 13.5427 13.7487 13.7487 13.8397 13.8397 14.0173 14.0173 14.0972 14.0972 14.1185 14.1185 14.1422 14.1422 14.1466 14.1466 14.1764 14.1764 14.5522 14.5522 14.5972 14.5972 14.6457 14.6457 14.8365 14.8365 15.3650 15.3650 15.8014 15.8014 15.8067 15.8067 16.0283 16.0283 16.0827 16.0827 17.7651 17.7651 18.1135 18.1135 18.2057 18.2057 18.3981 18.3981 Writing output data file Ni4W.save init_run : 4.07s CPU 13.37s WALL ( 1 calls) electrons : 843.89s CPU 852.39s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.33s CPU 1.45s WALL ( 1 calls) Called by electrons: c_bands : 843.87s CPU 852.07s WALL ( 1 calls) v_of_rho : 0.16s CPU 0.99s WALL ( 1 calls) v_h : 0.00s CPU 0.05s WALL ( 1 calls) v_xc : 0.16s CPU 0.61s WALL ( 1 calls) newd : 0.36s CPU 0.59s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.16s WALL ( 381 calls) cegterg : 794.84s CPU 800.61s WALL ( 699 calls) Called by sum_band: Called by *egterg: h_psi : 289.06s CPU 296.92s WALL ( 11597 calls) s_psi : 49.90s CPU 50.61s WALL ( 11597 calls) g_psi : 0.64s CPU 0.64s WALL ( 10517 calls) cdiaghg : 349.43s CPU 347.36s WALL ( 10898 calls) cegterg:over : 76.39s CPU 74.22s WALL ( 10517 calls) cegterg:upda : 12.07s CPU 14.65s WALL ( 10517 calls) cegterg:last : 11.99s CPU 12.75s WALL ( 2176 calls) Called by h_psi: h_psi:vloc : 199.46s CPU 205.73s WALL ( 11597 calls) h_psi:vnl : 89.39s CPU 90.54s WALL ( 11597 calls) add_vuspsi : 34.01s CPU 37.19s WALL ( 11597 calls) General routines calbec : 55.34s CPU 53.27s WALL ( 11597 calls) fft : 0.13s CPU 0.92s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 185.06s CPU 190.88s WALL ( 1704760 calls) interpolate : 0.04s CPU 0.06s WALL ( 4 calls) davcio : 0.04s CPU 0.94s WALL ( 762 calls) Parallel routines fft_scatter : 123.09s CPU 125.29s WALL ( 1704783 calls) PWSCF : 15m 5.72s CPU 16m24.31s WALL This run was terminated on: 21:37: 2 19Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=