Program PWSCF v.5.1.1 starts on 21Jun2016 at 0: 6:19 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: ./RbMnSe2.save/ file Mn.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 3P 3P renormalized file Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 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 201 57 16 6901 1036 161 Max 202 58 17 6903 1056 164 Sum 9665 2741 785 331283 50159 7771 bravais-lattice index = 14 lattice parameter (alat) = 14.4327 a.u. unit-cell volume = 861.7053 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 36.00 number of Kohn-Sham states= 44 kinetic-energy cutoff = 57.0000 Ry charge density cutoff = 803.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.432689 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.844003 celldm(5)= -0.844003 celldm(6)= 0.688007 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.688007 0.725704 0.000000 ) a(3) = ( -0.844003 -0.362852 0.394964 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.948054 1.265938 ) b(2) = ( 0.000000 1.377972 1.265938 ) b(3) = ( 0.000000 0.000000 2.531877 ) PseudoPot. # 1 for Mn read from file: /home/autes/Pseudo/Mn.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 5689fa97e257199ddb8f72ed56aebbb6 Pseudo is Ultrasoft + core correction, Zval = 15.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1187 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 Se read from file: /home/autes/Pseudo/Se_MT_PBE.UPF MD5 check sum: 8b5aa0a73ac3f20b8f2ba32420215307 Pseudo is Norm-conserving, Zval = 6.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1211 points, 3 beta functions with: l(1) = 0 l(2) = 1 l(3) = 1 PseudoPot. # 3 for Rb read from file: /home/autes/Pseudo/Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 948b8f0a9070089a35782939cf30e963 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1219 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 Mn 15.00 54.93800 Mn( 1.00) Se 6.00 78.96000 Se( 1.00) Rb 9.00 85.46780 Rb( 1.00) 2 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 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_2 (2) there are 4 classes and 2 irreducible representations the character table: E -E C2 -C2 G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E C2 -C2 G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 C2 2 -E -1 -C2 -2 Cartesian axes number of k points= 323 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 2) = ( 0.0000000 0.0000000 0.0238856), wk = 0.0030960 k( 3) = ( 0.0000000 0.0000000 0.0477712), wk = 0.0030960 k( 4) = ( 0.0000000 0.0000000 0.0716569), wk = 0.0030960 k( 5) = ( 0.0000000 0.0000000 0.0955425), wk = 0.0030960 k( 6) = ( 0.0000000 0.0000000 0.1194281), wk = 0.0030960 k( 7) = ( 0.0000000 0.0000000 0.1433138), wk = 0.0030960 k( 8) = ( 0.0000000 0.0000000 0.1671994), wk = 0.0030960 k( 9) = ( 0.0000000 0.0000000 0.1910850), wk = 0.0030960 k( 10) = ( 0.0000000 0.0000000 0.2149707), wk = 0.0030960 k( 11) = ( 0.0000000 0.0000000 0.2388563), wk = 0.0030960 k( 12) = ( 0.0000000 0.0000000 0.2627419), wk = 0.0030960 k( 13) = ( 0.0000000 0.0000000 0.2866276), wk = 0.0030960 k( 14) = ( 0.0000000 0.0000000 0.3105132), wk = 0.0030960 k( 15) = ( 0.0000000 0.0000000 0.3343988), wk = 0.0030960 k( 16) = ( 0.0000000 0.0000000 0.3582844), wk = 0.0030960 k( 17) = ( 0.0000000 0.0000000 0.3821701), wk = 0.0030960 k( 18) = ( 0.0000000 0.0000000 0.4060557), wk = 0.0030960 k( 19) = ( 0.0000000 0.0000000 0.4299413), wk = 0.0030960 k( 20) = ( 0.0000000 0.0000000 0.4538270), wk = 0.0030960 k( 21) = ( 0.0000000 0.0000000 0.4777126), wk = 0.0030960 k( 22) = ( 0.0000000 0.0000000 0.5015982), wk = 0.0030960 k( 23) = ( 0.0000000 0.0000000 0.5254838), wk = 0.0030960 k( 24) = ( 0.0000000 0.0000000 0.5493695), wk = 0.0030960 k( 25) = ( 0.0000000 0.0000000 0.5732551), wk = 0.0030960 k( 26) = ( 0.0000000 0.0000000 0.5971407), wk = 0.0030960 k( 27) = ( 0.0000000 0.0000000 0.6210264), wk = 0.0030960 k( 28) = ( 0.0000000 0.0000000 0.6449120), wk = 0.0030960 k( 29) = ( 0.0000000 0.0000000 0.6687976), wk = 0.0030960 k( 30) = ( 0.0000000 0.0000000 0.6926833), wk = 0.0030960 k( 31) = ( 0.0000000 0.0000000 0.7165689), wk = 0.0030960 k( 32) = ( 0.0000000 0.0000000 0.7404545), wk = 0.0030960 k( 33) = ( 0.0000000 0.0000000 0.7643401), wk = 0.0030960 k( 34) = ( 0.0000000 0.0000000 0.7882258), wk = 0.0030960 k( 35) = ( 0.0000000 0.0000000 0.8121114), wk = 0.0030960 k( 36) = ( 0.0000000 0.0000000 0.8359970), wk = 0.0030960 k( 37) = ( 0.0000000 0.0000000 0.8598827), wk = 0.0030960 k( 38) = ( 0.0000000 0.0000000 0.8837683), wk = 0.0030960 k( 39) = ( 0.0000000 0.0000000 0.9076539), wk = 0.0030960 k( 40) = ( 0.0000000 0.0000000 0.9315396), wk = 0.0030960 k( 41) = ( 0.0000000 0.0000000 0.9554252), wk = 0.0030960 k( 42) = ( 0.0000000 0.0000000 0.9793108), wk = 0.0030960 k( 43) = ( 0.0000000 0.0000000 1.0031964), wk = 0.0030960 k( 44) = ( 0.0000000 0.0000000 1.0270821), wk = 0.0030960 k( 45) = ( 0.0000000 0.0000000 1.0509677), wk = 0.0030960 k( 46) = ( 0.0000000 0.0000000 1.0748533), wk = 0.0030960 k( 47) = ( 0.0000000 0.0000000 1.0987389), wk = 0.0030960 k( 48) = ( 0.0000000 0.0000000 1.1226246), wk = 0.0030960 k( 49) = ( 0.0000000 0.0000000 1.1465102), wk = 0.0030960 k( 50) = ( 0.0000000 0.0000000 1.1703958), wk = 0.0030960 k( 51) = ( 0.0000000 0.0000000 1.1942815), wk = 0.0030960 k( 52) = ( 0.0000000 0.0000000 1.2181671), wk = 0.0030960 k( 53) = ( 0.0000000 0.0000000 1.2420527), wk = 0.0030960 k( 54) = ( 0.0000000 0.0000000 1.2659384), wk = 0.0030960 k( 55) = ( 0.0000000 0.0000000 1.2659384), wk = 0.0030960 k( 56) = ( -0.0092415 0.0214959 1.2659384), wk = 0.0030960 k( 57) = ( -0.0184829 0.0429918 1.2659384), wk = 0.0030960 k( 58) = ( -0.0277244 0.0644876 1.2659384), wk = 0.0030960 k( 59) = ( -0.0369659 0.0859836 1.2659384), wk = 0.0030960 k( 60) = ( -0.0462073 0.1074794 1.2659384), wk = 0.0030960 k( 61) = ( -0.0462073 0.1074794 1.2659384), wk = 0.0030960 k( 62) = ( -0.0528807 0.1230020 1.2490421), wk = 0.0030960 k( 63) = ( -0.0595542 0.1385245 1.2321458), wk = 0.0030960 k( 64) = ( -0.0662276 0.1540471 1.2152495), wk = 0.0030960 k( 65) = ( -0.0729010 0.1695696 1.1983532), wk = 0.0030960 k( 66) = ( -0.0795744 0.1850922 1.1814570), wk = 0.0030960 k( 67) = ( -0.0862478 0.2006148 1.1645607), wk = 0.0030960 k( 68) = ( -0.0929213 0.2161373 1.1476644), wk = 0.0030960 k( 69) = ( -0.0995947 0.2316599 1.1307681), wk = 0.0030960 k( 70) = ( -0.1062681 0.2471824 1.1138718), wk = 0.0030960 k( 71) = ( -0.1129415 0.2627050 1.0969755), wk = 0.0030960 k( 72) = ( -0.1196149 0.2782276 1.0800793), wk = 0.0030960 k( 73) = ( -0.1262884 0.2937501 1.0631830), wk = 0.0030960 k( 74) = ( -0.1329618 0.3092727 1.0462867), wk = 0.0030960 k( 75) = ( -0.1396352 0.3247952 1.0293904), wk = 0.0030960 k( 76) = ( -0.1463086 0.3403178 1.0124941), wk = 0.0030960 k( 77) = ( -0.1529821 0.3558403 0.9955979), wk = 0.0030960 k( 78) = ( -0.1596555 0.3713629 0.9787016), wk = 0.0030960 k( 79) = ( -0.1663289 0.3868854 0.9618053), wk = 0.0030960 k( 80) = ( -0.1730023 0.4024080 0.9449090), wk = 0.0030960 k( 81) = ( -0.1796757 0.4179306 0.9280127), wk = 0.0030960 k( 82) = ( -0.1863492 0.4334531 0.9111164), wk = 0.0030960 k( 83) = ( -0.1930226 0.4489757 0.8942202), wk = 0.0030960 k( 84) = ( -0.1996960 0.4644982 0.8773239), wk = 0.0030960 k( 85) = ( -0.2063694 0.4800208 0.8604276), wk = 0.0030960 k( 86) = ( -0.2130429 0.4955434 0.8435313), wk = 0.0030960 k( 87) = ( -0.2197163 0.5110659 0.8266350), wk = 0.0030960 k( 88) = ( -0.2263897 0.5265885 0.8097388), wk = 0.0030960 k( 89) = ( -0.2330631 0.5421110 0.7928425), wk = 0.0030960 k( 90) = ( -0.2397365 0.5576336 0.7759462), wk = 0.0030960 k( 91) = ( -0.2464100 0.5731561 0.7590499), wk = 0.0030960 k( 92) = ( -0.2530834 0.5886787 0.7421536), wk = 0.0030960 k( 93) = ( -0.2597568 0.6042012 0.7252574), wk = 0.0030960 k( 94) = ( -0.2664302 0.6197238 0.7083611), wk = 0.0030960 k( 95) = ( -0.2731036 0.6352464 0.6914648), wk = 0.0030960 k( 96) = ( -0.2731036 0.6352464 0.6914648), wk = 0.0030960 k( 97) = ( -0.2664426 0.6197526 0.6745998), wk = 0.0030960 k( 98) = ( -0.2597815 0.6042587 0.6577348), wk = 0.0030960 k( 99) = ( -0.2531205 0.5887649 0.6408698), wk = 0.0030960 k( 100) = ( -0.2464594 0.5732711 0.6240048), wk = 0.0030960 k( 101) = ( -0.2397983 0.5577773 0.6071398), wk = 0.0030960 k( 102) = ( -0.2331373 0.5422835 0.5902748), wk = 0.0030960 k( 103) = ( -0.2264762 0.5267897 0.5734098), wk = 0.0030960 k( 104) = ( -0.2198151 0.5112959 0.5565448), wk = 0.0030960 k( 105) = ( -0.2131541 0.4958020 0.5396798), wk = 0.0030960 k( 106) = ( -0.2064930 0.4803082 0.5228148), wk = 0.0030960 k( 107) = ( -0.1998319 0.4648144 0.5059498), wk = 0.0030960 k( 108) = ( -0.1931709 0.4493206 0.4890849), wk = 0.0030960 k( 109) = ( -0.1865098 0.4338268 0.4722198), wk = 0.0030960 k( 110) = ( -0.1798488 0.4183330 0.4553549), wk = 0.0030960 k( 111) = ( -0.1731877 0.4028391 0.4384899), wk = 0.0030960 k( 112) = ( -0.1665266 0.3873453 0.4216249), wk = 0.0030960 k( 113) = ( -0.1598655 0.3718515 0.4047599), wk = 0.0030960 k( 114) = ( -0.1532045 0.3563577 0.3878949), wk = 0.0030960 k( 115) = ( -0.1465434 0.3408639 0.3710299), wk = 0.0030960 k( 116) = ( -0.1398824 0.3253701 0.3541649), wk = 0.0030960 k( 117) = ( -0.1332213 0.3098763 0.3372999), wk = 0.0030960 k( 118) = ( -0.1265602 0.2943825 0.3204349), wk = 0.0030960 k( 119) = ( -0.1198992 0.2788886 0.3035699), wk = 0.0030960 k( 120) = ( -0.1132381 0.2633948 0.2867049), wk = 0.0030960 k( 121) = ( -0.1065770 0.2479010 0.2698399), wk = 0.0030960 k( 122) = ( -0.0999160 0.2324072 0.2529749), wk = 0.0030960 k( 123) = ( -0.0932549 0.2169134 0.2361099), wk = 0.0030960 k( 124) = ( -0.0865938 0.2014196 0.2192449), wk = 0.0030960 k( 125) = ( -0.0799328 0.1859258 0.2023799), wk = 0.0030960 k( 126) = ( -0.0732717 0.1704319 0.1855149), wk = 0.0030960 k( 127) = ( -0.0666106 0.1549381 0.1686500), wk = 0.0030960 k( 128) = ( -0.0599496 0.1394443 0.1517849), wk = 0.0030960 k( 129) = ( -0.0532885 0.1239505 0.1349200), wk = 0.0030960 k( 130) = ( -0.0466275 0.1084567 0.1180550), wk = 0.0030960 k( 131) = ( -0.0399664 0.0929629 0.1011900), wk = 0.0030960 k( 132) = ( -0.0333053 0.0774691 0.0843250), wk = 0.0030960 k( 133) = ( -0.0266443 0.0619753 0.0674600), wk = 0.0030960 k( 134) = ( -0.0199832 0.0464814 0.0505950), wk = 0.0030960 k( 135) = ( -0.0133221 0.0309876 0.0337300), wk = 0.0030960 k( 136) = ( -0.0066611 0.0154938 0.0168650), wk = 0.0030960 k( 137) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 138) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 139) = ( 0.0217391 0.0093460 -0.0000000), wk = 0.0030960 k( 140) = ( 0.0434783 0.0186921 -0.0000000), wk = 0.0030960 k( 141) = ( 0.0652174 0.0280381 -0.0000000), wk = 0.0030960 k( 142) = ( 0.0869565 0.0373841 -0.0000000), wk = 0.0030960 k( 143) = ( 0.1086957 0.0467302 -0.0000000), wk = 0.0030960 k( 144) = ( 0.1304348 0.0560762 -0.0000000), wk = 0.0030960 k( 145) = ( 0.1521739 0.0654223 -0.0000000), wk = 0.0030960 k( 146) = ( 0.1739130 0.0747683 -0.0000000), wk = 0.0030960 k( 147) = ( 0.1956522 0.0841143 -0.0000000), wk = 0.0030960 k( 148) = ( 0.2173913 0.0934604 -0.0000000), wk = 0.0030960 k( 149) = ( 0.2391304 0.1028064 -0.0000000), wk = 0.0030960 k( 150) = ( 0.2608696 0.1121524 -0.0000000), wk = 0.0030960 k( 151) = ( 0.2826087 0.1214985 -0.0000000), wk = 0.0030960 k( 152) = ( 0.3043478 0.1308445 -0.0000000), wk = 0.0030960 k( 153) = ( 0.3260870 0.1401906 -0.0000000), wk = 0.0030960 k( 154) = ( 0.3478261 0.1495366 -0.0000000), wk = 0.0030960 k( 155) = ( 0.3695652 0.1588826 -0.0000000), wk = 0.0030960 k( 156) = ( 0.3913044 0.1682287 -0.0000000), wk = 0.0030960 k( 157) = ( 0.4130435 0.1775747 -0.0000000), wk = 0.0030960 k( 158) = ( 0.4347826 0.1869207 -0.0000000), wk = 0.0030960 k( 159) = ( 0.4565217 0.1962668 -0.0000000), wk = 0.0030960 k( 160) = ( 0.4782609 0.2056128 -0.0000000), wk = 0.0030960 k( 161) = ( 0.5000000 0.2149588 -0.0000000), wk = 0.0030960 k( 162) = ( 0.5000000 0.2149588 -0.0000000), wk = 0.0030960 k( 163) = ( 0.4933266 0.2304814 0.0168963), wk = 0.0030960 k( 164) = ( 0.4866532 0.2460040 0.0337926), wk = 0.0030960 k( 165) = ( 0.4799797 0.2615265 0.0506889), wk = 0.0030960 k( 166) = ( 0.4733063 0.2770491 0.0675851), wk = 0.0030960 k( 167) = ( 0.4666329 0.2925716 0.0844814), wk = 0.0030960 k( 168) = ( 0.4599595 0.3080942 0.1013777), wk = 0.0030960 k( 169) = ( 0.4532860 0.3236167 0.1182740), wk = 0.0030960 k( 170) = ( 0.4466126 0.3391393 0.1351703), wk = 0.0030960 k( 171) = ( 0.4399392 0.3546619 0.1520665), wk = 0.0030960 k( 172) = ( 0.4332658 0.3701844 0.1689628), wk = 0.0030960 k( 173) = ( 0.4265924 0.3857070 0.1858591), wk = 0.0030960 k( 174) = ( 0.4199189 0.4012295 0.2027554), wk = 0.0030960 k( 175) = ( 0.4132455 0.4167521 0.2196517), wk = 0.0030960 k( 176) = ( 0.4065721 0.4322747 0.2365480), wk = 0.0030960 k( 177) = ( 0.3998987 0.4477972 0.2534442), wk = 0.0030960 k( 178) = ( 0.3932253 0.4633198 0.2703405), wk = 0.0030960 k( 179) = ( 0.3865518 0.4788423 0.2872368), wk = 0.0030960 k( 180) = ( 0.3798784 0.4943649 0.3041331), wk = 0.0030960 k( 181) = ( 0.3732050 0.5098874 0.3210294), wk = 0.0030960 k( 182) = ( 0.3665316 0.5254100 0.3379256), wk = 0.0030960 k( 183) = ( 0.3598581 0.5409325 0.3548219), wk = 0.0030960 k( 184) = ( 0.3531847 0.5564551 0.3717182), wk = 0.0030960 k( 185) = ( 0.3465113 0.5719777 0.3886145), wk = 0.0030960 k( 186) = ( 0.3398379 0.5875002 0.4055108), wk = 0.0030960 k( 187) = ( 0.3331645 0.6030228 0.4224070), wk = 0.0030960 k( 188) = ( 0.3264910 0.6185453 0.4393033), wk = 0.0030960 k( 189) = ( 0.3198176 0.6340679 0.4561996), wk = 0.0030960 k( 190) = ( 0.3131442 0.6495904 0.4730959), wk = 0.0030960 k( 191) = ( 0.3064708 0.6651130 0.4899922), wk = 0.0030960 k( 192) = ( 0.2997973 0.6806356 0.5068885), wk = 0.0030960 k( 193) = ( 0.2931239 0.6961581 0.5237847), wk = 0.0030960 k( 194) = ( 0.2864505 0.7116807 0.5406810), wk = 0.0030960 k( 195) = ( 0.2797771 0.7272032 0.5575773), wk = 0.0030960 k( 196) = ( 0.2731036 0.7427258 0.5744736), wk = 0.0030960 k( 197) = ( 0.2731036 0.7427258 0.5744736), wk = 0.0030960 k( 198) = ( 0.2503450 0.7382475 0.5793482), wk = 0.0030960 k( 199) = ( 0.2275864 0.7337692 0.5842228), wk = 0.0030960 k( 200) = ( 0.2048277 0.7292909 0.5890975), wk = 0.0030960 k( 201) = ( 0.1820691 0.7248125 0.5939721), wk = 0.0030960 k( 202) = ( 0.1593105 0.7203342 0.5988467), wk = 0.0030960 k( 203) = ( 0.1365518 0.7158559 0.6037214), wk = 0.0030960 k( 204) = ( 0.1137932 0.7113776 0.6085960), wk = 0.0030960 k( 205) = ( 0.0910346 0.7068993 0.6134707), wk = 0.0030960 k( 206) = ( 0.0682759 0.7024210 0.6183453), wk = 0.0030960 k( 207) = ( 0.0455173 0.6979427 0.6232199), wk = 0.0030960 k( 208) = ( 0.0227586 0.6934644 0.6280945), wk = 0.0030960 k( 209) = ( 0.0000000 0.6889861 0.6329692), wk = 0.0030960 k( 210) = ( 0.0000000 0.6889861 0.6329692), wk = 0.0030960 k( 211) = ( 0.0067568 0.6732697 0.6500765), wk = 0.0030960 k( 212) = ( 0.0135135 0.6575533 0.6671837), wk = 0.0030960 k( 213) = ( 0.0202703 0.6418369 0.6842910), wk = 0.0030960 k( 214) = ( 0.0270270 0.6261205 0.7013983), wk = 0.0030960 k( 215) = ( 0.0337838 0.6104041 0.7185055), wk = 0.0030960 k( 216) = ( 0.0405405 0.5946877 0.7356128), wk = 0.0030960 k( 217) = ( 0.0472973 0.5789713 0.7527201), wk = 0.0030960 k( 218) = ( 0.0540540 0.5632549 0.7698274), wk = 0.0030960 k( 219) = ( 0.0608108 0.5475385 0.7869347), wk = 0.0030960 k( 220) = ( 0.0675676 0.5318221 0.8040419), wk = 0.0030960 k( 221) = ( 0.0743243 0.5161057 0.8211492), wk = 0.0030960 k( 222) = ( 0.0810811 0.5003893 0.8382565), wk = 0.0030960 k( 223) = ( 0.0878378 0.4846729 0.8553638), wk = 0.0030960 k( 224) = ( 0.0945946 0.4689565 0.8724710), wk = 0.0030960 k( 225) = ( 0.1013514 0.4532401 0.8895783), wk = 0.0030960 k( 226) = ( 0.1081081 0.4375237 0.9066856), wk = 0.0030960 k( 227) = ( 0.1148649 0.4218074 0.9237928), wk = 0.0030960 k( 228) = ( 0.1216216 0.4060910 0.9409001), wk = 0.0030960 k( 229) = ( 0.1283784 0.3903745 0.9580074), wk = 0.0030960 k( 230) = ( 0.1351351 0.3746581 0.9751147), wk = 0.0030960 k( 231) = ( 0.1418919 0.3589418 0.9922220), wk = 0.0030960 k( 232) = ( 0.1486486 0.3432254 1.0093292), wk = 0.0030960 k( 233) = ( 0.1554054 0.3275090 1.0264365), wk = 0.0030960 k( 234) = ( 0.1621622 0.3117926 1.0435438), wk = 0.0030960 k( 235) = ( 0.1689189 0.2960762 1.0606511), wk = 0.0030960 k( 236) = ( 0.1756757 0.2803598 1.0777583), wk = 0.0030960 k( 237) = ( 0.1824324 0.2646434 1.0948656), wk = 0.0030960 k( 238) = ( 0.1891892 0.2489270 1.1119729), wk = 0.0030960 k( 239) = ( 0.1959460 0.2332106 1.1290802), wk = 0.0030960 k( 240) = ( 0.2027027 0.2174942 1.1461874), wk = 0.0030960 k( 241) = ( 0.2094595 0.2017778 1.1632947), wk = 0.0030960 k( 242) = ( 0.2162162 0.1860614 1.1804020), wk = 0.0030960 k( 243) = ( 0.2229730 0.1703450 1.1975093), wk = 0.0030960 k( 244) = ( 0.2297297 0.1546286 1.2146165), wk = 0.0030960 k( 245) = ( 0.2364865 0.1389122 1.2317238), wk = 0.0030960 k( 246) = ( 0.2432432 0.1231958 1.2488311), wk = 0.0030960 k( 247) = ( 0.2500000 0.1074794 1.2659384), wk = 0.0030960 k( 248) = ( 0.2500000 0.1074794 1.2659384), wk = 0.0030960 k( 249) = ( 0.2692308 0.1157471 1.2569390), wk = 0.0030960 k( 250) = ( 0.2884615 0.1240147 1.2479397), wk = 0.0030960 k( 251) = ( 0.3076923 0.1322824 1.2389404), wk = 0.0030960 k( 252) = ( 0.3269231 0.1405500 1.2299411), wk = 0.0030960 k( 253) = ( 0.3461538 0.1488177 1.2209417), wk = 0.0030960 k( 254) = ( 0.3653846 0.1570853 1.2119424), wk = 0.0030960 k( 255) = ( 0.3846154 0.1653530 1.2029431), wk = 0.0030960 k( 256) = ( 0.4038462 0.1736206 1.1939438), wk = 0.0030960 k( 257) = ( 0.4230769 0.1818883 1.1849444), wk = 0.0030960 k( 258) = ( 0.4423077 0.1901559 1.1759451), wk = 0.0030960 k( 259) = ( 0.4615385 0.1984236 1.1669458), wk = 0.0030960 k( 260) = ( 0.4807692 0.2066912 1.1579465), wk = 0.0030960 k( 261) = ( 0.5000000 0.2149588 1.1489471), wk = 0.0030960 k( 262) = ( 0.5000000 0.2149588 1.1489471), wk = 0.0030960 k( 263) = ( 0.5000000 0.2149588 1.1250108), wk = 0.0030960 k( 264) = ( 0.5000000 0.2149588 1.1010743), wk = 0.0030960 k( 265) = ( 0.5000000 0.2149588 1.0771380), wk = 0.0030960 k( 266) = ( 0.5000000 0.2149588 1.0532016), wk = 0.0030960 k( 267) = ( 0.5000000 0.2149588 1.0292652), wk = 0.0030960 k( 268) = ( 0.5000000 0.2149588 1.0053288), wk = 0.0030960 k( 269) = ( 0.5000000 0.2149588 0.9813924), wk = 0.0030960 k( 270) = ( 0.5000000 0.2149588 0.9574560), wk = 0.0030960 k( 271) = ( 0.5000000 0.2149588 0.9335196), wk = 0.0030960 k( 272) = ( 0.5000000 0.2149588 0.9095832), wk = 0.0030960 k( 273) = ( 0.5000000 0.2149588 0.8856468), wk = 0.0030960 k( 274) = ( 0.5000000 0.2149588 0.8617104), wk = 0.0030960 k( 275) = ( 0.5000000 0.2149588 0.8377740), wk = 0.0030960 k( 276) = ( 0.5000000 0.2149588 0.8138376), wk = 0.0030960 k( 277) = ( 0.5000000 0.2149588 0.7899012), wk = 0.0030960 k( 278) = ( 0.5000000 0.2149588 0.7659648), wk = 0.0030960 k( 279) = ( 0.5000000 0.2149588 0.7420284), wk = 0.0030960 k( 280) = ( 0.5000000 0.2149588 0.7180920), wk = 0.0030960 k( 281) = ( 0.5000000 0.2149588 0.6941556), wk = 0.0030960 k( 282) = ( 0.5000000 0.2149588 0.6702192), wk = 0.0030960 k( 283) = ( 0.5000000 0.2149588 0.6462828), wk = 0.0030960 k( 284) = ( 0.5000000 0.2149588 0.6223464), wk = 0.0030960 k( 285) = ( 0.5000000 0.2149588 0.5984100), wk = 0.0030960 k( 286) = ( 0.5000000 0.2149588 0.5744736), wk = 0.0030960 k( 287) = ( 0.5000000 0.2149588 0.5505372), wk = 0.0030960 k( 288) = ( 0.5000000 0.2149588 0.5266008), wk = 0.0030960 k( 289) = ( 0.5000000 0.2149588 0.5026644), wk = 0.0030960 k( 290) = ( 0.5000000 0.2149588 0.4787280), wk = 0.0030960 k( 291) = ( 0.5000000 0.2149588 0.4547916), wk = 0.0030960 k( 292) = ( 0.5000000 0.2149588 0.4308552), wk = 0.0030960 k( 293) = ( 0.5000000 0.2149588 0.4069188), wk = 0.0030960 k( 294) = ( 0.5000000 0.2149588 0.3829824), wk = 0.0030960 k( 295) = ( 0.5000000 0.2149588 0.3590460), wk = 0.0030960 k( 296) = ( 0.5000000 0.2149588 0.3351096), wk = 0.0030960 k( 297) = ( 0.5000000 0.2149588 0.3111732), wk = 0.0030960 k( 298) = ( 0.5000000 0.2149588 0.2872368), wk = 0.0030960 k( 299) = ( 0.5000000 0.2149588 0.2633004), wk = 0.0030960 k( 300) = ( 0.5000000 0.2149588 0.2393640), wk = 0.0030960 k( 301) = ( 0.5000000 0.2149588 0.2154276), wk = 0.0030960 k( 302) = ( 0.5000000 0.2149588 0.1914912), wk = 0.0030960 k( 303) = ( 0.5000000 0.2149588 0.1675548), wk = 0.0030960 k( 304) = ( 0.5000000 0.2149588 0.1436184), wk = 0.0030960 k( 305) = ( 0.5000000 0.2149588 0.1196820), wk = 0.0030960 k( 306) = ( 0.5000000 0.2149588 0.0957456), wk = 0.0030960 k( 307) = ( 0.5000000 0.2149588 0.0718092), wk = 0.0030960 k( 308) = ( 0.5000000 0.2149588 0.0478728), wk = 0.0030960 k( 309) = ( 0.5000000 0.2149588 0.0239364), wk = 0.0030960 k( 310) = ( 0.5000000 0.2149588 -0.0000000), wk = 0.0030960 k( 311) = ( 0.0000000 0.0000000 1.2659384), wk = 0.0030960 k( 312) = ( 0.0208333 0.0089566 1.2659384), wk = 0.0030960 k( 313) = ( 0.0416667 0.0179132 1.2659384), wk = 0.0030960 k( 314) = ( 0.0625000 0.0268699 1.2659384), wk = 0.0030960 k( 315) = ( 0.0833333 0.0358265 1.2659384), wk = 0.0030960 k( 316) = ( 0.1041667 0.0447831 1.2659384), wk = 0.0030960 k( 317) = ( 0.1250000 0.0537397 1.2659384), wk = 0.0030960 k( 318) = ( 0.1458333 0.0626963 1.2659384), wk = 0.0030960 k( 319) = ( 0.1666667 0.0716530 1.2659384), wk = 0.0030960 k( 320) = ( 0.1875000 0.0806096 1.2659384), wk = 0.0030960 k( 321) = ( 0.2083333 0.0895662 1.2659384), wk = 0.0030960 k( 322) = ( 0.2291667 0.0985228 1.2659384), wk = 0.0030960 k( 323) = ( 0.2500000 0.1074794 1.2659384), wk = 0.0030960 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 2) = ( 0.0000000 0.0000000 0.0094340), wk = 0.0030960 k( 3) = ( 0.0000000 0.0000000 0.0188679), wk = 0.0030960 k( 4) = ( 0.0000000 0.0000000 0.0283019), wk = 0.0030960 k( 5) = ( 0.0000000 0.0000000 0.0377359), wk = 0.0030960 k( 6) = ( 0.0000000 0.0000000 0.0471698), wk = 0.0030960 k( 7) = ( 0.0000000 0.0000000 0.0566038), wk = 0.0030960 k( 8) = ( 0.0000000 0.0000000 0.0660377), wk = 0.0030960 k( 9) = ( 0.0000000 0.0000000 0.0754717), wk = 0.0030960 k( 10) = ( 0.0000000 0.0000000 0.0849057), wk = 0.0030960 k( 11) = ( 0.0000000 0.0000000 0.0943396), wk = 0.0030960 k( 12) = ( 0.0000000 0.0000000 0.1037736), wk = 0.0030960 k( 13) = ( 0.0000000 0.0000000 0.1132076), wk = 0.0030960 k( 14) = ( 0.0000000 0.0000000 0.1226415), wk = 0.0030960 k( 15) = ( 0.0000000 0.0000000 0.1320755), wk = 0.0030960 k( 16) = ( 0.0000000 0.0000000 0.1415094), wk = 0.0030960 k( 17) = ( 0.0000000 0.0000000 0.1509434), wk = 0.0030960 k( 18) = ( 0.0000000 0.0000000 0.1603774), wk = 0.0030960 k( 19) = ( 0.0000000 0.0000000 0.1698113), wk = 0.0030960 k( 20) = ( 0.0000000 0.0000000 0.1792453), wk = 0.0030960 k( 21) = ( 0.0000000 0.0000000 0.1886793), wk = 0.0030960 k( 22) = ( 0.0000000 0.0000000 0.1981132), wk = 0.0030960 k( 23) = ( 0.0000000 0.0000000 0.2075472), wk = 0.0030960 k( 24) = ( 0.0000000 0.0000000 0.2169811), wk = 0.0030960 k( 25) = ( 0.0000000 0.0000000 0.2264151), wk = 0.0030960 k( 26) = ( 0.0000000 0.0000000 0.2358491), wk = 0.0030960 k( 27) = ( 0.0000000 0.0000000 0.2452830), wk = 0.0030960 k( 28) = ( 0.0000000 0.0000000 0.2547170), wk = 0.0030960 k( 29) = ( 0.0000000 0.0000000 0.2641509), wk = 0.0030960 k( 30) = ( 0.0000000 0.0000000 0.2735849), wk = 0.0030960 k( 31) = ( 0.0000000 0.0000000 0.2830189), wk = 0.0030960 k( 32) = ( 0.0000000 0.0000000 0.2924528), wk = 0.0030960 k( 33) = ( 0.0000000 0.0000000 0.3018868), wk = 0.0030960 k( 34) = ( 0.0000000 0.0000000 0.3113208), wk = 0.0030960 k( 35) = ( 0.0000000 0.0000000 0.3207547), wk = 0.0030960 k( 36) = ( 0.0000000 0.0000000 0.3301887), wk = 0.0030960 k( 37) = ( 0.0000000 0.0000000 0.3396226), wk = 0.0030960 k( 38) = ( 0.0000000 0.0000000 0.3490566), wk = 0.0030960 k( 39) = ( 0.0000000 0.0000000 0.3584906), wk = 0.0030960 k( 40) = ( 0.0000000 0.0000000 0.3679245), wk = 0.0030960 k( 41) = ( 0.0000000 0.0000000 0.3773585), wk = 0.0030960 k( 42) = ( 0.0000000 0.0000000 0.3867925), wk = 0.0030960 k( 43) = ( 0.0000000 0.0000000 0.3962264), wk = 0.0030960 k( 44) = ( 0.0000000 0.0000000 0.4056604), wk = 0.0030960 k( 45) = ( 0.0000000 0.0000000 0.4150943), wk = 0.0030960 k( 46) = ( 0.0000000 0.0000000 0.4245283), wk = 0.0030960 k( 47) = ( 0.0000000 0.0000000 0.4339623), wk = 0.0030960 k( 48) = ( 0.0000000 0.0000000 0.4433962), wk = 0.0030960 k( 49) = ( 0.0000000 0.0000000 0.4528302), wk = 0.0030960 k( 50) = ( 0.0000000 0.0000000 0.4622642), wk = 0.0030960 k( 51) = ( 0.0000000 0.0000000 0.4716981), wk = 0.0030960 k( 52) = ( 0.0000000 0.0000000 0.4811321), wk = 0.0030960 k( 53) = ( 0.0000000 0.0000000 0.4905660), wk = 0.0030960 k( 54) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030960 k( 55) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030960 k( 56) = ( -0.0092415 0.0092415 0.5000000), wk = 0.0030960 k( 57) = ( -0.0184829 0.0184829 0.5000000), wk = 0.0030960 k( 58) = ( -0.0277244 0.0277244 0.5000000), wk = 0.0030960 k( 59) = ( -0.0369659 0.0369659 0.5000000), wk = 0.0030960 k( 60) = ( -0.0462073 0.0462073 0.5000000), wk = 0.0030960 k( 61) = ( -0.0462073 0.0462073 0.5000000), wk = 0.0030960 k( 62) = ( -0.0528807 0.0528807 0.4933266), wk = 0.0030960 k( 63) = ( -0.0595542 0.0595542 0.4866532), wk = 0.0030960 k( 64) = ( -0.0662276 0.0662276 0.4799797), wk = 0.0030960 k( 65) = ( -0.0729010 0.0729010 0.4733063), wk = 0.0030960 k( 66) = ( -0.0795744 0.0795744 0.4666329), wk = 0.0030960 k( 67) = ( -0.0862478 0.0862478 0.4599595), wk = 0.0030960 k( 68) = ( -0.0929213 0.0929213 0.4532860), wk = 0.0030960 k( 69) = ( -0.0995947 0.0995947 0.4466126), wk = 0.0030960 k( 70) = ( -0.1062681 0.1062681 0.4399392), wk = 0.0030960 k( 71) = ( -0.1129415 0.1129415 0.4332658), wk = 0.0030960 k( 72) = ( -0.1196149 0.1196150 0.4265924), wk = 0.0030960 k( 73) = ( -0.1262884 0.1262884 0.4199189), wk = 0.0030960 k( 74) = ( -0.1329618 0.1329618 0.4132455), wk = 0.0030960 k( 75) = ( -0.1396352 0.1396352 0.4065721), wk = 0.0030960 k( 76) = ( -0.1463086 0.1463086 0.3998987), wk = 0.0030960 k( 77) = ( -0.1529821 0.1529821 0.3932253), wk = 0.0030960 k( 78) = ( -0.1596555 0.1596555 0.3865518), wk = 0.0030960 k( 79) = ( -0.1663289 0.1663289 0.3798784), wk = 0.0030960 k( 80) = ( -0.1730023 0.1730023 0.3732050), wk = 0.0030960 k( 81) = ( -0.1796757 0.1796758 0.3665316), wk = 0.0030960 k( 82) = ( -0.1863492 0.1863492 0.3598581), wk = 0.0030960 k( 83) = ( -0.1930226 0.1930226 0.3531847), wk = 0.0030960 k( 84) = ( -0.1996960 0.1996960 0.3465113), wk = 0.0030960 k( 85) = ( -0.2063694 0.2063694 0.3398379), wk = 0.0030960 k( 86) = ( -0.2130429 0.2130429 0.3331645), wk = 0.0030960 k( 87) = ( -0.2197163 0.2197163 0.3264910), wk = 0.0030960 k( 88) = ( -0.2263897 0.2263897 0.3198176), wk = 0.0030960 k( 89) = ( -0.2330631 0.2330631 0.3131442), wk = 0.0030960 k( 90) = ( -0.2397365 0.2397365 0.3064708), wk = 0.0030960 k( 91) = ( -0.2464100 0.2464100 0.2997973), wk = 0.0030960 k( 92) = ( -0.2530834 0.2530834 0.2931239), wk = 0.0030960 k( 93) = ( -0.2597568 0.2597568 0.2864505), wk = 0.0030960 k( 94) = ( -0.2664302 0.2664302 0.2797771), wk = 0.0030960 k( 95) = ( -0.2731036 0.2731037 0.2731036), wk = 0.0030960 k( 96) = ( -0.2731036 0.2731037 0.2731036), wk = 0.0030960 k( 97) = ( -0.2664426 0.2664426 0.2664426), wk = 0.0030960 k( 98) = ( -0.2597815 0.2597815 0.2597815), wk = 0.0030960 k( 99) = ( -0.2531205 0.2531205 0.2531205), wk = 0.0030960 k( 100) = ( -0.2464594 0.2464594 0.2464594), wk = 0.0030960 k( 101) = ( -0.2397983 0.2397983 0.2397983), wk = 0.0030960 k( 102) = ( -0.2331373 0.2331373 0.2331373), wk = 0.0030960 k( 103) = ( -0.2264762 0.2264762 0.2264762), wk = 0.0030960 k( 104) = ( -0.2198151 0.2198151 0.2198151), wk = 0.0030960 k( 105) = ( -0.2131541 0.2131541 0.2131541), wk = 0.0030960 k( 106) = ( -0.2064930 0.2064930 0.2064930), wk = 0.0030960 k( 107) = ( -0.1998319 0.1998319 0.1998319), wk = 0.0030960 k( 108) = ( -0.1931709 0.1931709 0.1931709), wk = 0.0030960 k( 109) = ( -0.1865098 0.1865098 0.1865098), wk = 0.0030960 k( 110) = ( -0.1798488 0.1798488 0.1798488), wk = 0.0030960 k( 111) = ( -0.1731877 0.1731877 0.1731877), wk = 0.0030960 k( 112) = ( -0.1665266 0.1665266 0.1665266), wk = 0.0030960 k( 113) = ( -0.1598655 0.1598656 0.1598656), wk = 0.0030960 k( 114) = ( -0.1532045 0.1532045 0.1532045), wk = 0.0030960 k( 115) = ( -0.1465434 0.1465434 0.1465434), wk = 0.0030960 k( 116) = ( -0.1398824 0.1398824 0.1398824), wk = 0.0030960 k( 117) = ( -0.1332213 0.1332213 0.1332213), wk = 0.0030960 k( 118) = ( -0.1265602 0.1265602 0.1265602), wk = 0.0030960 k( 119) = ( -0.1198992 0.1198992 0.1198992), wk = 0.0030960 k( 120) = ( -0.1132381 0.1132381 0.1132381), wk = 0.0030960 k( 121) = ( -0.1065770 0.1065770 0.1065770), wk = 0.0030960 k( 122) = ( -0.0999160 0.0999160 0.0999160), wk = 0.0030960 k( 123) = ( -0.0932549 0.0932549 0.0932549), wk = 0.0030960 k( 124) = ( -0.0865938 0.0865938 0.0865938), wk = 0.0030960 k( 125) = ( -0.0799328 0.0799328 0.0799328), wk = 0.0030960 k( 126) = ( -0.0732717 0.0732717 0.0732717), wk = 0.0030960 k( 127) = ( -0.0666106 0.0666106 0.0666107), wk = 0.0030960 k( 128) = ( -0.0599496 0.0599496 0.0599496), wk = 0.0030960 k( 129) = ( -0.0532885 0.0532885 0.0532885), wk = 0.0030960 k( 130) = ( -0.0466275 0.0466274 0.0466275), wk = 0.0030960 k( 131) = ( -0.0399664 0.0399664 0.0399664), wk = 0.0030960 k( 132) = ( -0.0333053 0.0333053 0.0333053), wk = 0.0030960 k( 133) = ( -0.0266443 0.0266443 0.0266443), wk = 0.0030960 k( 134) = ( -0.0199832 0.0199832 0.0199832), wk = 0.0030960 k( 135) = ( -0.0133221 0.0133221 0.0133221), wk = 0.0030960 k( 136) = ( -0.0066611 0.0066611 0.0066611), wk = 0.0030960 k( 137) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 138) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030960 k( 139) = ( 0.0217391 0.0217391 -0.0217391), wk = 0.0030960 k( 140) = ( 0.0434783 0.0434783 -0.0434783), wk = 0.0030960 k( 141) = ( 0.0652174 0.0652174 -0.0652174), wk = 0.0030960 k( 142) = ( 0.0869565 0.0869565 -0.0869565), wk = 0.0030960 k( 143) = ( 0.1086957 0.1086957 -0.1086957), wk = 0.0030960 k( 144) = ( 0.1304348 0.1304348 -0.1304348), wk = 0.0030960 k( 145) = ( 0.1521739 0.1521739 -0.1521739), wk = 0.0030960 k( 146) = ( 0.1739130 0.1739130 -0.1739130), wk = 0.0030960 k( 147) = ( 0.1956522 0.1956522 -0.1956522), wk = 0.0030960 k( 148) = ( 0.2173913 0.2173913 -0.2173913), wk = 0.0030960 k( 149) = ( 0.2391304 0.2391304 -0.2391304), wk = 0.0030960 k( 150) = ( 0.2608696 0.2608696 -0.2608696), wk = 0.0030960 k( 151) = ( 0.2826087 0.2826087 -0.2826087), wk = 0.0030960 k( 152) = ( 0.3043478 0.3043478 -0.3043478), wk = 0.0030960 k( 153) = ( 0.3260870 0.3260870 -0.3260870), wk = 0.0030960 k( 154) = ( 0.3478261 0.3478261 -0.3478261), wk = 0.0030960 k( 155) = ( 0.3695652 0.3695652 -0.3695652), wk = 0.0030960 k( 156) = ( 0.3913044 0.3913044 -0.3913044), wk = 0.0030960 k( 157) = ( 0.4130435 0.4130435 -0.4130435), wk = 0.0030960 k( 158) = ( 0.4347826 0.4347826 -0.4347826), wk = 0.0030960 k( 159) = ( 0.4565217 0.4565217 -0.4565217), wk = 0.0030960 k( 160) = ( 0.4782609 0.4782609 -0.4782609), wk = 0.0030960 k( 161) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0030960 k( 162) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0030960 k( 163) = ( 0.4933266 0.5066734 -0.4933266), wk = 0.0030960 k( 164) = ( 0.4866532 0.5133468 -0.4866532), wk = 0.0030960 k( 165) = ( 0.4799797 0.5200203 -0.4799797), wk = 0.0030960 k( 166) = ( 0.4733063 0.5266937 -0.4733063), wk = 0.0030960 k( 167) = ( 0.4666329 0.5333671 -0.4666329), wk = 0.0030960 k( 168) = ( 0.4599595 0.5400405 -0.4599595), wk = 0.0030960 k( 169) = ( 0.4532860 0.5467140 -0.4532860), wk = 0.0030960 k( 170) = ( 0.4466126 0.5533874 -0.4466126), wk = 0.0030960 k( 171) = ( 0.4399392 0.5600608 -0.4399392), wk = 0.0030960 k( 172) = ( 0.4332658 0.5667342 -0.4332658), wk = 0.0030960 k( 173) = ( 0.4265924 0.5734076 -0.4265924), wk = 0.0030960 k( 174) = ( 0.4199189 0.5800811 -0.4199189), wk = 0.0030960 k( 175) = ( 0.4132455 0.5867545 -0.4132455), wk = 0.0030960 k( 176) = ( 0.4065721 0.5934279 -0.4065721), wk = 0.0030960 k( 177) = ( 0.3998987 0.6001013 -0.3998987), wk = 0.0030960 k( 178) = ( 0.3932253 0.6067748 -0.3932253), wk = 0.0030960 k( 179) = ( 0.3865518 0.6134482 -0.3865518), wk = 0.0030960 k( 180) = ( 0.3798784 0.6201216 -0.3798784), wk = 0.0030960 k( 181) = ( 0.3732050 0.6267950 -0.3732050), wk = 0.0030960 k( 182) = ( 0.3665316 0.6334684 -0.3665316), wk = 0.0030960 k( 183) = ( 0.3598581 0.6401419 -0.3598581), wk = 0.0030960 k( 184) = ( 0.3531847 0.6468153 -0.3531847), wk = 0.0030960 k( 185) = ( 0.3465113 0.6534887 -0.3465113), wk = 0.0030960 k( 186) = ( 0.3398379 0.6601621 -0.3398379), wk = 0.0030960 k( 187) = ( 0.3331645 0.6668356 -0.3331645), wk = 0.0030960 k( 188) = ( 0.3264910 0.6735090 -0.3264910), wk = 0.0030960 k( 189) = ( 0.3198176 0.6801824 -0.3198176), wk = 0.0030960 k( 190) = ( 0.3131442 0.6868558 -0.3131442), wk = 0.0030960 k( 191) = ( 0.3064708 0.6935292 -0.3064708), wk = 0.0030960 k( 192) = ( 0.2997973 0.7002027 -0.2997973), wk = 0.0030960 k( 193) = ( 0.2931239 0.7068761 -0.2931239), wk = 0.0030960 k( 194) = ( 0.2864505 0.7135495 -0.2864505), wk = 0.0030960 k( 195) = ( 0.2797771 0.7202229 -0.2797771), wk = 0.0030960 k( 196) = ( 0.2731036 0.7268964 -0.2731037), wk = 0.0030960 k( 197) = ( 0.2731036 0.7268964 -0.2731037), wk = 0.0030960 k( 198) = ( 0.2503450 0.7079883 -0.2503450), wk = 0.0030960 k( 199) = ( 0.2275864 0.6890803 -0.2275864), wk = 0.0030960 k( 200) = ( 0.2048277 0.6701723 -0.2048277), wk = 0.0030960 k( 201) = ( 0.1820691 0.6512642 -0.1820691), wk = 0.0030960 k( 202) = ( 0.1593105 0.6323562 -0.1593105), wk = 0.0030960 k( 203) = ( 0.1365518 0.6134482 -0.1365518), wk = 0.0030960 k( 204) = ( 0.1137932 0.5945401 -0.1137932), wk = 0.0030960 k( 205) = ( 0.0910346 0.5756321 -0.0910346), wk = 0.0030960 k( 206) = ( 0.0682759 0.5567241 -0.0682759), wk = 0.0030960 k( 207) = ( 0.0455173 0.5378161 -0.0455173), wk = 0.0030960 k( 208) = ( 0.0227586 0.5189080 -0.0227586), wk = 0.0030960 k( 209) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030960 k( 210) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0030960 k( 211) = ( 0.0067568 0.4932432 0.0067568), wk = 0.0030960 k( 212) = ( 0.0135135 0.4864865 0.0135135), wk = 0.0030960 k( 213) = ( 0.0202703 0.4797297 0.0202703), wk = 0.0030960 k( 214) = ( 0.0270270 0.4729730 0.0270270), wk = 0.0030960 k( 215) = ( 0.0337838 0.4662162 0.0337838), wk = 0.0030960 k( 216) = ( 0.0405405 0.4594595 0.0405405), wk = 0.0030960 k( 217) = ( 0.0472973 0.4527027 0.0472973), wk = 0.0030960 k( 218) = ( 0.0540540 0.4459460 0.0540540), wk = 0.0030960 k( 219) = ( 0.0608108 0.4391892 0.0608108), wk = 0.0030960 k( 220) = ( 0.0675676 0.4324324 0.0675676), wk = 0.0030960 k( 221) = ( 0.0743243 0.4256757 0.0743243), wk = 0.0030960 k( 222) = ( 0.0810811 0.4189189 0.0810811), wk = 0.0030960 k( 223) = ( 0.0878378 0.4121622 0.0878378), wk = 0.0030960 k( 224) = ( 0.0945946 0.4054054 0.0945946), wk = 0.0030960 k( 225) = ( 0.1013514 0.3986487 0.1013514), wk = 0.0030960 k( 226) = ( 0.1081081 0.3918919 0.1081081), wk = 0.0030960 k( 227) = ( 0.1148649 0.3851351 0.1148649), wk = 0.0030960 k( 228) = ( 0.1216216 0.3783784 0.1216216), wk = 0.0030960 k( 229) = ( 0.1283784 0.3716216 0.1283784), wk = 0.0030960 k( 230) = ( 0.1351351 0.3648649 0.1351351), wk = 0.0030960 k( 231) = ( 0.1418919 0.3581081 0.1418919), wk = 0.0030960 k( 232) = ( 0.1486486 0.3513514 0.1486486), wk = 0.0030960 k( 233) = ( 0.1554054 0.3445946 0.1554054), wk = 0.0030960 k( 234) = ( 0.1621622 0.3378378 0.1621622), wk = 0.0030960 k( 235) = ( 0.1689189 0.3310811 0.1689189), wk = 0.0030960 k( 236) = ( 0.1756757 0.3243243 0.1756757), wk = 0.0030960 k( 237) = ( 0.1824324 0.3175676 0.1824324), wk = 0.0030960 k( 238) = ( 0.1891892 0.3108108 0.1891892), wk = 0.0030960 k( 239) = ( 0.1959460 0.3040541 0.1959460), wk = 0.0030960 k( 240) = ( 0.2027027 0.2972973 0.2027027), wk = 0.0030960 k( 241) = ( 0.2094595 0.2905405 0.2094595), wk = 0.0030960 k( 242) = ( 0.2162162 0.2837838 0.2162162), wk = 0.0030960 k( 243) = ( 0.2229730 0.2770270 0.2229730), wk = 0.0030960 k( 244) = ( 0.2297297 0.2702703 0.2297297), wk = 0.0030960 k( 245) = ( 0.2364865 0.2635135 0.2364865), wk = 0.0030960 k( 246) = ( 0.2432432 0.2567568 0.2432432), wk = 0.0030960 k( 247) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0030960 k( 248) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0030960 k( 249) = ( 0.2692308 0.2692308 0.2272148), wk = 0.0030960 k( 250) = ( 0.2884615 0.2884615 0.2044297), wk = 0.0030960 k( 251) = ( 0.3076923 0.3076923 0.1816445), wk = 0.0030960 k( 252) = ( 0.3269231 0.3269231 0.1588593), wk = 0.0030960 k( 253) = ( 0.3461538 0.3461539 0.1360741), wk = 0.0030960 k( 254) = ( 0.3653846 0.3653846 0.1132889), wk = 0.0030960 k( 255) = ( 0.3846154 0.3846154 0.0905038), wk = 0.0030960 k( 256) = ( 0.4038462 0.4038462 0.0677186), wk = 0.0030960 k( 257) = ( 0.4230769 0.4230769 0.0449334), wk = 0.0030960 k( 258) = ( 0.4423077 0.4423077 0.0221482), wk = 0.0030960 k( 259) = ( 0.4615385 0.4615385 -0.0006370), wk = 0.0030960 k( 260) = ( 0.4807692 0.4807692 -0.0234221), wk = 0.0030960 k( 261) = ( 0.5000000 0.5000000 -0.0462073), wk = 0.0030960 k( 262) = ( 0.5000000 0.5000000 -0.0462073), wk = 0.0030960 k( 263) = ( 0.5000000 0.5000000 -0.0556613), wk = 0.0030960 k( 264) = ( 0.5000000 0.5000000 -0.0651153), wk = 0.0030960 k( 265) = ( 0.5000000 0.5000000 -0.0745693), wk = 0.0030960 k( 266) = ( 0.5000000 0.5000000 -0.0840234), wk = 0.0030960 k( 267) = ( 0.5000000 0.5000000 -0.0934774), wk = 0.0030960 k( 268) = ( 0.5000000 0.5000000 -0.1029314), wk = 0.0030960 k( 269) = ( 0.5000000 0.5000000 -0.1123854), wk = 0.0030960 k( 270) = ( 0.5000000 0.5000000 -0.1218394), wk = 0.0030960 k( 271) = ( 0.5000000 0.5000000 -0.1312934), wk = 0.0030960 k( 272) = ( 0.5000000 0.5000000 -0.1407474), wk = 0.0030960 k( 273) = ( 0.5000000 0.5000000 -0.1502015), wk = 0.0030960 k( 274) = ( 0.5000000 0.5000000 -0.1596555), wk = 0.0030960 k( 275) = ( 0.5000000 0.5000000 -0.1691095), wk = 0.0030960 k( 276) = ( 0.5000000 0.5000000 -0.1785635), wk = 0.0030960 k( 277) = ( 0.5000000 0.5000000 -0.1880175), wk = 0.0030960 k( 278) = ( 0.5000000 0.5000000 -0.1974715), wk = 0.0030960 k( 279) = ( 0.5000000 0.5000000 -0.2069256), wk = 0.0030960 k( 280) = ( 0.5000000 0.5000000 -0.2163796), wk = 0.0030960 k( 281) = ( 0.5000000 0.5000000 -0.2258336), wk = 0.0030960 k( 282) = ( 0.5000000 0.5000000 -0.2352876), wk = 0.0030960 k( 283) = ( 0.5000000 0.5000000 -0.2447416), wk = 0.0030960 k( 284) = ( 0.5000000 0.5000000 -0.2541956), wk = 0.0030960 k( 285) = ( 0.5000000 0.5000000 -0.2636496), wk = 0.0030960 k( 286) = ( 0.5000000 0.5000000 -0.2731036), wk = 0.0030960 k( 287) = ( 0.5000000 0.5000000 -0.2825577), wk = 0.0030960 k( 288) = ( 0.5000000 0.5000000 -0.2920117), wk = 0.0030960 k( 289) = ( 0.5000000 0.5000000 -0.3014657), wk = 0.0030960 k( 290) = ( 0.5000000 0.5000000 -0.3109197), wk = 0.0030960 k( 291) = ( 0.5000000 0.5000000 -0.3203737), wk = 0.0030960 k( 292) = ( 0.5000000 0.5000000 -0.3298277), wk = 0.0030960 k( 293) = ( 0.5000000 0.5000000 -0.3392817), wk = 0.0030960 k( 294) = ( 0.5000000 0.5000000 -0.3487358), wk = 0.0030960 k( 295) = ( 0.5000000 0.5000000 -0.3581898), wk = 0.0030960 k( 296) = ( 0.5000000 0.5000000 -0.3676438), wk = 0.0030960 k( 297) = ( 0.5000000 0.5000000 -0.3770978), wk = 0.0030960 k( 298) = ( 0.5000000 0.5000000 -0.3865518), wk = 0.0030960 k( 299) = ( 0.5000000 0.5000000 -0.3960058), wk = 0.0030960 k( 300) = ( 0.5000000 0.5000000 -0.4054599), wk = 0.0030960 k( 301) = ( 0.5000000 0.5000000 -0.4149139), wk = 0.0030960 k( 302) = ( 0.5000000 0.5000000 -0.4243679), wk = 0.0030960 k( 303) = ( 0.5000000 0.5000000 -0.4338219), wk = 0.0030960 k( 304) = ( 0.5000000 0.5000000 -0.4432759), wk = 0.0030960 k( 305) = ( 0.5000000 0.5000000 -0.4527299), wk = 0.0030960 k( 306) = ( 0.5000000 0.5000000 -0.4621839), wk = 0.0030960 k( 307) = ( 0.5000000 0.5000000 -0.4716380), wk = 0.0030960 k( 308) = ( 0.5000000 0.5000000 -0.4810920), wk = 0.0030960 k( 309) = ( 0.5000000 0.5000000 -0.4905460), wk = 0.0030960 k( 310) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0030960 k( 311) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030960 k( 312) = ( 0.0208333 0.0208333 0.4791667), wk = 0.0030960 k( 313) = ( 0.0416667 0.0416667 0.4583333), wk = 0.0030960 k( 314) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0030960 k( 315) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0030960 k( 316) = ( 0.1041667 0.1041667 0.3958333), wk = 0.0030960 k( 317) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0030960 k( 318) = ( 0.1458333 0.1458333 0.3541667), wk = 0.0030960 k( 319) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0030960 k( 320) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0030960 k( 321) = ( 0.2083333 0.2083333 0.2916667), wk = 0.0030960 k( 322) = ( 0.2291667 0.2291667 0.2708333), wk = 0.0030960 k( 323) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0030960 Dense grid: 331283 G-vectors FFT dimensions: ( 135, 135, 135) Smooth grid: 50159 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.17 Mb ( 260, 44) NL pseudopotentials 0.16 Mb ( 130, 82) Each V/rho on FFT grid 0.83 Mb ( 54675) Each G-vector array 0.05 Mb ( 6902) G-vector shells 0.02 Mb ( 3202) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.70 Mb ( 260, 176) Each subspace H/S matrix 0.47 Mb ( 176, 176) Each matrix 0.11 Mb ( 82, 2, 44) The potential is recalculated from file : ./RbMnSe2.save/charge-density.dat Starting wfc are 52 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 44.1 secs Computing kpt #: 2 total cpu time spent up to now is 47.0 secs Computing kpt #: 3 total cpu time spent up to now is 49.8 secs Computing kpt #: 4 total cpu time spent up to now is 52.6 secs Computing kpt #: 5 total cpu time spent up to now is 55.5 secs Computing kpt #: 6 total cpu time spent up to now is 58.4 secs Computing kpt #: 7 total cpu time spent up to now is 61.2 secs Computing kpt #: 8 total cpu time spent up to now is 64.1 secs Computing kpt #: 9 total cpu time spent up to now is 67.0 secs Computing kpt #: 10 total cpu time spent up to now is 70.0 secs Computing kpt #: 11 total cpu time spent up to now is 73.0 secs Computing kpt #: 12 total cpu time spent up to now is 75.9 secs Computing kpt #: 13 total cpu time spent up to now is 78.9 secs Computing kpt #: 14 total cpu time spent up to now is 81.9 secs Computing kpt #: 15 total cpu time spent up to now is 84.9 secs Computing kpt #: 16 total cpu time spent up to now is 87.8 secs Computing kpt #: 17 total cpu time spent up to now is 91.2 secs Computing kpt #: 18 total cpu time spent up to now is 94.4 secs Computing kpt #: 19 total cpu time spent up to now is 97.7 secs Computing kpt #: 20 total cpu time spent up to now is 101.1 secs Computing kpt #: 21 total cpu time spent up to now is 104.5 secs Computing kpt #: 22 total cpu time spent up to now is 108.0 secs Computing kpt #: 23 total cpu time spent up to now is 111.4 secs Computing kpt #: 24 total cpu time spent up to now is 114.8 secs Computing kpt #: 25 total cpu time spent up to now is 118.2 secs Computing kpt #: 26 total cpu time spent up to now is 121.6 secs Computing kpt #: 27 total cpu time spent up to now is 125.0 secs Computing kpt #: 28 total cpu time spent up to now is 128.3 secs Computing kpt #: 29 total cpu time spent up to now is 131.7 secs Computing kpt #: 30 total cpu time spent up to now is 135.4 secs Computing kpt #: 31 total cpu time spent up to now is 138.9 secs Computing kpt #: 32 total cpu time spent up to now is 142.4 secs Computing kpt #: 33 total cpu time spent up to now is 146.0 secs Computing kpt #: 34 total cpu time spent up to now is 149.6 secs Computing kpt #: 35 total cpu time spent up to now is 153.0 secs Computing kpt #: 36 total cpu time spent up to now is 156.6 secs Computing kpt #: 37 total cpu time spent up to now is 160.3 secs Computing kpt #: 38 total cpu time spent up to now is 163.9 secs Computing kpt #: 39 total cpu time spent up to now is 167.5 secs Computing kpt #: 40 total cpu time spent up to now is 171.2 secs Computing kpt #: 41 total cpu time spent up to now is 174.9 secs Computing kpt #: 42 total cpu time spent up to now is 178.5 secs Computing kpt #: 43 total cpu time spent up to now is 182.2 secs Computing kpt #: 44 total cpu time spent up to now is 185.9 secs Computing kpt #: 45 total cpu time spent up to now is 189.5 secs Computing kpt #: 46 total cpu time spent up to now is 193.1 secs Computing kpt #: 47 total cpu time spent up to now is 196.6 secs Computing kpt #: 48 total cpu time spent up to now is 201.7 secs Computing kpt #: 49 total cpu time spent up to now is 206.6 secs Computing kpt #: 50 total cpu time spent up to now is 209.9 secs Computing kpt #: 51 total cpu time spent up to now is 213.3 secs Computing kpt #: 52 total cpu time spent up to now is 216.7 secs Computing kpt #: 53 total cpu time spent up to now is 220.0 secs Computing kpt #: 54 total cpu time spent up to now is 223.3 secs Computing kpt #: 55 total cpu time spent up to now is 226.6 secs Computing kpt #: 56 total cpu time spent up to now is 229.9 secs Computing kpt #: 57 total cpu time spent up to now is 233.3 secs Computing kpt #: 58 total cpu time spent up to now is 236.6 secs Computing kpt #: 59 total cpu time spent up to now is 239.9 secs Computing kpt #: 60 total cpu time spent up to now is 243.2 secs Computing kpt #: 61 total cpu time spent up to now is 246.5 secs Computing kpt #: 62 total cpu time spent up to now is 249.9 secs Computing kpt #: 63 total cpu time spent up to now is 253.2 secs Computing kpt #: 64 total cpu time spent up to now is 256.6 secs Computing kpt #: 65 total cpu time spent up to now is 260.0 secs Computing kpt #: 66 total cpu time spent up to now is 263.4 secs Computing kpt #: 67 total cpu time spent up to now is 267.0 secs Computing kpt #: 68 total cpu time spent up to now is 270.5 secs Computing kpt #: 69 total cpu time spent up to now is 274.2 secs Computing kpt #: 70 total cpu time spent up to now is 277.8 secs Computing kpt #: 71 total cpu time spent up to now is 281.4 secs Computing kpt #: 72 total cpu time spent up to now is 285.5 secs Computing kpt #: 73 total cpu time spent up to now is 289.5 secs Computing kpt #: 74 total cpu time spent up to now is 293.5 secs Computing kpt #: 75 total cpu time spent up to now is 297.5 secs Computing kpt #: 76 total cpu time spent up to now is 301.5 secs Computing kpt #: 77 total cpu time spent up to now is 305.7 secs Computing kpt #: 78 total cpu time spent up to now is 309.4 secs Computing kpt #: 79 total cpu time spent up to now is 312.9 secs Computing kpt #: 80 total cpu time spent up to now is 316.4 secs Computing kpt #: 81 total cpu time spent up to now is 319.9 secs Computing kpt #: 82 total cpu time spent up to now is 323.4 secs Computing kpt #: 83 total cpu time spent up to now is 327.1 secs Computing kpt #: 84 total cpu time spent up to now is 330.6 secs Computing kpt #: 85 total cpu time spent up to now is 334.4 secs Computing kpt #: 86 total cpu time spent up to now is 337.9 secs Computing kpt #: 87 total cpu time spent up to now is 341.5 secs Computing kpt #: 88 total cpu time spent up to now is 345.0 secs Computing kpt #: 89 total cpu time spent up to now is 348.7 secs Computing kpt #: 90 total cpu time spent up to now is 352.3 secs Computing kpt #: 91 total cpu time spent up to now is 356.1 secs Computing kpt #: 92 total cpu time spent up to now is 359.6 secs Computing kpt #: 93 total cpu time spent up to now is 363.1 secs Computing kpt #: 94 total cpu time spent up to now is 366.5 secs Computing kpt #: 95 total cpu time spent up to now is 370.0 secs Computing kpt #: 96 total cpu time spent up to now is 373.8 secs Computing kpt #: 97 total cpu time spent up to now is 377.3 secs Computing kpt #: 98 total cpu time spent up to now is 380.8 secs Computing kpt #: 99 total cpu time spent up to now is 384.3 secs Computing kpt #: 100 total cpu time spent up to now is 387.7 secs Computing kpt #: 101 total cpu time spent up to now is 391.3 secs Computing kpt #: 102 total cpu time spent up to now is 394.8 secs Computing kpt #: 103 total cpu time spent up to now is 398.3 secs Computing kpt #: 104 total cpu time spent up to now is 401.9 secs Computing kpt #: 105 total cpu time spent up to now is 405.5 secs Computing kpt #: 106 total cpu time spent up to now is 409.1 secs Computing kpt #: 107 total cpu time spent up to now is 412.8 secs Computing kpt #: 108 total cpu time spent up to now is 416.6 secs Computing kpt #: 109 total cpu time spent up to now is 420.2 secs Computing kpt #: 110 total cpu time spent up to now is 424.1 secs Computing kpt #: 111 total cpu time spent up to now is 427.7 secs Computing kpt #: 112 total cpu time spent up to now is 431.3 secs Computing kpt #: 113 total cpu time spent up to now is 435.1 secs Computing kpt #: 114 total cpu time spent up to now is 439.0 secs Computing kpt #: 115 total cpu time spent up to now is 442.5 secs Computing kpt #: 116 total cpu time spent up to now is 445.9 secs Computing kpt #: 117 total cpu time spent up to now is 449.3 secs Computing kpt #: 118 total cpu time spent up to now is 452.9 secs Computing kpt #: 119 total cpu time spent up to now is 456.2 secs Computing kpt #: 120 total cpu time spent up to now is 459.7 secs Computing kpt #: 121 total cpu time spent up to now is 463.1 secs Computing kpt #: 122 total cpu time spent up to now is 466.5 secs Computing kpt #: 123 total cpu time spent up to now is 469.8 secs Computing kpt #: 124 total cpu time spent up to now is 473.4 secs Computing kpt #: 125 total cpu time spent up to now is 476.8 secs Computing kpt #: 126 total cpu time spent up to now is 480.7 secs Computing kpt #: 127 total cpu time spent up to now is 483.9 secs Computing kpt #: 128 total cpu time spent up to now is 487.4 secs Computing kpt #: 129 total cpu time spent up to now is 490.8 secs Computing kpt #: 130 total cpu time spent up to now is 494.1 secs Computing kpt #: 131 total cpu time spent up to now is 497.4 secs Computing kpt #: 132 total cpu time spent up to now is 503.3 secs Computing kpt #: 133 total cpu time spent up to now is 507.3 secs Computing kpt #: 134 total cpu time spent up to now is 510.5 secs Computing kpt #: 135 total cpu time spent up to now is 513.6 secs Computing kpt #: 136 total cpu time spent up to now is 516.5 secs Computing kpt #: 137 total cpu time spent up to now is 519.2 secs Computing kpt #: 138 total cpu time spent up to now is 522.2 secs Computing kpt #: 139 total cpu time spent up to now is 525.1 secs Computing kpt #: 140 total cpu time spent up to now is 527.9 secs Computing kpt #: 141 total cpu time spent up to now is 530.7 secs Computing kpt #: 142 total cpu time spent up to now is 533.5 secs Computing kpt #: 143 total cpu time spent up to now is 536.3 secs Computing kpt #: 144 total cpu time spent up to now is 539.2 secs Computing kpt #: 145 total cpu time spent up to now is 542.0 secs Computing kpt #: 146 total cpu time spent up to now is 545.2 secs Computing kpt #: 147 total cpu time spent up to now is 548.6 secs Computing kpt #: 148 total cpu time spent up to now is 551.9 secs Computing kpt #: 149 total cpu time spent up to now is 555.3 secs Computing kpt #: 150 total cpu time spent up to now is 558.7 secs Computing kpt #: 151 total cpu time spent up to now is 562.4 secs Computing kpt #: 152 total cpu time spent up to now is 566.2 secs Computing kpt #: 153 total cpu time spent up to now is 569.9 secs Computing kpt #: 154 total cpu time spent up to now is 574.1 secs Computing kpt #: 155 total cpu time spent up to now is 578.2 secs Computing kpt #: 156 total cpu time spent up to now is 582.3 secs Computing kpt #: 157 total cpu time spent up to now is 586.5 secs Computing kpt #: 158 total cpu time spent up to now is 590.7 secs Computing kpt #: 159 total cpu time spent up to now is 595.1 secs Computing kpt #: 160 total cpu time spent up to now is 599.2 secs Computing kpt #: 161 total cpu time spent up to now is 603.4 secs Computing kpt #: 162 total cpu time spent up to now is 608.0 secs Computing kpt #: 163 total cpu time spent up to now is 612.3 secs Computing kpt #: 164 total cpu time spent up to now is 617.0 secs Computing kpt #: 165 total cpu time spent up to now is 621.5 secs Computing kpt #: 166 total cpu time spent up to now is 625.8 secs Computing kpt #: 167 total cpu time spent up to now is 630.3 secs Computing kpt #: 168 total cpu time spent up to now is 634.5 secs Computing kpt #: 169 total cpu time spent up to now is 638.8 secs Computing kpt #: 170 total cpu time spent up to now is 643.1 secs Computing kpt #: 171 total cpu time spent up to now is 647.3 secs Computing kpt #: 172 total cpu time spent up to now is 651.4 secs Computing kpt #: 173 total cpu time spent up to now is 655.1 secs Computing kpt #: 174 total cpu time spent up to now is 658.8 secs Computing kpt #: 175 total cpu time spent up to now is 663.0 secs Computing kpt #: 176 total cpu time spent up to now is 667.1 secs Computing kpt #: 177 total cpu time spent up to now is 671.3 secs Computing kpt #: 178 total cpu time spent up to now is 675.5 secs Computing kpt #: 179 total cpu time spent up to now is 679.1 secs Computing kpt #: 180 total cpu time spent up to now is 683.2 secs Computing kpt #: 181 total cpu time spent up to now is 687.2 secs Computing kpt #: 182 total cpu time spent up to now is 691.4 secs Computing kpt #: 183 total cpu time spent up to now is 695.4 secs Computing kpt #: 184 total cpu time spent up to now is 699.4 secs Computing kpt #: 185 total cpu time spent up to now is 703.6 secs Computing kpt #: 186 total cpu time spent up to now is 707.6 secs Computing kpt #: 187 total cpu time spent up to now is 711.2 secs Computing kpt #: 188 total cpu time spent up to now is 714.8 secs Computing kpt #: 189 total cpu time spent up to now is 718.3 secs Computing kpt #: 190 total cpu time spent up to now is 721.9 secs Computing kpt #: 191 total cpu time spent up to now is 725.4 secs Computing kpt #: 192 total cpu time spent up to now is 728.9 secs Computing kpt #: 193 total cpu time spent up to now is 732.5 secs Computing kpt #: 194 total cpu time spent up to now is 735.9 secs Computing kpt #: 195 total cpu time spent up to now is 739.4 secs Computing kpt #: 196 total cpu time spent up to now is 742.9 secs Computing kpt #: 197 total cpu time spent up to now is 746.3 secs Computing kpt #: 198 total cpu time spent up to now is 749.8 secs Computing kpt #: 199 total cpu time spent up to now is 753.3 secs Computing kpt #: 200 total cpu time spent up to now is 756.9 secs Computing kpt #: 201 total cpu time spent up to now is 760.4 secs Computing kpt #: 202 total cpu time spent up to now is 764.0 secs Computing kpt #: 203 total cpu time spent up to now is 767.5 secs Computing kpt #: 204 total cpu time spent up to now is 771.0 secs Computing kpt #: 205 total cpu time spent up to now is 774.6 secs Computing kpt #: 206 total cpu time spent up to now is 778.2 secs Computing kpt #: 207 total cpu time spent up to now is 781.6 secs Computing kpt #: 208 total cpu time spent up to now is 785.1 secs Computing kpt #: 209 total cpu time spent up to now is 788.6 secs Computing kpt #: 210 total cpu time spent up to now is 792.1 secs Computing kpt #: 211 total cpu time spent up to now is 795.7 secs Computing kpt #: 212 total cpu time spent up to now is 799.9 secs Computing kpt #: 213 total cpu time spent up to now is 805.6 secs Computing kpt #: 214 total cpu time spent up to now is 809.3 secs Computing kpt #: 215 total cpu time spent up to now is 812.9 secs Computing kpt #: 216 total cpu time spent up to now is 816.5 secs Computing kpt #: 217 total cpu time spent up to now is 820.1 secs Computing kpt #: 218 total cpu time spent up to now is 823.7 secs Computing kpt #: 219 total cpu time spent up to now is 827.3 secs Computing kpt #: 220 total cpu time spent up to now is 830.9 secs Computing kpt #: 221 total cpu time spent up to now is 834.6 secs Computing kpt #: 222 total cpu time spent up to now is 838.3 secs Computing kpt #: 223 total cpu time spent up to now is 842.0 secs Computing kpt #: 224 total cpu time spent up to now is 846.0 secs Computing kpt #: 225 total cpu time spent up to now is 850.0 secs Computing kpt #: 226 total cpu time spent up to now is 854.2 secs Computing kpt #: 227 total cpu time spent up to now is 858.3 secs Computing kpt #: 228 total cpu time spent up to now is 862.5 secs Computing kpt #: 229 total cpu time spent up to now is 866.7 secs Computing kpt #: 230 total cpu time spent up to now is 871.7 secs Computing kpt #: 231 total cpu time spent up to now is 878.1 secs Computing kpt #: 232 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 884.7 secs Computing kpt #: 233 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 891.3 secs Computing kpt #: 234 total cpu time spent up to now is 896.2 secs Computing kpt #: 235 total cpu time spent up to now is 901.8 secs Computing kpt #: 236 total cpu time spent up to now is 907.0 secs Computing kpt #: 237 total cpu time spent up to now is 911.8 secs Computing kpt #: 238 total cpu time spent up to now is 916.6 secs Computing kpt #: 239 total cpu time spent up to now is 921.3 secs Computing kpt #: 240 total cpu time spent up to now is 925.5 secs Computing kpt #: 241 total cpu time spent up to now is 930.0 secs Computing kpt #: 242 total cpu time spent up to now is 934.2 secs Computing kpt #: 243 total cpu time spent up to now is 938.5 secs Computing kpt #: 244 total cpu time spent up to now is 942.9 secs Computing kpt #: 245 total cpu time spent up to now is 947.2 secs Computing kpt #: 246 total cpu time spent up to now is 951.4 secs Computing kpt #: 247 total cpu time spent up to now is 955.7 secs Computing kpt #: 248 total cpu time spent up to now is 960.0 secs Computing kpt #: 249 total cpu time spent up to now is 964.2 secs Computing kpt #: 250 total cpu time spent up to now is 968.1 secs Computing kpt #: 251 total cpu time spent up to now is 971.7 secs Computing kpt #: 252 total cpu time spent up to now is 975.2 secs Computing kpt #: 253 total cpu time spent up to now is 978.7 secs Computing kpt #: 254 total cpu time spent up to now is 982.2 secs Computing kpt #: 255 total cpu time spent up to now is 985.7 secs Computing kpt #: 256 total cpu time spent up to now is 989.0 secs Computing kpt #: 257 total cpu time spent up to now is 992.3 secs Computing kpt #: 258 total cpu time spent up to now is 995.6 secs Computing kpt #: 259 total cpu time spent up to now is 999.0 secs Computing kpt #: 260 total cpu time spent up to now is 1002.4 secs Computing kpt #: 261 total cpu time spent up to now is 1005.7 secs Computing kpt #: 262 total cpu time spent up to now is 1009.1 secs Computing kpt #: 263 total cpu time spent up to now is 1012.4 secs Computing kpt #: 264 total cpu time spent up to now is 1015.7 secs Computing kpt #: 265 total cpu time spent up to now is 1019.1 secs Computing kpt #: 266 total cpu time spent up to now is 1022.5 secs Computing kpt #: 267 total cpu time spent up to now is 1025.8 secs Computing kpt #: 268 total cpu time spent up to now is 1029.2 secs Computing kpt #: 269 total cpu time spent up to now is 1032.6 secs Computing kpt #: 270 total cpu time spent up to now is 1036.0 secs Computing kpt #: 271 total cpu time spent up to now is 1039.4 secs Computing kpt #: 272 total cpu time spent up to now is 1042.9 secs Computing kpt #: 273 total cpu time spent up to now is 1046.4 secs Computing kpt #: 274 total cpu time spent up to now is 1050.0 secs Computing kpt #: 275 total cpu time spent up to now is 1053.5 secs Computing kpt #: 276 total cpu time spent up to now is 1057.1 secs Computing kpt #: 277 total cpu time spent up to now is 1060.7 secs Computing kpt #: 278 total cpu time spent up to now is 1064.3 secs Computing kpt #: 279 total cpu time spent up to now is 1067.9 secs Computing kpt #: 280 total cpu time spent up to now is 1071.8 secs Computing kpt #: 281 total cpu time spent up to now is 1075.8 secs Computing kpt #: 282 total cpu time spent up to now is 1079.7 secs Computing kpt #: 283 total cpu time spent up to now is 1083.7 secs Computing kpt #: 284 total cpu time spent up to now is 1087.7 secs Computing kpt #: 285 total cpu time spent up to now is 1091.7 secs Computing kpt #: 286 total cpu time spent up to now is 1095.7 secs Computing kpt #: 287 total cpu time spent up to now is 1101.3 secs Computing kpt #: 288 total cpu time spent up to now is 1107.0 secs Computing kpt #: 289 total cpu time spent up to now is 1111.7 secs Computing kpt #: 290 total cpu time spent up to now is 1116.5 secs Computing kpt #: 291 total cpu time spent up to now is 1121.9 secs Computing kpt #: 292 total cpu time spent up to now is 1127.7 secs Computing kpt #: 293 total cpu time spent up to now is 1133.4 secs Computing kpt #: 294 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1140.0 secs Computing kpt #: 295 total cpu time spent up to now is 1145.5 secs Computing kpt #: 296 total cpu time spent up to now is 1151.2 secs Computing kpt #: 297 total cpu time spent up to now is 1156.0 secs Computing kpt #: 298 total cpu time spent up to now is 1161.6 secs Computing kpt #: 299 total cpu time spent up to now is 1166.7 secs Computing kpt #: 300 total cpu time spent up to now is 1171.8 secs Computing kpt #: 301 total cpu time spent up to now is 1176.8 secs Computing kpt #: 302 total cpu time spent up to now is 1181.6 secs Computing kpt #: 303 total cpu time spent up to now is 1186.4 secs Computing kpt #: 304 total cpu time spent up to now is 1191.4 secs Computing kpt #: 305 total cpu time spent up to now is 1195.9 secs Computing kpt #: 306 total cpu time spent up to now is 1200.3 secs Computing kpt #: 307 total cpu time spent up to now is 1204.6 secs Computing kpt #: 308 total cpu time spent up to now is 1209.0 secs Computing kpt #: 309 total cpu time spent up to now is 1213.3 secs Computing kpt #: 310 total cpu time spent up to now is 1217.4 secs Computing kpt #: 311 total cpu time spent up to now is 1220.9 secs Computing kpt #: 312 total cpu time spent up to now is 1224.3 secs Computing kpt #: 313 total cpu time spent up to now is 1227.6 secs Computing kpt #: 314 total cpu time spent up to now is 1231.0 secs Computing kpt #: 315 total cpu time spent up to now is 1234.3 secs Computing kpt #: 316 total cpu time spent up to now is 1238.1 secs Computing kpt #: 317 total cpu time spent up to now is 1241.6 secs Computing kpt #: 318 total cpu time spent up to now is 1245.1 secs Computing kpt #: 319 total cpu time spent up to now is 1248.7 secs Computing kpt #: 320 total cpu time spent up to now is 1252.2 secs Computing kpt #: 321 total cpu time spent up to now is 1256.2 secs Computing kpt #: 322 total cpu time spent up to now is 1260.3 secs Computing kpt #: 323 total cpu time spent up to now is 1264.6 secs ethr = 2.78E-11, avg # of iterations = 37.7 total cpu time spent up to now is 1264.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6303 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8648 -7.8648 -7.5992 -7.5992 -6.9165 -6.9165 -6.1157 -6.1157 -6.0437 -6.0437 1.1169 1.1169 2.0203 2.0203 2.0503 2.0503 2.4512 2.4512 3.4022 3.4022 3.4697 3.4697 4.2222 4.2222 4.3678 4.3678 5.7497 5.7497 5.8695 5.8695 5.8807 5.8807 6.7228 6.7228 k = 0.0000 0.0000 0.0239 ( 6295 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8646 -7.8646 -7.5990 -7.5987 -6.9167 -6.9166 -6.1158 -6.1158 -6.0439 -6.0439 1.1169 1.1188 2.0181 2.0206 2.0484 2.0505 2.4491 2.4535 3.4001 3.4010 3.4676 3.4684 4.2225 4.2242 4.3658 4.3701 5.7446 5.7505 5.8635 5.8675 5.8773 5.8808 6.7305 6.7314 k = 0.0000 0.0000 0.0478 ( 6287 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3661 -22.3661 -7.8642 -7.8642 -7.5981 -7.5976 -6.9171 -6.9168 -6.1161 -6.1161 -6.0445 -6.0445 1.1186 1.1226 2.0141 2.0181 2.0455 2.0487 2.4471 2.4560 3.3946 3.3961 3.4623 3.4643 4.2250 4.2284 4.3642 4.3727 5.7354 5.7468 5.8507 5.8569 5.8701 5.8784 6.7538 6.7556 k = 0.0000 0.0000 0.0717 ( 6283 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3660 -22.3660 -7.8634 -7.8634 -7.5966 -7.5959 -6.9177 -6.9173 -6.1166 -6.1165 -6.0456 -6.0455 1.1221 1.1282 2.0083 2.0119 2.0428 2.0453 2.4453 2.4587 3.3848 3.3864 3.4548 3.4586 4.2295 4.2344 4.3629 4.3757 5.7221 5.7380 5.8320 5.8392 5.8603 5.8734 6.7915 6.7938 k = 0.0000 0.0000 0.0955 ( 6279 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3659 -22.3659 -7.8623 -7.8623 -7.5944 -7.5935 -6.9185 -6.9180 -6.1173 -6.1173 -6.0470 -6.0469 1.1273 1.1356 2.0003 2.0013 2.0406 2.0409 2.4437 2.4615 3.3697 3.3711 3.4466 3.4526 4.2354 4.2419 4.3621 4.3793 5.7052 5.7241 5.8086 5.8162 5.8489 5.8659 6.8416 6.8443 k = 0.0000 0.0000 0.1194 ( 6279 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3657 -22.3657 -7.8609 -7.8609 -7.5916 -7.5905 -6.9195 -6.9189 -6.1182 -6.1182 -6.0488 -6.0487 1.1340 1.1447 1.9867 1.9897 2.0353 2.0395 2.4423 2.4646 3.3488 3.3497 3.4388 3.4474 4.2423 4.2503 4.3620 4.3834 5.6847 5.7053 5.7815 5.7893 5.8368 5.8564 6.9021 6.9049 k = 0.0000 0.0000 0.1433 ( 6275 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8282 -42.6775 -42.6774 -22.3654 -22.3654 -7.8591 -7.8591 -7.5882 -7.5868 -6.9207 -6.9200 -6.1193 -6.1193 -6.0510 -6.0509 1.1422 1.1555 1.9687 1.9764 2.0297 2.0382 2.4410 2.4678 3.3221 3.3228 3.4318 3.4429 4.2497 4.2589 4.3629 4.3884 5.6613 5.6823 5.7514 5.7597 5.8244 5.8451 6.9711 6.9740 k = 0.0000 0.0000 0.1672 ( 6271 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3651 -22.3651 -7.8571 -7.8570 -7.5842 -7.5826 -6.9222 -6.9213 -6.1206 -6.1206 -6.0535 -6.0534 1.1517 1.1678 1.9478 1.9604 2.0242 2.0369 2.4400 2.4713 3.2905 3.2911 3.4255 3.4389 4.2569 4.2670 4.3651 4.3943 5.6353 5.6564 5.7187 5.7282 5.8117 5.8325 7.0471 7.0499 k = 0.0000 0.0000 0.1911 ( 6271 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3648 -22.3648 -7.8546 -7.8546 -7.5796 -7.5778 -6.9238 -6.9229 -6.1222 -6.1222 -6.0563 -6.0562 1.1622 1.1816 1.9243 1.9420 2.0186 2.0353 2.4392 2.4750 3.2547 3.2556 3.4195 3.4351 4.2636 4.2737 4.3691 4.4012 5.6074 5.6289 5.6835 5.6956 5.7988 5.8186 7.1289 7.1315 k = 0.0000 0.0000 0.2150 ( 6273 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3644 -22.3644 -7.8518 -7.8518 -7.5745 -7.5724 -6.9257 -6.9247 -6.1241 -6.1240 -6.0594 -6.0593 1.1735 1.1965 1.8986 1.9218 2.0131 2.0334 2.4388 2.4790 3.2155 3.2169 3.4137 3.4315 4.2693 4.2787 4.3751 4.4093 5.5777 5.6007 5.6462 5.6626 5.7853 5.8037 7.2153 7.2178 k = 0.0000 0.0000 0.2389 ( 6285 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3640 -22.3640 -7.8487 -7.8486 -7.5688 -7.5665 -6.9279 -6.9267 -6.1261 -6.1261 -6.0628 -6.0627 1.1852 1.2124 1.8712 1.9002 2.0074 2.0311 2.4385 2.4832 3.1735 3.1755 3.4079 3.4277 4.2738 4.2815 4.3831 4.4185 5.5463 5.5726 5.6070 5.6297 5.7711 5.7878 7.3055 7.3077 k = 0.0000 0.0000 0.2627 ( 6273 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3635 -22.3635 -7.8451 -7.8451 -7.5626 -7.5601 -6.9302 -6.9290 -6.1285 -6.1285 -6.0663 -6.0663 1.1970 1.2290 1.8424 1.8779 2.0016 2.0285 2.4387 2.4877 3.1293 3.1322 3.4020 3.4238 4.2772 4.2825 4.3928 4.4286 5.5132 5.5447 5.5666 5.5980 5.7562 5.7711 7.3986 7.4005 k = 0.0000 0.0000 0.2866 ( 6269 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3630 -22.3630 -7.8412 -7.8411 -7.5560 -7.5533 -6.9329 -6.9315 -6.1311 -6.1311 -6.0701 -6.0700 1.2084 1.2459 1.8128 1.8555 1.9957 2.0256 2.4391 2.4924 3.0833 3.0873 3.3961 3.4198 4.2793 4.2818 4.4039 4.4395 5.4781 5.5153 5.5273 5.5678 5.7404 5.7534 7.4938 7.4956 k = 0.0000 0.0000 0.3105 ( 6265 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3625 -22.3625 -7.8368 -7.8367 -7.5489 -7.5460 -6.9357 -6.9343 -6.1340 -6.1340 -6.0740 -6.0740 1.2188 1.2626 1.7830 1.8339 1.9895 2.0222 2.4399 2.4974 3.0361 3.0413 3.3899 3.4156 4.2797 4.2803 4.4158 4.4509 5.4411 5.4770 5.4971 5.5398 5.7237 5.7349 7.5906 7.5921 k = 0.0000 0.0000 0.3344 ( 6265 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8283 -42.6775 -42.6774 -22.3620 -22.3620 -7.8320 -7.8319 -7.5414 -7.5383 -6.9388 -6.9373 -6.1372 -6.1371 -6.0780 -6.0780 1.2276 1.2786 1.7538 1.8137 1.9832 2.0184 2.4411 2.5026 2.9880 2.9945 3.3836 3.4112 4.2767 4.2803 4.4282 4.4626 5.4024 5.4337 5.4722 5.5138 5.7060 5.7154 7.6882 7.6895 k = 0.0000 0.0000 0.3583 ( 6265 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3614 -22.3614 -7.8267 -7.8267 -7.5336 -7.5303 -6.9421 -6.9406 -6.1407 -6.1406 -6.0821 -6.0821 1.2339 1.2928 1.7260 1.7959 1.9766 2.0143 2.4427 2.5081 2.9393 2.9473 3.3772 3.4066 4.2728 4.2794 4.4408 4.4745 5.3623 5.3892 5.4493 5.4898 5.6873 5.6951 7.7859 7.7870 k = 0.0000 0.0000 0.3822 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3608 -22.3608 -7.8210 -7.8210 -7.5254 -7.5220 -6.9457 -6.9441 -6.1446 -6.1444 -6.0863 -6.0863 1.2372 1.3044 1.7008 1.7813 1.9698 2.0099 2.4446 2.5138 2.8904 2.9000 3.3705 3.4019 4.2684 4.2778 4.4534 4.4864 5.3212 5.3442 5.4276 5.4676 5.6677 5.6738 7.8831 7.8840 k = 0.0000 0.0000 0.4061 ( 6258 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3601 -22.3601 -7.8148 -7.8148 -7.5170 -7.5134 -6.9494 -6.9479 -6.1487 -6.1485 -6.0905 -6.0905 1.2368 1.3120 1.6796 1.7706 1.9627 2.0051 2.4470 2.5197 2.8417 2.8529 3.3637 3.3970 4.2634 4.2755 4.4660 4.4981 5.2796 5.2991 5.4070 5.4468 5.6470 5.6516 7.9791 7.9798 k = 0.0000 0.0000 0.4299 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3595 -22.3595 -7.8081 -7.8081 -7.5083 -7.5045 -6.9535 -6.9519 -6.1532 -6.1529 -6.0947 -6.0947 1.2321 1.3143 1.6637 1.7644 1.9555 2.0000 2.4497 2.5257 2.7934 2.8064 3.3568 3.3920 4.2581 4.2726 4.4783 4.5096 5.2376 5.2539 5.3874 5.4271 5.6253 5.6284 8.0732 8.0737 k = 0.0000 0.0000 0.4538 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0280 -42.8285 -42.8284 -42.6775 -42.6774 -22.3588 -22.3588 -7.8010 -7.8009 -7.4994 -7.4955 -6.9577 -6.9561 -6.1579 -6.1576 -6.0990 -6.0989 1.2231 1.3102 1.6541 1.7629 1.9482 1.9947 2.4527 2.5317 2.7462 2.7609 3.3497 3.3869 4.2524 4.2693 4.4904 4.5207 5.1955 5.2090 5.3685 5.4084 5.6025 5.6042 8.1646 8.1649 k = 0.0000 0.0000 0.4777 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3581 -22.3581 -7.7933 -7.7933 -7.4904 -7.4864 -6.9621 -6.9606 -6.1629 -6.1625 -6.1032 -6.1031 1.2098 1.2995 1.6510 1.7659 1.9407 1.9893 2.4560 2.5371 2.7006 2.7165 3.3424 3.3816 4.2465 4.2657 4.5022 4.5315 5.1536 5.1643 5.3503 5.3903 5.5786 5.5789 8.2526 8.2526 k = 0.0000 0.0000 0.5016 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3573 -22.3573 -7.7851 -7.7851 -7.4813 -7.4772 -6.9668 -6.9652 -6.1681 -6.1676 -6.1075 -6.1074 1.1928 1.2827 1.6539 1.7729 1.9333 1.9837 2.4594 2.5407 2.6582 2.6739 3.3351 3.3764 4.2404 4.2617 4.5136 4.5419 5.1121 5.1201 5.3324 5.3726 5.5526 5.5536 8.3362 8.3363 k = 0.0000 0.0000 0.5255 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3566 -22.3566 -7.7764 -7.7764 -7.4721 -7.4679 -6.9716 -6.9701 -6.1736 -6.1730 -6.1117 -6.1116 1.1726 1.2610 1.6615 1.7832 1.9258 1.9780 2.4625 2.5388 2.6230 2.6336 3.3276 3.3710 4.2342 4.2574 4.5247 4.5518 5.0709 5.0764 5.3149 5.3552 5.5251 5.5275 8.4146 8.4150 k = 0.0000 0.0000 0.5494 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3559 -22.3559 -7.7672 -7.7672 -7.4630 -7.4587 -6.9766 -6.9752 -6.1793 -6.1786 -6.1160 -6.1159 1.1499 1.2357 1.6722 1.7959 1.9186 1.9725 2.4645 2.5233 2.5967 2.6032 3.3200 3.3657 4.2279 4.2530 4.5355 4.5612 5.0304 5.0333 5.2973 5.3377 5.4964 5.5001 8.4872 8.4878 k = 0.0000 0.0000 0.5733 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3551 -22.3551 -7.7574 -7.7574 -7.4539 -7.4495 -6.9818 -6.9804 -6.1851 -6.1843 -6.1203 -6.1202 1.1255 1.2081 1.6846 1.8099 1.9120 1.9670 2.4638 2.4934 2.5652 2.6000 3.3124 3.3603 4.2217 4.2485 4.5459 4.5701 4.9905 4.9909 5.2797 5.3200 5.4664 5.4715 8.5532 8.5540 k = 0.0000 0.0000 0.5971 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3544 -22.3544 -7.7472 -7.7472 -7.4449 -7.4405 -6.9871 -6.9858 -6.1911 -6.1902 -6.1246 -6.1245 1.0998 1.1790 1.6975 1.8238 1.9066 1.9619 2.4568 2.4578 2.5428 2.6050 3.3046 3.3550 4.2155 4.2440 4.5558 4.5784 4.9493 4.9513 5.2618 5.3020 5.4352 5.4416 8.6120 8.6130 k = 0.0000 0.0000 0.6210 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3536 -22.3536 -7.7364 -7.7364 -7.4360 -7.4316 -6.9925 -6.9913 -6.1972 -6.1963 -6.1290 -6.1288 1.0736 1.1494 1.7100 1.8357 1.9036 1.9572 2.4214 2.4409 2.5324 2.6135 3.2968 3.3497 4.2094 4.2394 4.5654 4.5862 4.9085 4.9130 5.2435 5.2834 5.4027 5.4104 8.6629 8.6642 k = 0.0000 0.0000 0.6449 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3528 -22.3528 -7.7251 -7.7251 -7.4274 -7.4230 -6.9981 -6.9970 -6.2035 -6.2025 -6.1333 -6.1331 1.0471 1.1197 1.7212 1.8431 1.9050 1.9529 2.3863 2.4187 2.5317 2.6237 3.2888 3.3444 4.2034 4.2351 4.5746 4.5934 4.8686 4.8755 5.2247 5.2641 5.3688 5.3779 8.7058 8.7072 k = 0.0000 0.0000 0.6688 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3521 -22.3521 -7.7133 -7.7133 -7.4190 -7.4146 -7.0038 -7.0028 -6.2098 -6.2088 -6.1376 -6.1373 1.0208 1.0904 1.7304 1.8445 1.9114 1.9492 2.3533 2.3949 2.5363 2.6352 3.2808 3.3391 4.1978 4.2308 4.5834 4.5999 4.8297 4.8391 5.2052 5.2439 5.3336 5.3442 8.7403 8.7418 k = 0.0000 0.0000 0.6927 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3513 -22.3513 -7.7010 -7.7010 -7.4108 -7.4065 -7.0096 -7.0087 -6.2163 -6.2152 -6.1419 -6.1415 0.9951 1.0617 1.7375 1.8413 1.9212 1.9459 2.3231 2.3719 2.5438 2.6478 3.2728 3.3340 4.1924 4.2268 4.5917 4.6057 4.7917 4.8036 5.1850 5.2227 5.2972 5.3092 8.7666 8.7682 k = 0.0000 0.0000 0.7166 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3506 -22.3506 -7.6882 -7.6882 -7.4030 -7.3987 -7.0154 -7.0147 -6.2229 -6.2218 -6.1461 -6.1457 0.9700 1.0339 1.7421 1.8354 1.9316 1.9430 2.2961 2.3511 2.5532 2.6612 3.2646 3.3289 4.1873 4.2231 4.5995 4.6108 4.7549 4.7692 5.1641 5.2004 5.2597 5.2730 8.7849 8.7866 k = 0.0000 0.0000 0.7405 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3498 -22.3498 -7.6750 -7.6750 -7.3956 -7.3913 -7.0214 -7.0208 -6.2296 -6.2285 -6.1502 -6.1497 0.9459 1.0071 1.7442 1.8280 1.9401 1.9407 2.2728 2.3330 2.5641 2.6756 3.2564 3.3238 4.1826 4.2197 4.6067 4.6151 4.7192 4.7360 5.1424 5.1769 5.2213 5.2358 8.7955 8.7973 k = 0.0000 0.0000 0.7643 ( 6244 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8287 -42.6775 -42.6774 -22.3491 -22.3491 -7.6614 -7.6614 -7.3885 -7.3844 -7.0274 -7.0269 -6.2365 -6.2354 -6.1542 -6.1536 0.9228 0.9815 1.7442 1.8200 1.9370 1.9475 2.2538 2.3178 2.5760 2.6907 3.2480 3.3188 4.1785 4.2168 4.6132 4.6183 4.6847 4.7040 5.1201 5.1517 5.1825 5.1975 8.7991 8.8010 k = 0.0000 0.0000 0.7882 ( 6248 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8288 -42.6775 -42.6774 -22.3484 -22.3484 -7.6474 -7.6473 -7.3818 -7.3778 -7.0335 -7.0331 -6.2434 -6.2424 -6.1580 -6.1573 0.9009 0.9572 1.7423 1.8115 1.9335 1.9512 2.2391 2.3055 2.5890 2.7067 3.2395 3.3138 4.1748 4.2143 4.6188 4.6202 4.6517 4.6734 5.0971 5.1231 5.1452 5.1584 8.7963 8.7984 k = 0.0000 0.0000 0.8121 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8288 -42.6775 -42.6774 -22.3477 -22.3477 -7.6330 -7.6330 -7.3756 -7.3717 -7.0396 -7.0394 -6.2505 -6.2495 -6.1617 -6.1608 0.8802 0.9341 1.7389 1.8028 1.9294 1.9517 2.2287 2.2958 2.6029 2.7234 3.2309 3.3088 4.1717 4.2124 4.6149 4.6225 4.6259 4.6452 5.0736 5.0883 5.1126 5.1188 8.7880 8.7902 k = 0.0000 0.0000 0.8360 ( 6246 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3470 -22.3470 -7.6183 -7.6183 -7.3698 -7.3661 -7.0458 -7.0458 -6.2577 -6.2568 -6.1650 -6.1641 0.8608 0.9124 1.7344 1.7940 1.9247 1.9492 2.2224 2.2885 2.6177 2.7409 3.2222 3.3038 4.1692 4.2110 4.5870 4.6114 4.6229 4.6321 5.0483 5.0493 5.0795 5.0841 8.7751 8.7774 k = 0.0000 0.0000 0.8599 ( 6248 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3464 -22.3464 -7.6033 -7.6033 -7.3644 -7.3609 -7.0522 -7.0521 -6.2651 -6.2642 -6.1682 -6.1671 0.8428 0.8921 1.7292 1.7853 1.9193 1.9441 2.2192 2.2831 2.6333 2.7591 3.2132 3.2988 4.1674 4.2103 4.5578 4.5861 4.6208 4.6335 5.0063 5.0225 5.0425 5.0570 8.7586 8.7610 k = 0.0000 0.0000 0.8838 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8288 -42.6775 -42.6774 -22.3458 -22.3458 -7.5882 -7.5882 -7.3595 -7.3562 -7.0586 -7.0584 -6.2725 -6.2717 -6.1710 -6.1699 0.8262 0.8730 1.7237 1.7767 1.9135 1.9373 2.2185 2.2792 2.6497 2.7780 3.2040 3.2936 4.1663 4.2103 4.5298 4.5608 4.6172 4.6349 4.9634 4.9886 5.0130 5.0306 8.7394 8.7419 k = 0.0000 0.0000 0.9077 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3452 -22.3452 -7.5729 -7.5729 -7.3551 -7.3520 -7.0651 -7.0648 -6.2799 -6.2793 -6.1736 -6.1724 0.8109 0.8553 1.7181 1.7683 1.9074 1.9295 2.2194 2.2763 2.6669 2.7976 3.1946 3.2883 4.1660 4.2110 4.5033 4.5367 4.6117 4.6349 4.9205 4.9498 4.9896 5.0051 8.7184 8.7210 k = 0.0000 0.0000 0.9315 ( 6248 PWs) bands (ev): -74.4113 -74.4112 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3446 -22.3446 -7.5575 -7.5575 -7.3511 -7.3482 -7.0717 -7.0713 -6.2874 -6.2868 -6.1758 -6.1746 0.7969 0.8389 1.7126 1.7601 1.9013 1.9212 2.2211 2.2741 2.6848 2.8177 3.1848 3.2827 4.1664 4.2125 4.4783 4.5141 4.6042 4.6331 4.8779 4.9099 4.9690 4.9808 8.6964 8.6991 k = 0.0000 0.0000 0.9554 ( 6246 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3441 -22.3441 -7.5422 -7.5421 -7.3475 -7.3449 -7.0783 -7.0778 -6.2948 -6.2943 -6.1778 -6.1765 0.7842 0.8237 1.7075 1.7523 1.8953 1.9131 2.2232 2.2721 2.7033 2.8384 3.1747 3.2768 4.1678 4.2148 4.4548 4.4928 4.5945 4.6292 4.8359 4.8702 4.9506 4.9581 8.6741 8.6768 k = 0.0000 0.0000 0.9793 ( 6242 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3436 -22.3436 -7.5269 -7.5269 -7.3443 -7.3419 -7.0850 -7.0844 -6.3021 -6.3017 -6.1795 -6.1782 0.7729 0.8097 1.7029 1.7448 1.8896 1.9054 2.2253 2.2701 2.7225 2.8594 3.1643 3.2705 4.1700 4.2179 4.4331 4.4732 4.5826 4.6228 4.7950 4.8313 4.9343 4.9375 8.6521 8.6548 k = 0.0000 0.0000 1.0032 ( 6238 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3431 -22.3431 -7.5119 -7.5118 -7.3415 -7.3394 -7.0917 -7.0910 -6.3092 -6.3088 -6.1809 -6.1796 0.7627 0.7969 1.6989 1.7378 1.8843 1.8983 2.2271 2.2680 2.7421 2.8808 3.1534 3.2637 4.1731 4.2219 4.4131 4.4550 4.5687 4.6137 4.7555 4.7934 4.9195 4.9202 8.6308 8.6334 k = 0.0000 0.0000 1.0271 ( 6238 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0283 -42.8290 -42.8289 -42.6775 -42.6774 -22.3427 -22.3427 -7.4972 -7.4971 -7.3391 -7.3372 -7.0984 -7.0977 -6.3160 -6.3157 -6.1821 -6.1808 0.7538 0.7852 1.6955 1.7313 1.8795 1.8921 2.2285 2.2656 2.7623 2.9023 3.1422 3.2563 4.1771 4.2267 4.3949 4.4384 4.5531 4.6019 4.7179 4.7569 4.9042 4.9082 8.6106 8.6131 k = 0.0000 0.0000 1.0510 ( 6242 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6774 -22.3423 -22.3423 -7.4829 -7.4829 -7.3370 -7.3354 -7.1050 -7.1043 -6.3225 -6.3223 -6.1830 -6.1818 0.7460 0.7746 1.6928 1.7252 1.8753 1.8866 2.2295 2.2628 2.7828 2.9238 3.1307 3.2483 4.1821 4.2322 4.3785 4.4233 4.5363 4.5875 4.6825 4.7222 4.8917 4.8982 8.5918 8.5941 k = 0.0000 0.0000 1.0749 ( 6246 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6774 -22.3419 -22.3419 -7.4693 -7.4693 -7.3352 -7.3338 -7.1115 -7.1108 -6.3286 -6.3284 -6.1838 -6.1827 0.7394 0.7650 1.6907 1.7197 1.8717 1.8819 2.2301 2.2598 2.8036 2.9449 3.1190 3.2395 4.1880 4.2384 4.3640 4.4096 4.5188 4.5710 4.6499 4.6894 4.8820 4.8900 8.5745 8.5766 k = 0.0000 0.0000 1.0987 ( 6238 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3416 -22.3416 -7.4564 -7.4564 -7.3338 -7.3326 -7.1178 -7.1171 -6.3342 -6.3341 -6.1844 -6.1833 0.7339 0.7564 1.6893 1.7147 1.8689 1.8780 2.2303 2.2564 2.8245 2.9651 3.1075 3.2298 4.1948 4.2452 4.3514 4.3973 4.5014 4.5529 4.6205 4.6590 4.8746 4.8834 8.5590 8.5609 k = 0.0000 0.0000 1.1226 ( 6240 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3413 -22.3413 -7.4446 -7.4446 -7.3325 -7.3316 -7.1238 -7.1231 -6.3392 -6.3391 -6.1848 -6.1839 0.7294 0.7488 1.6883 1.7101 1.8667 1.8747 2.2304 2.2529 2.8456 2.9835 3.0968 3.2192 4.2025 4.2522 4.3407 4.3861 4.4848 4.5340 4.5947 4.6311 4.8693 4.8779 8.5453 8.5470 k = 0.0000 0.0000 1.1465 ( 6250 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3411 -22.3411 -7.4340 -7.4339 -7.3315 -7.3308 -7.1293 -7.1287 -6.3436 -6.3435 -6.1851 -6.1843 0.7259 0.7422 1.6879 1.7061 1.8651 1.8720 2.2304 2.2493 2.8665 2.9983 3.0888 3.2076 4.2110 4.2590 4.3321 4.3759 4.4698 4.5150 4.5728 4.6060 4.8656 4.8736 8.5337 8.5351 k = 0.0000 0.0000 1.1704 ( 6250 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3409 -22.3409 -7.4248 -7.4248 -7.3308 -7.3302 -7.1341 -7.1336 -6.3472 -6.3472 -6.1853 -6.1847 0.7233 0.7365 1.6880 1.7025 1.8641 1.8699 2.2305 2.2457 2.8873 3.0062 3.0863 3.1949 4.2201 4.2648 4.3259 4.3664 4.4572 4.4968 4.5552 4.5840 4.8632 4.8701 8.5241 8.5252 k = 0.0000 0.0000 1.1943 ( 6266 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3407 -22.3407 -7.4173 -7.4173 -7.3302 -7.3298 -7.1382 -7.1378 -6.3502 -6.3501 -6.1854 -6.1849 0.7218 0.7317 1.6885 1.6993 1.8636 1.8681 2.2308 2.2423 2.9078 3.0047 3.0920 3.1812 4.2296 4.2682 4.3227 4.3575 4.4479 4.4801 4.5422 4.5653 4.8619 4.8673 8.5166 8.5175 k = 0.0000 0.0000 1.2182 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3406 -22.3406 -7.4117 -7.4117 -7.3298 -7.3295 -7.1412 -7.1409 -6.3523 -6.3523 -6.1855 -6.1851 0.7212 0.7278 1.6894 1.6966 1.8636 1.8666 2.2315 2.2392 2.9277 2.9954 3.1040 3.1666 4.2393 4.2681 4.3232 4.3489 4.4428 4.4656 4.5342 4.5504 4.8614 4.8651 8.5112 8.5118 k = 0.0000 0.0000 1.2421 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4083 -7.4083 -7.3295 -7.3294 -7.1431 -7.1429 -6.3535 -6.3535 -6.1855 -6.1853 0.7215 0.7248 1.6906 1.6942 1.8639 1.8655 2.2327 2.2366 2.9468 2.9815 3.1191 3.1512 4.2487 4.2641 4.3272 4.3408 4.4421 4.4540 4.5311 4.5395 4.8615 4.8634 8.5081 8.5084 k = 0.0000 0.0000 1.2659 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4071 -7.4071 -7.3294 -7.3294 -7.1436 -7.1436 -6.3540 -6.3540 -6.1854 -6.1854 0.7227 0.7227 1.6923 1.6923 1.8646 1.8646 2.2344 2.2344 2.9649 2.9649 3.1351 3.1351 4.2573 4.2573 4.3333 4.3333 4.4460 4.4460 4.5330 4.5330 4.8622 4.8622 8.5071 8.5071 k = 0.0000 0.0000 1.2659 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4071 -7.4071 -7.3294 -7.3294 -7.1436 -7.1436 -6.3540 -6.3540 -6.1854 -6.1854 0.7227 0.7227 1.6923 1.6923 1.8646 1.8646 2.2344 2.2344 2.9649 2.9649 3.1351 3.1351 4.2573 4.2573 4.3333 4.3333 4.4460 4.4460 4.5330 4.5330 4.8622 4.8622 8.5071 8.5071 k =-0.0092 0.0215 1.2659 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4080 -7.4078 -7.3298 -7.3298 -7.1431 -7.1430 -6.3536 -6.3536 -6.1855 -6.1853 0.7231 0.7241 1.6921 1.6930 1.8650 1.8654 2.2315 2.2370 2.9631 2.9645 3.1329 3.1355 4.2551 4.2594 4.3270 4.3364 4.4401 4.4591 4.5314 4.5370 4.8621 4.8629 8.5103 8.5105 k =-0.0185 0.0430 1.2659 ( 6284 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3406 -22.3406 -7.4102 -7.4099 -7.3312 -7.3311 -7.1413 -7.1411 -6.3524 -6.3524 -6.1855 -6.1850 0.7254 0.7274 1.6924 1.6944 1.8667 1.8676 2.2285 2.2394 2.9591 2.9618 3.1288 3.1341 4.2518 4.2620 4.3209 4.3336 4.4434 4.4767 4.5323 4.5434 4.8627 4.8642 8.5199 8.5203 k =-0.0277 0.0645 1.2659 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3407 -22.3407 -7.4138 -7.4134 -7.3334 -7.3334 -7.1384 -7.1380 -6.3504 -6.3504 -6.1854 -6.1848 0.7295 0.7325 1.6931 1.6963 1.8697 1.8712 2.2251 2.2416 2.9529 2.9569 3.1230 3.1310 4.2468 4.2657 4.3176 4.3257 4.4548 4.4964 4.5363 4.5521 4.8641 4.8661 8.5358 8.5364 k =-0.0370 0.0860 1.2659 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3409 -22.3409 -7.4187 -7.4181 -7.3366 -7.3365 -7.1344 -7.1340 -6.3477 -6.3477 -6.1852 -6.1844 0.7354 0.7394 1.6942 1.6987 1.8739 1.8763 2.2215 2.2436 2.9445 2.9498 3.1155 3.1264 4.2398 4.2704 4.3153 4.3181 4.4712 4.5162 4.5440 4.5631 4.8664 4.8687 8.5580 8.5587 k =-0.0462 0.1075 1.2659 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3411 -22.3411 -7.4246 -7.4239 -7.3406 -7.3405 -7.1295 -7.1291 -6.3443 -6.3443 -6.1849 -6.1839 0.7431 0.7481 1.6954 1.7016 1.8794 1.8829 2.2176 2.2454 2.9341 2.9406 3.1067 3.1205 4.2316 4.2759 4.3048 4.3222 4.4904 4.5334 4.5571 4.5762 4.8698 4.8722 8.5860 8.5870 k =-0.0462 0.1075 1.2659 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3411 -22.3411 -7.4246 -7.4239 -7.3406 -7.3405 -7.1295 -7.1291 -6.3443 -6.3443 -6.1849 -6.1839 0.7431 0.7481 1.6954 1.7016 1.8794 1.8829 2.2176 2.2454 2.9341 2.9406 3.1067 3.1205 4.2316 4.2759 4.3048 4.3222 4.4904 4.5334 4.5571 4.5762 4.8698 4.8722 8.5860 8.5870 k =-0.0529 0.1230 1.2490 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3412 -22.3412 -7.4299 -7.4292 -7.3441 -7.3440 -7.1253 -7.1248 -6.3412 -6.3412 -6.1846 -6.1835 0.7497 0.7559 1.6964 1.7043 1.8839 1.8890 2.2148 2.2467 2.9170 2.9402 3.0948 3.1207 4.2251 4.2802 4.2990 4.3275 4.5028 4.5478 4.5635 4.5952 4.8731 4.8756 8.6104 8.6114 k =-0.0596 0.1385 1.2321 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3414 -22.3414 -7.4367 -7.4358 -7.3481 -7.3478 -7.1202 -7.1196 -6.3374 -6.3373 -6.1842 -6.1829 0.7571 0.7651 1.6974 1.7074 1.8887 1.8962 2.2123 2.2482 2.8964 2.9393 3.0807 3.1234 4.2190 4.2819 4.2988 4.3347 4.5094 4.5648 4.5710 4.6235 4.8769 4.8800 8.6386 8.6398 k =-0.0662 0.1540 1.2152 ( 6255 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3417 -22.3417 -7.4447 -7.4437 -7.3526 -7.3521 -7.1144 -7.1138 -6.3328 -6.3328 -6.1837 -6.1823 0.7654 0.7754 1.6987 1.7110 1.8938 1.9042 2.2104 2.2499 2.8750 2.9353 3.0678 3.1258 4.2142 4.2792 4.3065 4.3437 4.5126 4.5655 4.6009 4.6551 4.8814 4.8855 8.6705 8.6719 k =-0.0729 0.1696 1.1984 ( 6261 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6774 -22.3420 -22.3420 -7.4539 -7.4527 -7.3576 -7.3568 -7.1080 -7.1074 -6.3276 -6.3275 -6.1831 -6.1816 0.7745 0.7865 1.7002 1.7150 1.8990 1.9129 2.2093 2.2518 2.8532 2.9277 3.0572 3.1276 4.2111 4.2759 4.3181 4.3543 4.5145 4.5661 4.6347 4.6884 4.8867 4.8920 8.7060 8.7075 k =-0.0796 0.1851 1.1815 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6774 -22.3423 -22.3423 -7.4640 -7.4625 -7.3629 -7.3619 -7.1012 -7.1005 -6.3218 -6.3217 -6.1825 -6.1809 0.7842 0.7982 1.7020 1.7194 1.9042 1.9219 2.2091 2.2538 2.8313 2.9167 3.0493 3.1290 4.2097 4.2738 4.3321 4.3665 4.5163 4.5672 4.6708 4.7225 4.8930 4.8997 8.7448 8.7464 k =-0.0862 0.2006 1.1646 ( 6266 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8289 -42.6775 -42.6774 -22.3427 -22.3427 -7.4749 -7.4731 -7.3686 -7.3673 -7.0940 -7.0933 -6.3154 -6.3153 -6.1818 -6.1800 0.7943 0.8103 1.7043 1.7244 1.9093 1.9311 2.2100 2.2561 2.8096 2.9030 3.0440 3.1301 4.2100 4.2730 4.3483 4.3804 4.5185 4.5687 4.7081 4.7562 4.9003 4.9093 8.7865 8.7882 k =-0.0929 0.2161 1.1477 ( 6257 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3430 -22.3430 -7.4864 -7.4843 -7.3747 -7.3730 -7.0867 -7.0858 -6.3086 -6.3084 -6.1809 -6.1791 0.8047 0.8225 1.7071 1.7300 1.9142 1.9400 2.2120 2.2586 2.7885 2.8876 3.0408 3.1310 4.2118 4.2736 4.3666 4.3960 4.5216 4.5709 4.7457 4.7885 4.9091 4.9215 8.8307 8.8325 k =-0.0996 0.2317 1.1308 ( 6263 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3435 -22.3435 -7.4985 -7.4960 -7.3810 -7.3790 -7.0791 -7.0782 -6.3013 -6.3011 -6.1800 -6.1780 0.8150 0.8345 1.7105 1.7362 1.9188 1.9485 2.2150 2.2612 2.7683 2.8715 3.0392 3.1317 4.2148 4.2754 4.3867 4.4130 4.5259 4.5738 4.7824 4.8178 4.9199 4.9375 8.8768 8.8786 k =-0.1063 0.2472 1.1139 ( 6273 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3439 -22.3439 -7.5109 -7.5081 -7.3876 -7.3852 -7.0715 -7.0706 -6.2936 -6.2934 -6.1790 -6.1769 0.8251 0.8461 1.7147 1.7432 1.9229 1.9563 2.2190 2.2639 2.7492 2.8556 3.0388 3.1326 4.2188 4.2782 4.4087 4.4312 4.5320 4.5778 4.8167 4.8425 4.9336 4.9585 8.9238 8.9255 k =-0.1129 0.2627 1.0970 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3444 -22.3444 -7.5236 -7.5205 -7.3944 -7.3916 -7.0638 -7.0629 -6.2857 -6.2853 -6.1779 -6.1756 0.8348 0.8570 1.7196 1.7509 1.9267 1.9633 2.2236 2.2667 2.7318 2.8409 3.0393 3.1336 4.2236 4.2819 4.4324 4.4503 4.5406 4.5831 4.8465 4.8623 4.9519 4.9848 8.9700 8.9717 k =-0.1196 0.2782 1.0801 ( 6258 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3448 -22.3448 -7.5365 -7.5330 -7.4014 -7.3982 -7.0562 -7.0552 -6.2775 -6.2771 -6.1767 -6.1742 0.8438 0.8670 1.7253 1.7596 1.9302 1.9693 2.2282 2.2695 2.7162 2.8278 3.0407 3.1348 4.2289 4.2861 4.4571 4.4699 4.5527 4.5902 4.8698 4.8782 4.9762 5.0154 9.0125 9.0146 k =-0.1263 0.2938 1.0632 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3453 -22.3453 -7.5494 -7.5456 -7.4085 -7.4048 -7.0487 -7.0477 -6.2691 -6.2687 -6.1754 -6.1728 0.8520 0.8759 1.7319 1.7690 1.9334 1.9745 2.2321 2.2724 2.7030 2.8169 3.0428 3.1364 4.2345 4.2905 4.4811 4.4901 4.5691 4.5996 4.8861 4.8919 5.0062 5.0485 9.0462 9.0496 k =-0.1330 0.3093 1.0463 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8288 -42.6775 -42.6774 -22.3459 -22.3459 -7.5624 -7.5582 -7.4156 -7.4116 -7.0413 -7.0402 -6.2607 -6.2602 -6.1740 -6.1711 0.8592 0.8835 1.7393 1.7792 1.9365 1.9789 2.2347 2.2752 2.6924 2.8085 3.0457 3.1383 4.2402 4.2950 4.5011 4.5133 4.5906 4.6123 4.8977 4.9037 5.0399 5.0830 9.0634 9.0686 k =-0.1396 0.3248 1.0294 ( 6253 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3464 -22.3464 -7.5752 -7.5707 -7.4228 -7.4183 -7.0341 -7.0330 -6.2523 -6.2517 -6.1724 -6.1694 0.8653 0.8897 1.7473 1.7901 1.9398 1.9827 2.2356 2.2778 2.6848 2.8028 3.0494 3.1407 4.2459 4.2993 4.5180 4.5376 4.6169 4.6296 4.9070 4.9136 5.0756 5.1179 9.0565 9.0630 k =-0.1463 0.3403 1.0125 ( 6253 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3469 -22.3469 -7.5879 -7.5831 -7.4300 -7.4251 -7.0271 -7.0259 -6.2441 -6.2434 -6.1706 -6.1675 0.8702 0.8944 1.7558 1.8016 1.9433 1.9861 2.2346 2.2796 2.6804 2.7998 3.0540 3.1436 4.2513 4.3031 4.5338 4.5602 4.6476 4.6525 4.9151 4.9219 5.1118 5.1525 9.0248 9.0316 k =-0.1530 0.3558 0.9956 ( 6259 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3474 -22.3474 -7.6003 -7.5952 -7.4371 -7.4318 -7.0203 -7.0191 -6.2360 -6.2352 -6.1687 -6.1653 0.8739 0.8977 1.7644 1.8132 1.9473 1.9895 2.2319 2.2801 2.6792 2.7992 3.0596 3.1469 4.2564 4.3064 4.5498 4.5803 4.6813 4.6818 4.9224 4.9291 5.1477 5.1863 8.9749 8.9813 k =-0.1597 0.3714 0.9787 ( 6257 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3479 -22.3479 -7.6124 -7.6070 -7.4441 -7.4384 -7.0137 -7.0126 -6.2282 -6.2273 -6.1665 -6.1630 0.8765 0.8995 1.7729 1.8249 1.9520 1.9933 2.2279 2.2790 2.6813 2.8008 3.0661 3.1508 4.2610 4.3090 4.5666 4.5987 4.7154 4.7189 4.9291 4.9354 5.1829 5.2190 8.9142 8.9203 k =-0.1663 0.3869 0.9618 ( 6258 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8288 -42.6775 -42.6774 -22.3485 -22.3485 -7.6241 -7.6184 -7.4509 -7.4449 -7.0075 -7.0063 -6.2209 -6.2198 -6.1640 -6.1604 0.8779 0.8999 1.7810 1.8360 1.9574 1.9979 2.2230 2.2761 2.6864 2.8040 3.0736 3.1552 4.2652 4.3110 4.5842 4.6163 4.7534 4.7584 4.9351 4.9410 5.2170 5.2505 8.8480 8.8539 k =-0.1730 0.4024 0.9449 ( 6258 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8288 -42.6775 -42.6774 -22.3490 -22.3490 -7.6354 -7.6295 -7.4576 -7.4512 -7.0015 -7.0004 -6.2140 -6.2128 -6.1611 -6.1575 0.8782 0.8992 1.7883 1.8461 1.9637 2.0036 2.2174 2.2716 2.6940 2.8085 3.0821 3.1600 4.2688 4.3123 4.6029 4.6338 4.7941 4.8001 4.9405 4.9462 5.2498 5.2805 8.7793 8.7852 k =-0.1797 0.4179 0.9280 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3495 -22.3495 -7.6462 -7.6400 -7.4640 -7.4573 -6.9959 -6.9948 -6.2078 -6.2065 -6.1579 -6.1543 0.8777 0.8973 1.7947 1.8548 1.9710 2.0108 2.2117 2.2657 2.7036 2.8136 3.0917 3.1654 4.2719 4.3130 4.6226 4.6518 4.8365 4.8434 4.9452 4.9513 5.2810 5.3088 8.7099 8.7161 k =-0.1863 0.4335 0.9111 ( 6261 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3499 -22.3499 -7.6565 -7.6501 -7.4702 -7.4632 -6.9906 -6.9895 -6.2023 -6.2008 -6.1543 -6.1507 0.8763 0.8945 1.8001 1.8616 1.9793 2.0195 2.2060 2.2586 2.7146 2.8191 3.1021 3.1711 4.2745 4.3133 4.6432 4.6704 4.8790 4.8882 4.9492 4.9570 5.3106 5.3353 8.6412 8.6478 k =-0.1930 0.4490 0.8942 ( 6253 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3504 -22.3504 -7.6662 -7.6595 -7.4760 -7.4688 -6.9856 -6.9846 -6.1975 -6.1959 -6.1503 -6.1468 0.8742 0.8911 1.8044 1.8663 1.9886 2.0294 2.2007 2.2509 2.7266 2.8245 3.1133 3.1772 4.2766 4.3131 4.6645 4.6897 4.9176 4.9340 4.9524 4.9667 5.3384 5.3601 8.5739 8.5809 k =-0.1997 0.4645 0.8773 ( 6253 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3508 -22.3508 -7.6753 -7.6684 -7.4815 -7.4740 -6.9810 -6.9800 -6.1935 -6.1917 -6.1459 -6.1427 0.8717 0.8870 1.8077 1.8691 1.9986 2.0402 2.1960 2.2429 2.7389 2.8295 3.1251 3.1835 4.2782 4.3125 4.6863 4.7095 4.9413 4.9546 4.9806 4.9907 5.3644 5.3830 8.5087 8.5162 k =-0.2064 0.4800 0.8604 ( 6249 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3512 -22.3512 -7.6837 -7.6767 -7.4867 -7.4789 -6.9768 -6.9759 -6.1901 -6.1881 -6.1414 -6.1385 0.8688 0.8826 1.8101 1.8702 2.0089 2.0514 2.1922 2.2348 2.7513 2.8340 3.1372 3.1899 4.2794 4.3117 4.7083 4.7299 4.9490 4.9565 5.0268 5.0293 5.3885 5.4040 8.4461 8.4540 k =-0.2130 0.4955 0.8435 ( 6249 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3516 -22.3516 -7.6914 -7.6842 -7.4914 -7.4834 -6.9730 -6.9721 -6.1873 -6.1851 -6.1369 -6.1342 0.8657 0.8781 1.8119 1.8700 2.0191 2.0626 2.1893 2.2271 2.7633 2.8378 3.1494 3.1963 4.2803 4.3107 4.7303 4.7506 4.9511 4.9577 5.0700 5.0735 5.4108 5.4231 8.3865 8.3947 k =-0.2197 0.5111 0.8266 ( 6248 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3519 -22.3519 -7.6984 -7.6910 -7.4957 -7.4876 -6.9695 -6.9687 -6.1850 -6.1827 -6.1325 -6.1301 0.8626 0.8735 1.8131 1.8689 2.0287 2.0734 2.1875 2.2200 2.7747 2.8409 3.1614 3.2025 4.2808 4.3096 4.7521 4.7713 4.9509 4.9580 5.1112 5.1177 5.4311 5.4404 8.3304 8.3389 k =-0.2264 0.5266 0.8097 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3522 -22.3522 -7.7046 -7.6971 -7.4996 -7.4912 -6.9665 -6.9657 -6.1832 -6.1807 -6.1283 -6.1261 0.8595 0.8690 1.8139 1.8672 2.0373 2.0833 2.1867 2.2136 2.7854 2.8432 3.1729 3.2083 4.2812 4.3084 4.7733 4.7919 4.9491 4.9572 5.1501 5.1598 5.4493 5.4560 8.2784 8.2870 k =-0.2331 0.5421 0.7928 ( 6258 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3525 -22.3525 -7.7101 -7.7025 -7.5030 -7.4945 -6.9638 -6.9631 -6.1817 -6.1790 -6.1244 -6.1226 0.8567 0.8649 1.8143 1.8652 2.0446 2.0921 2.1869 2.2081 2.7951 2.8447 3.1836 3.2136 4.2813 4.3073 4.7939 4.8120 4.9461 4.9552 5.1858 5.1986 5.4653 5.4702 8.2310 8.2397 k =-0.2397 0.5576 0.7759 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3527 -22.3527 -7.7147 -7.7070 -7.5059 -7.4973 -6.9615 -6.9609 -6.1805 -6.1777 -6.1210 -6.1194 0.8542 0.8611 1.8146 1.8631 2.0506 2.0996 2.1879 2.2036 2.8039 2.8454 3.1935 3.2181 4.2814 4.3062 4.8134 4.8315 4.9419 4.9519 5.2175 5.2334 5.4784 5.4835 8.1890 8.1976 k =-0.2464 0.5732 0.7590 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3529 -22.3529 -7.7185 -7.7108 -7.5083 -7.4996 -6.9597 -6.9591 -6.1795 -6.1766 -6.1181 -6.1168 0.8520 0.8577 1.8147 1.8612 2.0553 2.1056 2.1892 2.2002 2.8117 2.8454 3.2021 3.2217 4.2814 4.3053 4.8318 4.8499 4.9365 4.9473 5.2444 5.2632 5.4889 5.4954 8.1531 8.1615 k =-0.2531 0.5887 0.7422 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3531 -22.3531 -7.7215 -7.7137 -7.5102 -7.5014 -6.9582 -6.9577 -6.1788 -6.1758 -6.1158 -6.1146 0.8504 0.8550 1.8147 1.8595 2.0587 2.1102 2.1908 2.1977 2.8184 2.8447 3.2094 3.2242 4.2814 4.3045 4.8487 4.8670 4.9299 4.9411 5.2658 5.2872 5.4971 5.5054 8.1242 8.1323 k =-0.2598 0.6042 0.7253 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3532 -22.3532 -7.7237 -7.7158 -7.5116 -7.5026 -6.9572 -6.9567 -6.1783 -6.1753 -6.1141 -6.1131 0.8492 0.8529 1.8147 1.8583 2.0610 2.1133 2.1922 2.1960 2.8240 2.8434 3.2153 3.2256 4.2813 4.3040 4.8636 4.8826 4.9225 4.9336 5.2814 5.3047 5.5031 5.5129 8.1029 8.1107 k =-0.2664 0.6197 0.7084 ( 6255 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3533 -22.3533 -7.7250 -7.7171 -7.5124 -7.5034 -6.9566 -6.9561 -6.1780 -6.1750 -6.1131 -6.1122 0.8485 0.8516 1.8146 1.8575 2.0624 2.1152 2.1934 2.1949 2.8280 2.8419 3.2195 3.2258 4.2813 4.3036 4.8757 4.8958 4.9156 4.9248 5.2908 5.3154 5.5069 5.5176 8.0899 8.0975 k =-0.2731 0.6352 0.6915 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3533 -22.3533 -7.7254 -7.7175 -7.5127 -7.5037 -6.9564 -6.9559 -6.1779 -6.1748 -6.1127 -6.1119 0.8483 0.8511 1.8147 1.8573 2.0628 2.1158 2.1937 2.1946 2.8296 2.8411 3.2212 3.2256 4.2813 4.3035 4.8812 4.9023 4.9139 4.9177 5.2940 5.3190 5.5082 5.5192 8.0855 8.0930 k =-0.2731 0.6352 0.6915 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3533 -22.3533 -7.7254 -7.7175 -7.5127 -7.5037 -6.9564 -6.9559 -6.1779 -6.1748 -6.1127 -6.1119 0.8483 0.8511 1.8147 1.8573 2.0628 2.1158 2.1937 2.1946 2.8296 2.8411 3.2212 3.2256 4.2813 4.3035 4.8812 4.9023 4.9139 4.9177 5.2940 5.3190 5.5082 5.5192 8.0855 8.0930 k =-0.2664 0.6198 0.6746 ( 6240 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3531 -22.3531 -7.7309 -7.7244 -7.4998 -7.4925 -6.9592 -6.9579 -6.1804 -6.1768 -6.1133 -6.1124 0.8416 0.8432 1.8146 1.8599 2.0593 2.1170 2.1890 2.1915 2.8324 2.8425 3.2201 3.2237 4.2811 4.2957 4.8828 4.9009 4.9139 4.9159 5.2997 5.3235 5.4940 5.5034 8.1047 8.1125 k =-0.2598 0.6043 0.6577 ( 6242 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7364 -7.7310 -7.4879 -7.4823 -6.9620 -6.9598 -6.1825 -6.1785 -6.1139 -6.1128 0.8379 0.8382 1.8152 1.8643 2.0545 2.1183 2.1830 2.1889 2.8343 2.8430 3.2194 3.2223 4.2817 4.2883 4.8735 4.8908 4.9209 4.9264 5.3057 5.3284 5.4818 5.4893 8.1268 8.1347 k =-0.2531 0.5888 0.6409 ( 6254 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7418 -7.7374 -7.4772 -7.4730 -6.9646 -6.9615 -6.1844 -6.1798 -6.1144 -6.1131 0.8364 0.8374 1.8163 1.8705 2.0484 2.1197 2.1767 2.1861 2.8350 2.8426 3.2193 3.2213 4.2814 4.2829 4.8632 4.8837 4.9285 4.9336 5.3121 5.3339 5.4720 5.4773 8.1514 8.1592 k =-0.2465 0.5733 0.6240 ( 6246 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7469 -7.7435 -7.4676 -7.4649 -6.9670 -6.9629 -6.1858 -6.1809 -6.1147 -6.1134 0.8375 0.8400 1.8177 1.8785 2.0407 2.1213 2.1703 2.1833 2.8347 2.8414 3.2198 3.2209 4.2751 4.2847 4.8551 4.8797 4.9335 4.9371 5.3189 5.3398 5.4650 5.4678 8.1778 8.1855 k =-0.2398 0.5578 0.6071 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3531 -22.3531 -7.7520 -7.7493 -7.4593 -7.4580 -6.9692 -6.9641 -6.1869 -6.1815 -6.1151 -6.1136 0.8417 0.8457 1.8191 1.8882 2.0313 2.1233 2.1640 2.1808 2.8331 2.8392 3.2207 3.2209 4.2695 4.2871 4.8496 4.8785 4.9350 4.9366 5.3264 5.3465 5.4611 5.4612 8.2055 8.2127 k =-0.2331 0.5423 0.5903 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3532 -22.3532 -7.7569 -7.7550 -7.4524 -7.4523 -6.9710 -6.9650 -6.1876 -6.1818 -6.1153 -6.1137 0.8488 0.8545 1.8199 1.8996 2.0201 2.1256 2.1584 2.1787 2.8305 2.8362 3.2215 3.2221 4.2648 4.2900 4.8469 4.8799 4.9321 4.9327 5.3344 5.3538 5.4578 5.4605 8.2338 8.2404 k =-0.2265 0.5268 0.5734 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3533 -22.3533 -7.7616 -7.7603 -7.4478 -7.4468 -6.9724 -6.9656 -6.1878 -6.1818 -6.1153 -6.1137 0.8589 0.8664 1.8196 1.9125 2.0073 2.1279 2.1543 2.1771 2.8269 2.8326 3.2226 3.2240 4.2611 4.2934 4.8471 4.8839 4.9237 4.9263 5.3433 5.3619 5.4577 5.4631 8.2619 8.2674 k =-0.2198 0.5113 0.5565 ( 6282 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3535 -22.3535 -7.7661 -7.7655 -7.4447 -7.4427 -6.9734 -6.9659 -6.1876 -6.1813 -6.1153 -6.1136 0.8718 0.8812 1.8178 1.9265 1.9929 2.1288 2.1538 2.1764 2.8225 2.8285 3.2242 3.2264 4.2584 4.2972 4.8499 4.8894 4.9121 4.9161 5.3529 5.3708 5.4607 5.4687 8.2887 8.2930 k =-0.2132 0.4958 0.5397 ( 6278 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3537 -22.3537 -7.7706 -7.7704 -7.4428 -7.4400 -6.9740 -6.9658 -6.1870 -6.1805 -6.1152 -6.1134 0.8873 0.8988 1.8137 1.9404 1.9780 2.1271 2.1584 2.1768 2.8174 2.8241 3.2264 3.2293 4.2569 4.3015 4.8552 4.8902 4.9022 4.9044 5.3636 5.3807 5.4667 5.4771 8.3133 8.3160 k =-0.2065 0.4803 0.5228 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3540 -22.3540 -7.7751 -7.7748 -7.4422 -7.4386 -6.9740 -6.9654 -6.1859 -6.1793 -6.1148 -6.1131 0.9055 0.9193 1.8071 1.9462 1.9703 2.1236 2.1680 2.1785 2.8119 2.8197 3.2292 3.2328 4.2566 4.3063 4.8625 4.8744 4.8858 4.9117 5.3752 5.3916 5.4754 5.4879 8.3343 8.3351 k =-0.1998 0.4648 0.5059 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3543 -22.3543 -7.7797 -7.7790 -7.4427 -7.4386 -6.9737 -6.9647 -6.1844 -6.1778 -6.1144 -6.1127 0.9259 0.9423 1.7978 1.9325 1.9808 2.1195 2.1812 2.1822 2.8063 2.8155 3.2325 3.2367 4.2573 4.3114 4.8535 4.8632 4.8753 4.9234 5.3879 5.4035 5.4864 5.5006 8.3489 8.3501 k =-0.1932 0.4493 0.4891 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3546 -22.3546 -7.7841 -7.7831 -7.4444 -7.4399 -6.9729 -6.9638 -6.1825 -6.1760 -6.1137 -6.1121 0.9486 0.9677 1.7856 1.9128 1.9958 2.1153 2.1876 2.1984 2.8008 2.8119 3.2364 3.2412 4.2592 4.3170 4.8302 4.8424 4.8857 4.9368 5.4017 5.4164 5.4993 5.5149 8.3559 8.3593 k =-0.1865 0.4338 0.4722 ( 6258 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3550 -22.3550 -7.7884 -7.7871 -7.4472 -7.4424 -6.9716 -6.9626 -6.1802 -6.1738 -6.1129 -6.1113 0.9731 0.9954 1.7709 1.8913 2.0104 2.1111 2.1959 2.2183 2.7958 2.8091 3.2408 3.2462 4.2620 4.3228 4.8050 4.8184 4.8991 4.9517 5.4166 5.4305 5.5136 5.5304 8.3548 8.3602 k =-0.1798 0.4183 0.4554 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3554 -22.3554 -7.7925 -7.7910 -7.4508 -7.4460 -6.9700 -6.9611 -6.1776 -6.1714 -6.1118 -6.1104 0.9993 1.0250 1.7539 1.8690 2.0235 2.1071 2.2072 2.2408 2.7915 2.8075 3.2458 3.2516 4.2657 4.3289 4.7785 4.7927 4.9142 4.9678 5.4325 5.4455 5.5291 5.5468 8.3445 8.3515 k =-0.1732 0.4028 0.4385 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3559 -22.3559 -7.7965 -7.7948 -7.4553 -7.4505 -6.9681 -6.9595 -6.1746 -6.1688 -6.1105 -6.1092 1.0267 1.0562 1.7352 1.8464 2.0344 2.1032 2.2216 2.2654 2.7886 2.8074 3.2513 3.2575 4.2701 4.3351 4.7509 4.7658 4.9309 4.9851 5.4494 5.4616 5.5455 5.5640 8.3241 8.3323 k =-0.1665 0.3873 0.4216 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3563 -22.3563 -7.8004 -7.7986 -7.4606 -7.4560 -6.9659 -6.9577 -6.1714 -6.1660 -6.1090 -6.1079 1.0549 1.0887 1.7153 1.8240 2.0428 2.0994 2.2390 2.2915 2.7873 2.8092 3.2573 3.2639 4.2752 4.3415 4.7226 4.7379 4.9491 5.0036 5.4672 5.4786 5.5626 5.5815 8.2936 8.3023 k =-0.1599 0.3719 0.4048 ( 6254 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3568 -22.3568 -7.8043 -7.8024 -7.4665 -7.4622 -6.9635 -6.9558 -6.1680 -6.1630 -6.1072 -6.1063 1.0833 1.1219 1.6949 1.8025 2.0489 2.0957 2.2586 2.3183 2.7883 2.8133 3.2638 3.2708 4.2809 4.3479 4.6937 4.7094 4.9687 5.0232 5.4857 5.4965 5.5800 5.5994 8.2535 8.2621 k =-0.1532 0.3564 0.3879 ( 6261 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3573 -22.3573 -7.8081 -7.8061 -7.4730 -7.4690 -6.9609 -6.9538 -6.1644 -6.1599 -6.1052 -6.1045 1.1115 1.1553 1.6749 1.7825 2.0531 2.0920 2.2797 2.3450 2.7921 2.8201 3.2708 3.2781 4.2869 4.3542 4.6645 4.6805 4.9898 5.0441 5.5048 5.5149 5.5977 5.6174 8.2046 8.2126 k =-0.1465 0.3409 0.3710 ( 6261 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3579 -22.3579 -7.8118 -7.8098 -7.4799 -7.4763 -6.9581 -6.9517 -6.1608 -6.1568 -6.1029 -6.1024 1.1385 1.1879 1.6561 1.7647 2.0556 2.0884 2.3013 2.3707 2.7995 2.8302 3.2782 3.2858 4.2931 4.3604 4.6352 4.6513 5.0123 5.0663 5.5243 5.5339 5.6156 5.6355 8.1481 8.1552 k =-0.1399 0.3254 0.3542 ( 6273 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3584 -22.3584 -7.8154 -7.8135 -7.4872 -7.4840 -6.9553 -6.9496 -6.1571 -6.1536 -6.1004 -6.1001 1.1637 1.2186 1.6398 1.7500 2.0570 2.0848 2.3224 2.3946 2.8111 2.8438 3.2860 3.2938 4.2994 4.3662 4.6059 4.6221 5.0365 5.0899 5.5440 5.5533 5.6335 5.6534 8.0853 8.0914 k =-0.1332 0.3099 0.3373 ( 6257 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0280 -42.8285 -42.8284 -42.6775 -42.6774 -22.3589 -22.3589 -7.8190 -7.8172 -7.4947 -7.4921 -6.9524 -6.9474 -6.1534 -6.1505 -6.0976 -6.0975 1.1859 1.2460 1.6275 1.7392 2.0574 2.0812 2.3423 2.4158 2.8275 2.8613 3.2942 3.3022 4.3058 4.3717 4.5769 4.5930 5.0624 5.1151 5.5639 5.5727 5.6513 5.6712 8.0174 8.0225 k =-0.1266 0.2944 0.3204 ( 6253 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3595 -22.3595 -7.8226 -7.8208 -7.5024 -7.5003 -6.9495 -6.9452 -6.1498 -6.1474 -6.0946 -6.0945 1.2044 1.2683 1.6210 1.7332 2.0572 2.0777 2.3605 2.4338 2.8490 2.8828 3.3028 3.3108 4.3120 4.3767 4.5483 4.5641 5.0902 5.1421 5.5835 5.5922 5.6690 5.6887 7.9457 7.9497 k =-0.1199 0.2789 0.3036 ( 6257 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3600 -22.3600 -7.8260 -7.8244 -7.5102 -7.5086 -6.9466 -6.9429 -6.1464 -6.1444 -6.0915 -6.0913 1.2183 1.2837 1.6220 1.7327 2.0564 2.0743 2.3765 2.4482 2.8755 2.9083 3.3116 3.3197 4.3179 4.3810 4.5200 4.5357 5.1199 5.1708 5.6029 5.6114 5.6864 5.7059 7.8711 7.8741 k =-0.1132 0.2634 0.2867 ( 6265 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3606 -22.3606 -7.8295 -7.8280 -7.5180 -7.5168 -6.9437 -6.9407 -6.1431 -6.1416 -6.0882 -6.0878 1.2271 1.2912 1.6314 1.7381 2.0553 2.0709 2.3901 2.4592 2.9066 2.9375 3.3207 3.3288 4.3234 4.3848 4.4925 4.5077 5.1516 5.2015 5.6218 5.6301 5.7036 5.7226 7.7944 7.7965 k =-0.1066 0.2479 0.2698 ( 6261 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3611 -22.3611 -7.8328 -7.8315 -7.5257 -7.5250 -6.9409 -6.9385 -6.1400 -6.1388 -6.0847 -6.0842 1.2309 1.2910 1.6490 1.7492 2.0539 2.0676 2.4015 2.4671 2.9418 2.9701 3.3301 3.3381 4.3285 4.3879 4.4657 4.4805 5.1855 5.2343 5.6401 5.6484 5.7204 5.7389 7.7163 7.7177 k =-0.0999 0.2324 0.2530 ( 6263 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3617 -22.3617 -7.8361 -7.8349 -7.5334 -7.5331 -6.9381 -6.9363 -6.1370 -6.1362 -6.0810 -6.0806 1.2300 1.2845 1.6733 1.7655 2.0523 2.0644 2.4107 2.4724 2.9801 3.0055 3.3396 3.3474 4.3331 4.3903 4.4399 4.4540 5.2215 5.2692 5.6576 5.6659 5.7368 5.7547 7.6373 7.6382 k =-0.0933 0.2169 0.2361 ( 6259 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8283 -42.6775 -42.6774 -22.3622 -22.3622 -7.8393 -7.8383 -7.5409 -7.5408 -6.9355 -6.9342 -6.1343 -6.1337 -6.0773 -6.0768 1.2253 1.2735 1.7023 1.7860 2.0507 2.0614 2.4181 2.4756 3.0207 3.0430 3.3492 3.3568 4.3370 4.3919 4.4152 4.4283 5.2597 5.3062 5.6742 5.6826 5.7528 5.7698 7.5580 7.5585 k =-0.0866 0.2014 0.2192 ( 6259 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3627 -22.3627 -7.8424 -7.8415 -7.5483 -7.5479 -6.9330 -6.9322 -6.1318 -6.1313 -6.0735 -6.0731 1.2176 1.2595 1.7343 1.8096 2.0490 2.0584 2.4238 2.4771 3.0627 3.0820 3.3590 3.3662 4.3399 4.3907 4.3940 4.4037 5.3001 5.3453 5.6900 5.6985 5.7682 5.7842 7.4786 7.4790 k =-0.0799 0.1859 0.2024 ( 6259 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3632 -22.3632 -7.8453 -7.8446 -7.5555 -7.5548 -6.9306 -6.9302 -6.1294 -6.1291 -6.0698 -6.0694 1.2078 1.2440 1.7677 1.8352 2.0473 2.0557 2.4283 2.4774 3.1052 3.1216 3.3688 3.3756 4.3408 4.3712 4.3801 4.3933 5.3424 5.3864 5.7047 5.7135 5.7829 5.7979 7.3997 7.3999 k =-0.0733 0.1704 0.1855 ( 6261 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3636 -22.3636 -7.8481 -7.8476 -7.5622 -7.5613 -6.9284 -6.9282 -6.1272 -6.1271 -6.0661 -6.0658 1.1968 1.2278 1.8015 1.8617 2.0458 2.0531 2.4317 2.4767 3.1476 3.1611 3.3785 3.3848 4.3352 4.3565 4.3593 4.3929 5.3866 5.4294 5.7185 5.7275 5.7969 5.8107 7.3214 7.3217 k =-0.0666 0.1549 0.1686 ( 6275 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3640 -22.3640 -7.8508 -7.8503 -7.5684 -7.5674 -6.9264 -6.9264 -6.1253 -6.1252 -6.0626 -6.0624 1.1851 1.2116 1.8347 1.8882 2.0443 2.0506 2.4343 2.4754 3.1889 3.1998 3.3883 3.3938 4.3202 4.3364 4.3554 4.3919 5.4322 5.4738 5.7313 5.7408 5.8100 5.8225 7.2442 7.2447 k =-0.0599 0.1394 0.1518 ( 6283 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3644 -22.3644 -7.8533 -7.8529 -7.5742 -7.5730 -6.9247 -6.9245 -6.1235 -6.1234 -6.0593 -6.0592 1.1734 1.1960 1.8667 1.9140 2.0430 2.0485 2.4364 2.4735 3.2285 3.2369 3.3980 3.4027 4.3030 4.3167 4.3558 4.3903 5.4789 5.5193 5.7433 5.7534 5.8222 5.8334 7.1685 7.1693 k =-0.0533 0.1240 0.1349 ( 6283 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3648 -22.3648 -7.8556 -7.8553 -7.5794 -7.5782 -6.9232 -6.9228 -6.1219 -6.1218 -6.0562 -6.0561 1.1622 1.1812 1.8968 1.9383 2.0420 2.0466 2.4381 2.4713 3.2655 3.2717 3.4077 3.4114 4.2865 4.2986 4.3568 4.3884 5.5260 5.5652 5.7546 5.7655 5.8335 5.8432 7.0948 7.0959 k =-0.0466 0.1085 0.1181 ( 6287 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3651 -22.3651 -7.8576 -7.8575 -7.5841 -7.5829 -6.9217 -6.9213 -6.1204 -6.1204 -6.0534 -6.0534 1.1517 1.1676 1.9246 1.9604 2.0413 2.0450 2.4396 2.4689 3.2994 3.3033 3.4175 3.4200 4.2714 4.2821 4.3579 4.3861 5.5724 5.6104 5.7657 5.7774 5.8437 5.8519 7.0238 7.0252 k =-0.0400 0.0930 0.1012 ( 6277 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3654 -22.3654 -7.8595 -7.8594 -7.5881 -7.5870 -6.9204 -6.9200 -6.1192 -6.1192 -6.0509 -6.0509 1.1422 1.1554 1.9496 1.9798 2.0412 2.0438 2.4410 2.4664 3.3291 3.3310 3.4274 3.4286 4.2582 4.2674 4.3591 4.3835 5.6168 5.6531 5.7774 5.7898 5.8528 5.8594 6.9563 6.9582 k =-0.0333 0.0775 0.0843 ( 6277 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3657 -22.3657 -7.8610 -7.8610 -7.5916 -7.5906 -6.9193 -6.9189 -6.1181 -6.1181 -6.0488 -6.0487 1.1340 1.1446 1.9713 1.9957 2.0418 2.0431 2.4424 2.4638 3.3540 3.3541 3.4373 3.4374 4.2468 4.2546 4.3602 4.3808 5.6571 5.6906 5.7913 5.8033 5.8607 5.8656 6.8937 6.8958 k =-0.0266 0.0620 0.0675 ( 6277 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3659 -22.3659 -7.8624 -7.8623 -7.5944 -7.5935 -6.9184 -6.9180 -6.1172 -6.1172 -6.0470 -6.0469 1.1273 1.1355 1.9893 2.0076 2.0431 2.0434 2.4438 2.4611 3.3723 3.3735 3.4462 3.4473 4.2374 4.2438 4.3614 4.3780 5.6910 5.7192 5.8092 5.8186 5.8675 5.8706 6.8376 6.8398 k =-0.0200 0.0465 0.0506 ( 6273 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3660 -22.3660 -7.8634 -7.8634 -7.5966 -7.5959 -6.9176 -6.9173 -6.1165 -6.1165 -6.0455 -6.0455 1.1221 1.1282 2.0032 2.0152 2.0440 2.0460 2.4454 2.4585 3.3857 3.3874 3.4549 3.4564 4.2303 4.2351 4.3627 4.3752 5.7167 5.7374 5.8309 5.8357 5.8731 5.8743 6.7900 6.7921 k =-0.0133 0.0310 0.0337 ( 6285 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3661 -22.3661 -7.8642 -7.8642 -7.5981 -7.5976 -6.9171 -6.9168 -6.1160 -6.1160 -6.0445 -6.0445 1.1186 1.1226 2.0126 2.0192 2.0460 2.0488 2.4472 2.4560 3.3947 3.3963 3.4624 3.4637 4.2253 4.2285 4.3641 4.3725 5.7340 5.7469 5.8515 5.8523 5.8765 5.8778 6.7535 6.7551 k =-0.0067 0.0155 0.0169 ( 6293 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8646 -7.8646 -7.5990 -7.5987 -6.9167 -6.9166 -6.1158 -6.1158 -6.0439 -6.0439 1.1169 1.1188 2.0179 2.0207 2.0485 2.0504 2.4491 2.4535 3.4001 3.4010 3.4676 3.4684 4.2226 4.2242 4.3658 4.3701 5.7445 5.7506 5.8639 5.8663 5.8783 5.8808 6.7304 6.7313 k = 0.0000 0.0000 0.0000 ( 6303 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8648 -7.8648 -7.5992 -7.5992 -6.9165 -6.9165 -6.1157 -6.1157 -6.0437 -6.0437 1.1169 1.1169 2.0203 2.0203 2.0503 2.0503 2.4512 2.4512 3.4022 3.4022 3.4697 3.4697 4.2222 4.2222 4.3678 4.3678 5.7497 5.7497 5.8695 5.8695 5.8807 5.8807 6.7228 6.7228 k = 0.0000 0.0000 0.0000 ( 6303 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8648 -7.8648 -7.5992 -7.5992 -6.9165 -6.9165 -6.1157 -6.1157 -6.0437 -6.0437 1.1169 1.1169 2.0203 2.0203 2.0503 2.0503 2.4512 2.4512 3.4022 3.4022 3.4697 3.4697 4.2222 4.2222 4.3678 4.3678 5.7497 5.7497 5.8695 5.8695 5.8807 5.8807 6.7228 6.7228 k = 0.0217 0.0093-0.0000 ( 6291 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8652 -7.8652 -7.5986 -7.5986 -6.9166 -6.9166 -6.1157 -6.1157 -6.0437 -6.0437 1.1184 1.1184 2.0202 2.0202 2.0502 2.0503 2.4497 2.4497 3.4022 3.4022 3.4698 3.4698 4.2222 4.2222 4.3680 4.3681 5.7479 5.7479 5.8695 5.8696 5.8761 5.8761 6.7315 6.7315 k = 0.0435 0.0187-0.0000 ( 6291 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8663 -7.8663 -7.5971 -7.5971 -6.9170 -6.9170 -6.1157 -6.1157 -6.0439 -6.0439 1.1229 1.1229 2.0199 2.0200 2.0501 2.0502 2.4450 2.4450 3.4024 3.4024 3.4700 3.4700 4.2222 4.2222 4.3687 4.3688 5.7418 5.7418 5.8630 5.8631 5.8702 5.8702 6.7569 6.7569 k = 0.0652 0.0280-0.0000 ( 6283 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8682 -7.8682 -7.5945 -7.5945 -6.9176 -6.9176 -6.1157 -6.1157 -6.0441 -6.0441 1.1303 1.1303 2.0195 2.0196 2.0499 2.0501 2.4373 2.4373 3.4025 3.4025 3.4704 3.4704 4.2221 4.2222 4.3699 4.3700 5.7292 5.7292 5.8465 5.8465 5.8707 5.8707 6.7968 6.7968 k = 0.0870 0.0374-0.0000 ( 6296 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8707 -7.8707 -7.5911 -7.5911 -6.9184 -6.9184 -6.1157 -6.1157 -6.0445 -6.0445 1.1407 1.1407 2.0188 2.0191 2.0497 2.0499 2.4265 2.4266 3.4028 3.4028 3.4709 3.4709 4.2220 4.2222 4.3715 4.3717 5.7076 5.7076 5.8312 5.8312 5.8714 5.8715 6.8487 6.8487 k = 0.1087 0.0467-0.0000 ( 6304 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8738 -7.8738 -7.5868 -7.5868 -6.9194 -6.9194 -6.1157 -6.1157 -6.0450 -6.0450 1.1539 1.1539 2.0180 2.0183 2.0493 2.0497 2.4129 2.4129 3.4031 3.4031 3.4716 3.4716 4.2220 4.2221 4.3737 4.3738 5.6760 5.6760 5.8203 5.8203 5.8724 5.8724 6.9101 6.9101 k = 0.1304 0.0561-0.0000 ( 6300 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8774 -7.8774 -7.5819 -7.5819 -6.9205 -6.9205 -6.1157 -6.1157 -6.0455 -6.0455 1.1700 1.1700 2.0170 2.0173 2.0490 2.0494 2.3965 2.3965 3.4035 3.4035 3.4724 3.4724 4.2220 4.2222 4.3763 4.3765 5.6364 5.6364 5.8138 5.8139 5.8735 5.8736 6.9789 6.9789 k = 0.1522 0.0654-0.0000 ( 6280 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8813 -7.8813 -7.5764 -7.5764 -6.9219 -6.9219 -6.1157 -6.1157 -6.0461 -6.0461 1.1888 1.1888 2.0158 2.0162 2.0486 2.0491 2.3774 2.3774 3.4040 3.4040 3.4732 3.4732 4.2220 4.2222 4.3795 4.3797 5.5918 5.5918 5.8105 5.8106 5.8749 5.8750 7.0532 7.0532 k = 0.1739 0.0748-0.0000 ( 6288 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8855 -7.8855 -7.5704 -7.5704 -6.9234 -6.9234 -6.1157 -6.1157 -6.0468 -6.0468 1.2102 1.2102 2.0142 2.0147 2.0482 2.0487 2.3558 2.3558 3.4044 3.4044 3.4742 3.4742 4.2219 4.2221 4.3832 4.3834 5.5443 5.5443 5.8091 5.8092 5.8763 5.8764 7.1318 7.1318 k = 0.1957 0.0841-0.0000 ( 6288 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8898 -7.8898 -7.5642 -7.5642 -6.9251 -6.9251 -6.1157 -6.1157 -6.0475 -6.0475 1.2342 1.2342 2.0124 2.0129 2.0478 2.0484 2.3319 2.3320 3.4050 3.4050 3.4752 3.4752 4.2218 4.2221 4.3874 4.3876 5.4958 5.4958 5.8088 5.8090 5.8779 5.8780 7.2132 7.2132 k = 0.2174 0.0935-0.0000 ( 6288 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8942 -7.8942 -7.5578 -7.5578 -6.9268 -6.9268 -6.1157 -6.1157 -6.0482 -6.0482 1.2606 1.2606 2.0101 2.0107 2.0474 2.0480 2.3060 2.3061 3.4055 3.4055 3.4763 3.4763 4.2218 4.2220 4.3920 4.3923 5.4472 5.4472 5.8093 5.8095 5.8795 5.8796 7.2965 7.2965 k = 0.2391 0.1028-0.0000 ( 6280 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.8985 -7.8985 -7.5513 -7.5513 -6.9287 -6.9287 -6.1157 -6.1157 -6.0490 -6.0490 1.2893 1.2893 2.0072 2.0078 2.0470 2.0477 2.2784 2.2785 3.4060 3.4061 3.4774 3.4774 4.2217 4.2220 4.3972 4.3975 5.3993 5.3993 5.8103 5.8105 5.8812 5.8814 7.3804 7.3804 k = 0.2609 0.1122-0.0000 ( 6288 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9027 -7.9027 -7.5449 -7.5449 -6.9305 -6.9305 -6.1157 -6.1157 -6.0498 -6.0498 1.3201 1.3201 2.0036 2.0042 2.0466 2.0474 2.2494 2.2495 3.4066 3.4066 3.4786 3.4786 4.2217 4.2219 4.4028 4.4031 5.3527 5.3528 5.8116 5.8117 5.8829 5.8831 7.4638 7.4638 k = 0.2826 0.1215-0.0000 ( 6296 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9068 -7.9068 -7.5387 -7.5387 -6.9324 -6.9324 -6.1157 -6.1157 -6.0505 -6.0505 1.3529 1.3529 1.9988 1.9994 2.0462 2.0471 2.2195 2.2198 3.4071 3.4071 3.4797 3.4797 4.2216 4.2219 4.4089 4.4091 5.3081 5.3081 5.8130 5.8132 5.8846 5.8847 7.5453 7.5453 k = 0.3043 0.1308-0.0000 ( 6288 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9107 -7.9107 -7.5327 -7.5327 -6.9342 -6.9342 -6.1157 -6.1157 -6.0513 -6.0513 1.3876 1.3876 1.9923 1.9930 2.0459 2.0468 2.1896 2.1899 3.4077 3.4077 3.4808 3.4808 4.2216 4.2218 4.4153 4.4155 5.2657 5.2657 5.8146 5.8147 5.8863 5.8864 7.6232 7.6232 k = 0.3261 0.1402-0.0000 ( 6280 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9142 -7.9142 -7.5271 -7.5271 -6.9360 -6.9360 -6.1157 -6.1157 -6.0520 -6.0520 1.4239 1.4239 1.9833 1.9840 2.0457 2.0467 2.1606 2.1610 3.4082 3.4082 3.4818 3.4818 4.2216 4.2218 4.4219 4.4221 5.2261 5.2261 5.8162 5.8163 5.8879 5.8880 7.6953 7.6953 k = 0.3478 0.1495-0.0000 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9175 -7.9175 -7.5220 -7.5220 -6.9377 -6.9377 -6.1157 -6.1157 -6.0526 -6.0526 1.4617 1.4617 1.9707 1.9713 2.0456 2.0467 2.1339 2.1344 3.4087 3.4087 3.4828 3.4828 4.2216 4.2217 4.4286 4.4288 5.1896 5.1896 5.8177 5.8178 5.8894 5.8895 7.7592 7.7592 k = 0.3696 0.1589-0.0000 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9204 -7.9204 -7.5173 -7.5173 -6.9392 -6.9392 -6.1157 -6.1157 -6.0532 -6.0532 1.5007 1.5008 1.9532 1.9537 2.0456 2.0467 2.1109 2.1116 3.4091 3.4091 3.4836 3.4836 4.2215 4.2217 4.4352 4.4354 5.1568 5.1568 5.8191 5.8192 5.8907 5.8908 7.8125 7.8125 k = 0.3913 0.1682-0.0000 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9229 -7.9229 -7.5133 -7.5133 -6.9406 -6.9406 -6.1157 -6.1157 -6.0538 -6.0538 1.5408 1.5408 1.9300 1.9303 2.0458 2.0469 2.0927 2.0935 3.4095 3.4095 3.4844 3.4844 4.2216 4.2217 4.4415 4.4417 5.1279 5.1280 5.8204 5.8205 5.8919 5.8920 7.8536 7.8536 k = 0.4130 0.1776-0.0000 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9249 -7.9249 -7.5099 -7.5099 -6.9418 -6.9418 -6.1157 -6.1157 -6.0542 -6.0542 1.5816 1.5816 1.9012 1.9014 2.0461 2.0473 2.0793 2.0802 3.4098 3.4098 3.4851 3.4851 4.2216 4.2217 4.4472 4.4473 5.1036 5.1036 5.8215 5.8216 5.8930 5.8930 7.8824 7.8824 k = 0.4348 0.1869-0.0000 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9266 -7.9266 -7.5072 -7.5072 -6.9427 -6.9427 -6.1157 -6.1157 -6.0546 -6.0546 1.6228 1.6228 1.8679 1.8681 2.0467 2.0479 2.0699 2.0709 3.4100 3.4100 3.4856 3.4856 4.2216 4.2216 4.4520 4.4521 5.0840 5.0841 5.8224 5.8225 5.8938 5.8938 7.9011 7.9011 k = 0.4565 0.1963-0.0000 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9278 -7.9278 -7.5052 -7.5052 -6.9434 -6.9434 -6.1157 -6.1157 -6.0548 -6.0548 1.6640 1.6640 1.8317 1.8319 2.0475 2.0485 2.0637 2.0647 3.4102 3.4102 3.4859 3.4859 4.2216 4.2216 4.4557 4.4557 5.0698 5.0698 5.8231 5.8231 5.8944 5.8944 7.9121 7.9121 k = 0.4783 0.2056-0.0000 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9285 -7.9285 -7.5040 -7.5040 -6.9438 -6.9438 -6.1157 -6.1157 -6.0550 -6.0550 1.7038 1.7038 1.7946 1.7947 2.0484 2.0491 2.0601 2.0608 3.4103 3.4103 3.4862 3.4862 4.2216 4.2216 4.4580 4.4580 5.0611 5.0611 5.8235 5.8235 5.8947 5.8947 7.9178 7.9178 k = 0.5000 0.2150-0.0000 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9287 -7.9287 -7.5036 -7.5036 -6.9440 -6.9440 -6.1157 -6.1157 -6.0550 -6.0550 1.7302 1.7302 1.7691 1.7691 2.0491 2.0491 2.0591 2.0591 3.4103 3.4103 3.4862 3.4862 4.2216 4.2216 4.4588 4.4588 5.0581 5.0581 5.8236 5.8236 5.8948 5.8948 7.9196 7.9196 k = 0.5000 0.2150-0.0000 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9287 -7.9287 -7.5036 -7.5036 -6.9440 -6.9440 -6.1157 -6.1157 -6.0550 -6.0550 1.7302 1.7302 1.7691 1.7691 2.0491 2.0491 2.0591 2.0591 3.4103 3.4103 3.4862 3.4862 4.2216 4.2216 4.4588 4.4588 5.0581 5.0581 5.8236 5.8236 5.8948 5.8948 7.9196 7.9196 k = 0.4933 0.2305 0.0169 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9282 -7.9281 -7.5040 -7.5038 -6.9440 -6.9438 -6.1157 -6.1157 -6.0552 -6.0551 1.7268 1.7332 1.7620 1.7746 2.0448 2.0509 2.0545 2.0668 3.4066 3.4110 3.4834 3.4854 4.2220 4.2235 4.4561 4.4615 5.0580 5.0592 5.8209 5.8232 5.8920 5.8945 7.9228 7.9266 k = 0.4867 0.2460 0.0338 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3661 -22.3661 -7.9268 -7.9265 -7.5049 -7.5046 -6.9439 -6.9436 -6.1159 -6.1159 -6.0556 -6.0555 1.7223 1.7354 1.7534 1.7790 2.0409 2.0440 2.0593 2.0746 3.3997 3.4084 3.4771 3.4811 4.2247 4.2277 4.4536 4.4643 5.0586 5.0610 5.8147 5.8196 5.8866 5.8911 7.9360 7.9435 k = 0.4800 0.2615 0.0507 ( 6280 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3660 -22.3660 -7.9242 -7.9239 -7.5063 -7.5059 -6.9438 -6.9432 -6.1161 -6.1161 -6.0563 -6.0561 1.7163 1.7338 1.7466 1.7827 2.0368 2.0381 2.0647 2.0824 3.3892 3.4020 3.4681 3.4740 4.2296 4.2341 4.4511 4.4670 5.0601 5.0637 5.8043 5.8123 5.8795 5.8856 7.9579 7.9693 k = 0.4733 0.2770 0.0676 ( 6280 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3658 -22.3658 -7.9207 -7.9203 -7.5083 -7.5078 -6.9435 -6.9428 -6.1164 -6.1164 -6.0572 -6.0570 1.7079 1.7224 1.7476 1.7864 2.0308 2.0354 2.0704 2.0901 3.3749 3.3911 3.4575 3.4647 4.2367 4.2428 4.4487 4.4696 5.0624 5.0671 5.7892 5.8008 5.8721 5.8790 7.9868 8.0019 k = 0.4666 0.2926 0.0845 ( 6284 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3656 -22.3656 -7.9162 -7.9157 -7.5108 -7.5102 -6.9430 -6.9422 -6.1168 -6.1168 -6.0584 -6.0581 1.6965 1.7059 1.7517 1.7906 2.0254 2.0336 2.0762 2.0977 3.3562 3.3747 3.4467 3.4542 4.2459 4.2535 4.4462 4.4720 5.0655 5.0713 5.7693 5.7846 5.8651 5.8723 8.0203 8.0389 k = 0.4600 0.3081 0.1014 ( 6300 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3654 -22.3654 -7.9108 -7.9100 -7.5138 -7.5132 -6.9425 -6.9416 -6.1173 -6.1173 -6.0598 -6.0595 1.6819 1.6861 1.7568 1.7957 2.0208 2.0326 2.0822 2.1052 3.3332 3.3529 3.4364 3.4431 4.2570 4.2660 4.4437 4.4740 5.0694 5.0763 5.7451 5.7641 5.8586 5.8661 8.0559 8.0772 k = 0.4533 0.3236 0.1183 ( 6288 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3651 -22.3651 -7.9043 -7.9034 -7.5173 -7.5168 -6.9419 -6.9410 -6.1179 -6.1179 -6.0614 -6.0611 1.6636 1.6639 1.7627 1.8017 2.0172 2.0324 2.0883 2.1126 3.3062 3.3261 3.4266 3.4319 4.2701 4.2805 4.4409 4.4756 5.0742 5.0819 5.7177 5.7401 5.8524 5.8602 8.0910 8.1142 k = 0.4466 0.3391 0.1352 ( 6292 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3648 -22.3648 -7.8969 -7.8959 -7.5212 -7.5208 -6.9412 -6.9403 -6.1186 -6.1186 -6.0633 -6.0630 1.6385 1.6425 1.7691 1.8086 2.0145 2.0329 2.0944 2.1199 3.2755 3.2954 3.4171 3.4207 4.2847 4.2965 4.4379 4.4766 5.0796 5.0881 5.6878 5.7132 5.8463 5.8546 8.1242 8.1480 k = 0.4399 0.3547 0.1521 ( 6304 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3644 -22.3644 -7.8887 -7.8874 -7.5256 -7.5254 -6.9405 -6.9396 -6.1194 -6.1194 -6.0653 -6.0650 1.6109 1.6179 1.7760 1.8163 2.0128 2.0341 2.1006 2.1272 3.2421 3.2618 3.4077 3.4095 4.3008 4.3140 4.4346 4.4768 5.0856 5.0949 5.6563 5.6845 5.8401 5.8488 8.1547 8.1783 k = 0.4333 0.3702 0.1690 ( 6300 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3640 -22.3640 -7.8796 -7.8780 -7.5305 -7.5305 -6.9397 -6.9388 -6.1203 -6.1202 -6.0675 -6.0672 1.5811 1.5905 1.7833 1.8245 2.0119 2.0361 2.1070 2.1345 3.2065 3.2260 3.3982 3.3984 4.3182 4.3330 4.4310 4.4764 5.0924 5.1022 5.6238 5.6545 5.8336 5.8429 8.1826 8.2054 k = 0.4266 0.3857 0.1859 ( 6304 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3636 -22.3636 -7.8696 -7.8677 -7.5360 -7.5356 -6.9388 -6.9381 -6.1212 -6.1212 -6.0698 -6.0696 1.5492 1.5605 1.7907 1.8332 2.0119 2.0386 2.1133 2.1417 3.1695 3.1890 3.3873 3.3885 4.3366 4.3532 4.4272 4.4751 5.0997 5.1098 5.5909 5.6239 5.8267 5.8367 8.2080 8.2298 k = 0.4199 0.4012 0.2028 ( 6300 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3631 -22.3631 -7.8589 -7.8566 -7.5420 -7.5412 -6.9379 -6.9374 -6.1223 -6.1222 -6.0723 -6.0721 1.5156 1.5282 1.7981 1.8420 2.0126 2.0417 2.1197 2.1489 3.1319 3.1514 3.3763 3.3788 4.3554 4.3745 4.4237 4.4729 5.1074 5.1177 5.5578 5.5930 5.8194 5.8299 8.2310 8.2517 k = 0.4132 0.4168 0.2197 ( 6284 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3627 -22.3627 -7.8474 -7.8447 -7.5484 -7.5470 -6.9371 -6.9367 -6.1234 -6.1233 -6.0749 -6.0747 1.4804 1.4940 1.8055 1.8508 2.0139 2.0452 2.1261 2.1561 3.0942 3.1140 3.3654 3.3690 4.3733 4.3968 4.4216 4.4699 5.1156 5.1258 5.5249 5.5623 5.8115 5.8226 8.2513 8.2708 k = 0.4066 0.4323 0.2365 ( 6286 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8283 -42.6775 -42.6774 -22.3622 -22.3622 -7.8353 -7.8320 -7.5552 -7.5531 -6.9362 -6.9361 -6.1247 -6.1246 -6.0776 -6.0774 1.4439 1.4582 1.8126 1.8593 2.0159 2.0492 2.1324 2.1631 3.0571 3.0772 3.3546 3.3591 4.3861 4.4198 4.4249 4.4659 5.1240 5.1338 5.4924 5.5318 5.8030 5.8148 8.2683 8.2866 k = 0.3999 0.4478 0.2534 ( 6286 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3616 -22.3616 -7.8225 -7.8186 -7.5624 -7.5594 -6.9356 -6.9354 -6.1261 -6.1260 -6.0803 -6.0802 1.4063 1.4210 1.8192 1.8672 2.0184 2.0535 2.1388 2.1701 3.0212 3.0417 3.3440 3.3493 4.3891 4.4379 4.4438 4.4612 5.1325 5.1417 5.4604 5.5019 5.7940 5.8063 8.2809 8.2979 k = 0.3932 0.4633 0.2703 ( 6274 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3611 -22.3611 -7.8092 -7.8045 -7.5699 -7.5659 -6.9352 -6.9347 -6.1276 -6.1275 -6.0830 -6.0829 1.3681 1.3829 1.8252 1.8743 2.0215 2.0581 2.1450 2.1768 2.9869 3.0080 3.3337 3.3396 4.3857 4.4546 4.4586 4.4690 5.1409 5.1491 5.4291 5.4727 5.7842 5.7971 8.2874 8.3029 k = 0.3866 0.4788 0.2872 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3606 -22.3606 -7.7956 -7.7898 -7.5777 -7.5724 -6.9349 -6.9341 -6.1293 -6.1292 -6.0857 -6.0857 1.3294 1.3442 1.8305 1.8803 2.0249 2.0629 2.1512 2.1833 2.9549 2.9766 3.3236 3.3301 4.3796 4.4488 4.4811 4.4939 5.1492 5.1559 5.3984 5.4444 5.7738 5.7871 8.2862 8.2998 k = 0.3799 0.4944 0.3041 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3600 -22.3600 -7.7816 -7.7746 -7.5857 -7.5789 -6.9348 -6.9336 -6.1312 -6.1311 -6.0884 -6.0884 1.2905 1.3052 1.8349 1.8852 2.0288 2.0677 2.1572 2.1895 2.9255 2.9477 3.3138 3.3207 4.3725 4.4418 4.5053 4.5195 5.1568 5.1617 5.3687 5.4171 5.7626 5.7764 8.2761 8.2875 k = 0.3732 0.5099 0.3210 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3595 -22.3595 -7.7674 -7.7588 -7.5939 -7.5853 -6.9348 -6.9333 -6.1332 -6.1331 -6.0910 -6.0909 1.2517 1.2662 1.8384 1.8887 2.0328 2.0725 2.1629 2.1952 2.8990 2.9218 3.3043 3.3116 4.3648 4.4342 4.5302 4.5455 5.1636 5.1660 5.3401 5.3912 5.7507 5.7650 8.2573 8.2666 k = 0.3665 0.5254 0.3379 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0280 -42.8285 -42.8284 -42.6775 -42.6774 -22.3589 -22.3589 -7.7533 -7.7426 -7.6023 -7.5913 -6.9350 -6.9332 -6.1354 -6.1353 -6.0934 -6.0934 1.2133 1.2274 1.8408 1.8908 2.0371 2.0772 2.1684 2.2003 2.8758 2.8991 3.2952 3.3028 4.3567 4.4261 4.5557 4.5717 5.1683 5.1687 5.3131 5.3673 5.7380 5.7527 8.2320 8.2395 k = 0.3599 0.5409 0.3548 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3584 -22.3584 -7.7396 -7.7260 -7.6109 -7.5967 -6.9354 -6.9333 -6.1378 -6.1378 -6.0957 -6.0957 1.1755 1.1892 1.8423 1.8915 2.0414 2.0818 2.1736 2.2048 2.8560 2.8797 3.2866 3.2944 4.3485 4.4176 4.5815 4.5982 5.1676 5.1709 5.2890 5.3460 5.7247 5.7397 8.2031 8.2091 k = 0.3532 0.5565 0.3717 ( 6248 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3578 -22.3578 -7.7265 -7.7091 -7.6195 -7.6012 -6.9359 -6.9336 -6.1404 -6.1404 -6.0979 -6.0979 1.1387 1.1519 1.8426 1.8909 2.0457 2.0861 2.1784 2.2085 2.8398 2.8637 3.2783 3.2863 4.3404 4.4089 4.6075 4.6247 5.1631 5.1683 5.2696 5.3281 5.7105 5.7258 8.1731 8.1782 k = 0.3465 0.5720 0.3886 ( 6236 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3573 -22.3573 -7.7148 -7.6920 -7.6281 -7.6042 -6.9367 -6.9342 -6.1433 -6.1432 -6.0999 -6.0999 1.1031 1.1156 1.8420 1.8890 2.0498 2.0902 2.1828 2.2115 2.8270 2.8510 3.2706 3.2786 4.3324 4.3999 4.6336 4.6512 5.1539 5.1584 5.2573 5.3145 5.6957 5.7112 8.1442 8.1487 k = 0.3398 0.5875 0.4055 ( 6230 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3568 -22.3568 -7.7051 -7.6748 -7.6368 -7.6051 -6.9377 -6.9350 -6.1462 -6.1461 -6.1017 -6.1017 1.0689 1.0808 1.8405 1.8861 2.0536 2.0939 2.1867 2.2137 2.8177 2.8414 3.2633 3.2714 4.3247 4.3909 4.6596 4.6776 5.1398 5.1413 5.2521 5.3053 5.6801 5.6958 8.1177 8.1220 k = 0.3332 0.6030 0.4224 ( 6222 PWs) bands (ev): -74.4112 -74.4112 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3563 -22.3563 -7.6982 -7.6577 -7.6452 -7.6031 -6.9388 -6.9360 -6.1494 -6.1491 -6.1033 -6.1033 1.0363 1.0476 1.8383 1.8823 2.0570 2.0974 2.1902 2.2151 2.8115 2.8347 3.2566 3.2646 4.3174 4.3818 4.6855 4.7037 5.1190 5.1214 5.2520 5.3002 5.6639 5.6797 8.0946 8.0989 k = 0.3265 0.6185 0.4393 ( 6222 PWs) bands (ev): -74.4112 -74.4112 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3558 -22.3558 -7.6945 -7.6545 -7.6396 -7.5978 -6.9402 -6.9374 -6.1526 -6.1522 -6.1048 -6.1047 1.0056 1.0161 1.8354 1.8781 2.0601 2.1005 2.1930 2.2157 2.8081 2.8305 3.2504 3.2583 4.3106 4.3727 4.7111 4.7295 5.0940 5.0997 5.2545 5.2980 5.6472 5.6629 8.0756 8.0800 k = 0.3198 0.6341 0.4562 ( 6224 PWs) bands (ev): -74.4112 -74.4112 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3554 -22.3554 -7.6940 -7.6628 -7.6225 -7.5895 -6.9418 -6.9390 -6.1559 -6.1554 -6.1061 -6.1060 0.9770 0.9867 1.8322 1.8735 2.0626 2.1032 2.1953 2.2155 2.8070 2.8286 3.2448 3.2525 4.3043 4.3637 4.7363 4.7548 5.0680 5.0759 5.2584 5.2979 5.6298 5.6455 8.0611 8.0657 k = 0.3131 0.6496 0.4731 ( 6242 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3550 -22.3550 -7.6958 -7.6712 -7.6055 -7.5789 -6.9435 -6.9409 -6.1593 -6.1585 -6.1074 -6.1072 0.9507 0.9595 1.8287 1.8690 2.0647 2.1057 2.1969 2.2145 2.8079 2.8283 3.2397 3.2472 4.2987 4.3547 4.7610 4.7794 5.0419 5.0509 5.2630 5.2992 5.6121 5.6276 8.0511 8.0561 k = 0.3065 0.6651 0.4900 ( 6246 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3546 -22.3546 -7.6993 -7.6794 -7.5887 -7.5668 -6.9454 -6.9431 -6.1627 -6.1616 -6.1085 -6.1082 0.9268 0.9347 1.8253 1.8647 2.0662 2.1079 2.1979 2.2129 2.8104 2.8294 3.2352 3.2423 4.2938 4.3458 4.7849 4.8033 5.0163 5.0255 5.2678 5.3014 5.5941 5.6093 8.0459 8.0512 k = 0.2998 0.6806 0.5069 ( 6230 PWs) bands (ev): -74.4112 -74.4112 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3542 -22.3542 -7.7037 -7.6875 -7.5723 -7.5541 -6.9474 -6.9454 -6.1660 -6.1646 -6.1095 -6.1091 0.9054 0.9125 1.8221 1.8611 2.0670 2.1098 2.1983 2.2105 2.8138 2.8315 3.2313 3.2380 4.2898 4.3372 4.8079 4.8262 4.9920 5.0005 5.2729 5.3041 5.5761 5.5908 8.0453 8.0511 k = 0.2931 0.6962 0.5238 ( 6230 PWs) bands (ev): -74.4112 -74.4112 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3539 -22.3539 -7.7088 -7.6953 -7.5564 -7.5411 -6.9495 -6.9480 -6.1692 -6.1674 -6.1104 -6.1099 0.8868 0.8929 1.8193 1.8583 2.0672 2.1116 2.1981 2.2075 2.8179 2.8340 3.2279 3.2342 4.2865 4.3285 4.8297 4.8478 4.9692 4.9763 5.2780 5.3074 5.5582 5.5723 8.0492 8.0555 k = 0.2865 0.7117 0.5407 ( 6240 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3537 -22.3537 -7.7142 -7.7029 -7.5411 -7.5282 -6.9516 -6.9507 -6.1723 -6.1701 -6.1112 -6.1107 0.8710 0.8761 1.8170 1.8566 2.0666 2.1131 2.1972 2.2038 2.8221 2.8366 3.2251 3.2308 4.2839 4.3200 4.8499 4.8679 4.9483 4.9537 5.2832 5.3109 5.5407 5.5540 8.0574 8.0641 k = 0.2798 0.7272 0.5576 ( 6242 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3535 -22.3535 -7.7198 -7.7103 -7.5265 -7.5156 -6.9538 -6.9535 -6.1752 -6.1726 -6.1120 -6.1113 0.8582 0.8621 1.8155 1.8562 2.0652 2.1145 2.1958 2.1994 2.8261 2.8391 3.2229 3.2280 4.2822 4.3117 4.8678 4.8862 4.9298 4.9334 5.2885 5.3148 5.5239 5.5362 8.0696 8.0767 k = 0.2731 0.7427 0.5745 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3533 -22.3533 -7.7254 -7.7175 -7.5127 -7.5037 -6.9564 -6.9559 -6.1779 -6.1748 -6.1127 -6.1119 0.8483 0.8511 1.8147 1.8573 2.0628 2.1158 2.1937 2.1946 2.8296 2.8411 3.2212 3.2256 4.2813 4.3035 4.8812 4.9023 4.9139 4.9177 5.2940 5.3190 5.5082 5.5192 8.0855 8.0930 k = 0.2731 0.7427 0.5745 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3533 -22.3533 -7.7254 -7.7175 -7.5127 -7.5037 -6.9564 -6.9559 -6.1779 -6.1748 -6.1127 -6.1119 0.8483 0.8511 1.8147 1.8573 2.0628 2.1158 2.1937 2.1946 2.8296 2.8411 3.2212 3.2256 4.2813 4.3035 4.8812 4.9023 4.9139 4.9177 5.2940 5.3190 5.5082 5.5192 8.0855 8.0930 k = 0.2503 0.7382 0.5793 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3532 -22.3532 -7.7272 -7.7197 -7.5085 -7.5001 -6.9572 -6.9566 -6.1787 -6.1755 -6.1129 -6.1120 0.8462 0.8487 1.8139 1.8564 2.0628 2.1158 2.1935 2.1940 2.8304 2.8414 3.2208 3.2250 4.2810 4.3012 4.8835 4.9066 4.9100 4.9152 5.2952 5.3196 5.5037 5.5142 8.0921 8.0996 k = 0.2276 0.7338 0.5842 ( 6246 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3532 -22.3532 -7.7292 -7.7223 -7.5040 -7.4962 -6.9581 -6.9573 -6.1794 -6.1762 -6.1131 -6.1122 0.8447 0.8469 1.8120 1.8530 2.0644 2.1154 2.1945 2.1950 2.8309 2.8413 3.2205 3.2244 4.2808 4.2988 4.8850 4.9066 4.9109 4.9144 5.2955 5.3190 5.4990 5.5090 8.1014 8.1088 k = 0.2048 0.7293 0.5891 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3532 -22.3532 -7.7313 -7.7251 -7.4992 -7.4922 -6.9591 -6.9582 -6.1802 -6.1770 -6.1132 -6.1124 0.8437 0.8456 1.8090 1.8473 2.0673 2.1146 2.1966 2.1973 2.8312 2.8409 3.2202 3.2238 4.2805 4.2965 4.8858 4.9038 4.9150 4.9152 5.2950 5.3173 5.4942 5.5036 8.1126 8.1199 k = 0.1821 0.7248 0.5940 ( 6255 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3531 -22.3531 -7.7335 -7.7279 -7.4945 -7.4881 -6.9600 -6.9591 -6.1809 -6.1779 -6.1133 -6.1125 0.8431 0.8447 1.8051 1.8398 2.0711 2.1134 2.1995 2.2008 2.8312 2.8401 3.2200 3.2233 4.2801 4.2941 4.8861 4.9015 4.9171 4.9190 5.2938 5.3147 5.4895 5.4982 8.1251 8.1321 k = 0.1593 0.7203 0.5988 ( 6259 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3531 -22.3531 -7.7356 -7.7306 -7.4898 -7.4842 -6.9610 -6.9600 -6.1816 -6.1788 -6.1134 -6.1127 0.8429 0.8443 1.8007 1.8314 2.0755 2.1120 2.2030 2.2051 2.8310 2.8391 3.2199 3.2228 4.2798 4.2919 4.8864 4.8996 4.9198 4.9227 5.2921 5.3112 5.4849 5.4928 8.1382 8.1447 k = 0.1366 0.7159 0.6037 ( 6263 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3531 -22.3531 -7.7375 -7.7333 -7.4854 -7.4806 -6.9618 -6.9609 -6.1822 -6.1796 -6.1135 -6.1128 0.8430 0.8442 1.7962 1.8224 2.0799 2.1106 2.2071 2.2097 2.8307 2.8379 3.2198 3.2223 4.2795 4.2898 4.8867 4.8982 4.9227 4.9261 5.2901 5.3071 5.4808 5.4877 8.1510 8.1570 k = 0.1138 0.7114 0.6086 ( 6258 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3531 -22.3531 -7.7392 -7.7356 -7.4813 -7.4774 -6.9626 -6.9617 -6.1826 -6.1804 -6.1135 -6.1129 0.8433 0.8442 1.7919 1.8136 2.0842 2.1091 2.2114 2.2143 2.8305 2.8365 3.2197 3.2219 4.2794 4.2878 4.8872 4.8970 4.9257 4.9290 5.2882 5.3028 5.4771 5.4830 8.1630 8.1682 k = 0.0910 0.7069 0.6135 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7406 -7.7378 -7.4778 -7.4746 -6.9632 -6.9625 -6.1830 -6.1812 -6.1135 -6.1131 0.8437 0.8444 1.7881 1.8054 2.0881 2.1075 2.2155 2.2184 2.8302 2.8352 3.2197 3.2215 4.2793 4.2860 4.8880 4.8960 4.9285 4.9314 5.2865 5.2985 5.4739 5.4789 8.1736 8.1780 k = 0.0683 0.7024 0.6183 ( 6257 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7417 -7.7395 -7.4749 -7.4725 -6.9638 -6.9632 -6.1833 -6.1818 -6.1135 -6.1132 0.8441 0.8447 1.7853 1.7982 2.0917 2.1058 2.2193 2.2218 2.8301 2.8339 3.2198 3.2211 4.2794 4.2844 4.8889 4.8951 4.9310 4.9333 5.2852 5.2945 5.4716 5.4753 8.1824 8.1857 k = 0.0455 0.6979 0.6232 ( 6269 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7423 -7.7409 -7.4727 -7.4711 -6.9641 -6.9637 -6.1834 -6.1824 -6.1135 -6.1133 0.8445 0.8449 1.7837 1.7922 2.0948 2.1040 2.2224 2.2243 2.8301 2.8327 3.2199 3.2208 4.2797 4.2830 4.8900 4.8941 4.9329 4.9345 5.2846 5.2909 5.4699 5.4725 8.1890 8.1913 k = 0.0228 0.6935 0.6281 ( 6259 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7426 -7.7419 -7.4711 -7.4703 -6.9643 -6.9641 -6.1833 -6.1829 -6.1135 -6.1133 0.8448 0.8450 1.7835 1.7877 2.0975 2.1021 2.2246 2.2256 2.8304 2.8317 3.2200 3.2205 4.2802 4.2819 4.8911 4.8932 4.9343 4.9351 5.2849 5.2881 5.4692 5.4705 8.1933 8.1944 k = 0.0000 0.6890 0.6330 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7425 -7.7425 -7.4703 -7.4703 -6.9643 -6.9643 -6.1832 -6.1832 -6.1134 -6.1134 0.8450 0.8450 1.7848 1.7848 2.1000 2.1000 2.2257 2.2257 2.8309 2.8309 3.2202 3.2202 4.2809 4.2809 4.8921 4.8921 4.9350 4.9350 5.2860 5.2860 5.4694 5.4694 8.1951 8.1951 k = 0.0000 0.6890 0.6330 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7425 -7.7425 -7.4703 -7.4703 -6.9643 -6.9643 -6.1832 -6.1832 -6.1134 -6.1134 0.8450 0.8450 1.7848 1.7848 2.1000 2.1000 2.2257 2.2257 2.8309 2.8309 3.2202 3.2202 4.2809 4.2809 4.8921 4.8921 4.9350 4.9350 5.2860 5.2860 5.4694 5.4694 8.1951 8.1951 k = 0.0068 0.6733 0.6501 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3530 -22.3530 -7.7421 -7.7419 -7.4702 -7.4700 -6.9645 -6.9644 -6.1833 -6.1832 -6.1139 -6.1136 0.8444 0.8460 1.7834 1.7867 2.0952 2.1033 2.2231 2.2284 2.8263 2.8349 3.2171 3.2222 4.2802 4.2819 4.8850 4.8937 4.9321 4.9400 5.2816 5.2835 5.4679 5.4690 8.1991 8.2014 k = 0.0135 0.6576 0.6672 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6775 -22.3529 -22.3529 -7.7408 -7.7405 -7.4695 -7.4692 -6.9652 -6.9649 -6.1836 -6.1835 -6.1150 -6.1145 0.8443 0.8475 1.7825 1.7889 2.0891 2.1052 2.2207 2.2310 2.8210 2.8381 3.2128 3.2229 4.2796 4.2830 4.8742 4.8883 4.9327 4.9451 5.2704 5.2738 5.4645 5.4664 8.2132 8.2179 k = 0.0203 0.6418 0.6843 ( 6266 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3528 -22.3528 -7.7386 -7.7382 -7.4684 -7.4680 -6.9663 -6.9658 -6.1841 -6.1839 -6.1169 -6.1161 0.8446 0.8495 1.7819 1.7917 2.0817 2.1053 2.2188 2.2337 2.8149 2.8407 3.2072 3.2225 4.2793 4.2844 4.8609 4.8774 4.9354 4.9495 5.2528 5.2573 5.4596 5.4616 8.2371 8.2439 k = 0.0270 0.6261 0.7014 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3527 -22.3527 -7.7355 -7.7349 -7.4668 -7.4662 -6.9678 -6.9671 -6.1848 -6.1845 -6.1193 -6.1183 0.8453 0.8518 1.7817 1.7948 2.0732 2.1035 2.2176 2.2362 2.8080 2.8427 3.2006 3.2212 4.2791 4.2860 4.8455 4.8627 4.9386 4.9528 5.2296 5.2343 5.4532 5.4545 8.2700 8.2789 k = 0.0338 0.6104 0.7185 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8287 -42.8286 -42.6775 -42.6774 -22.3525 -22.3525 -7.7315 -7.7308 -7.4647 -7.4640 -6.9696 -6.9688 -6.1857 -6.1853 -6.1224 -6.1211 0.8464 0.8545 1.7817 1.7982 2.0634 2.0998 2.2172 2.2388 2.8003 2.8440 3.1929 3.2190 4.2791 4.2878 4.8282 4.8454 4.9414 4.9549 5.2012 5.2058 5.4451 5.4454 8.3111 8.3219 k = 0.0405 0.5947 0.7356 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3522 -22.3522 -7.7267 -7.7258 -7.4622 -7.4613 -6.9719 -6.9709 -6.1869 -6.1864 -6.1260 -6.1245 0.8477 0.8574 1.7821 1.8020 2.0525 2.0941 2.2179 2.2415 2.7918 2.8446 3.1843 3.2162 4.2791 4.2897 4.8093 4.8261 4.9434 4.9560 5.1686 5.1725 5.4338 5.4357 8.3593 8.3719 k = 0.0473 0.5790 0.7527 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3519 -22.3519 -7.7210 -7.7200 -7.4593 -7.4583 -6.9745 -6.9734 -6.1883 -6.1877 -6.1301 -6.1283 0.8493 0.8605 1.7826 1.8060 2.0405 2.0866 2.2194 2.2443 2.7826 2.8446 3.1751 3.2128 4.2792 4.2918 4.7890 4.8051 4.9445 4.9560 5.1325 5.1357 5.4202 5.4244 8.4137 8.4279 k = 0.0541 0.5633 0.7698 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3516 -22.3516 -7.7145 -7.7133 -7.4559 -7.4548 -6.9775 -6.9763 -6.1901 -6.1894 -6.1346 -6.1325 0.8509 0.8636 1.7832 1.8101 2.0276 2.0775 2.2218 2.2472 2.7726 2.8438 3.1655 3.2092 4.2793 4.2939 4.7674 4.7826 4.9443 4.9550 5.0938 5.0963 5.4045 5.4113 8.4733 8.4888 k = 0.0608 0.5475 0.7869 ( 6266 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3513 -22.3513 -7.7071 -7.7058 -7.4521 -7.4509 -6.9809 -6.9796 -6.1924 -6.1914 -6.1393 -6.1369 0.8524 0.8667 1.7838 1.8142 2.0139 2.0671 2.2249 2.2502 2.7620 2.8423 3.1557 3.2054 4.2793 4.2961 4.7448 4.7591 4.9426 4.9527 5.0534 5.0562 5.3867 5.3963 8.5373 8.5540 k = 0.0676 0.5318 0.8040 ( 6266 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3509 -22.3509 -7.6990 -7.6976 -7.4480 -7.4466 -6.9847 -6.9833 -6.1951 -6.1940 -6.1441 -6.1415 0.8539 0.8696 1.7842 1.8180 1.9996 2.0558 2.2285 2.2535 2.7510 2.8402 3.1460 3.2016 4.2793 4.2983 4.7214 4.7347 4.9380 4.9485 5.0128 5.0175 5.3667 5.3793 8.6046 8.6224 k = 0.0743 0.5161 0.8211 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3505 -22.3505 -7.6902 -7.6886 -7.4436 -7.4420 -6.9889 -6.9874 -6.1984 -6.1971 -6.1490 -6.1460 0.8550 0.8721 1.7845 1.8214 1.9852 2.0438 2.2322 2.2567 2.7398 2.8374 3.1366 3.1980 4.2791 4.3004 4.6975 4.7098 4.9267 4.9381 4.9773 4.9847 5.3446 5.3602 8.6748 8.6936 k = 0.0811 0.5004 0.8383 ( 6266 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3500 -22.3500 -7.6806 -7.6789 -7.4388 -7.4372 -6.9934 -6.9918 -6.2023 -6.2009 -6.1536 -6.1505 0.8557 0.8741 1.7844 1.8239 1.9710 2.0316 2.2361 2.2601 2.7286 2.8341 3.1279 3.1947 4.2786 4.3025 4.6732 4.6845 4.9021 4.9106 4.9584 4.9649 5.3204 5.3390 8.7469 8.7667 k = 0.0878 0.4847 0.8554 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3496 -22.3496 -7.6704 -7.6686 -7.4338 -7.4320 -6.9983 -6.9966 -6.2070 -6.2054 -6.1579 -6.1546 0.8559 0.8755 1.7838 1.8251 1.9577 2.0194 2.2397 2.2633 2.7179 2.8304 3.1199 3.1917 4.2777 4.3044 4.6486 4.6592 4.8672 4.8724 4.9505 4.9556 5.2941 5.3157 8.8203 8.8410 k = 0.0946 0.4690 0.8725 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8287 -42.6775 -42.6774 -22.3491 -22.3491 -7.6595 -7.6576 -7.4285 -7.4266 -7.0036 -7.0018 -6.2125 -6.2108 -6.1617 -6.1583 0.8554 0.8762 1.7828 1.8245 1.9459 2.0075 2.2428 2.2663 2.7080 2.8266 3.1129 3.1893 4.2765 4.3061 4.6240 4.6339 4.8295 4.8326 4.9450 4.9501 5.2656 5.2903 8.8940 8.9158 k = 0.1014 0.4532 0.8896 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8288 -42.6775 -42.6774 -22.3486 -22.3486 -7.6481 -7.6460 -7.4230 -7.4210 -7.0091 -7.0074 -6.2187 -6.2170 -6.1651 -6.1617 0.8542 0.8759 1.7812 1.8214 1.9362 1.9961 2.2454 2.2691 2.6994 2.8230 3.1069 3.1873 4.2748 4.3075 4.5995 4.6089 4.7921 4.7938 4.9400 4.9456 5.2351 5.2627 8.9668 8.9898 k = 0.1081 0.4375 0.9067 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3481 -22.3481 -7.6361 -7.6339 -7.4173 -7.4152 -7.0150 -7.0132 -6.2256 -6.2239 -6.1680 -6.1646 0.8521 0.8747 1.7789 1.8157 1.9291 1.9853 2.2470 2.2714 2.6926 2.8199 3.1019 3.1858 4.2725 4.3085 4.5752 4.5844 4.7561 4.7568 4.9349 4.9413 5.2026 5.2332 9.0371 9.0613 k = 0.1149 0.4218 0.9238 ( 6258 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3476 -22.3476 -7.6236 -7.6214 -7.4115 -7.4093 -7.0213 -7.0194 -6.2330 -6.2315 -6.1705 -6.1672 0.8490 0.8723 1.7761 1.8074 1.9245 1.9752 2.2477 2.2731 2.6879 2.8177 3.0980 3.1848 4.2696 4.3091 4.5513 4.5604 4.7214 4.7228 4.9298 4.9369 5.1681 5.2017 9.1026 9.1280 k = 0.1216 0.4061 0.9409 ( 6254 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3470 -22.3470 -7.6108 -7.6084 -7.4056 -7.4034 -7.0278 -7.0260 -6.2409 -6.2394 -6.1726 -6.1694 0.8449 0.8689 1.7726 1.7971 1.9220 1.9658 2.2472 2.2743 2.6857 2.8168 3.0951 3.1843 4.2660 4.3092 4.5278 4.5371 4.6889 4.6917 4.9246 4.9323 5.1319 5.1684 9.1599 9.1861 k = 0.1284 0.3904 0.9580 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3465 -22.3465 -7.5975 -7.5951 -7.3997 -7.3974 -7.0345 -7.0327 -6.2491 -6.2478 -6.1744 -6.1714 0.8399 0.8642 1.7683 1.7859 1.9208 1.9570 2.2457 2.2749 2.6864 2.8174 3.0930 3.1842 4.2618 4.3087 4.5049 4.5147 4.6590 4.6635 4.9192 4.9275 5.0940 5.1335 9.2053 9.2313 k = 0.1351 0.3747 0.9751 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8288 -42.6775 -42.6774 -22.3460 -22.3460 -7.5840 -7.5815 -7.3937 -7.3913 -7.0416 -7.0398 -6.2575 -6.2563 -6.1760 -6.1731 0.8339 0.8584 1.7625 1.7753 1.9203 1.9487 2.2433 2.2748 2.6899 2.8200 3.0916 3.1844 4.2568 4.3076 4.4828 4.4930 4.6320 4.6380 4.9135 4.9224 5.0547 5.0972 9.2360 9.2601 k = 0.1419 0.3589 0.9922 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3455 -22.3455 -7.5702 -7.5677 -7.3878 -7.3854 -7.0488 -7.0471 -6.2661 -6.2650 -6.1774 -6.1747 0.8269 0.8515 1.7537 1.7676 1.9198 1.9409 2.2401 2.2741 2.6963 2.8246 3.0909 3.1848 4.2514 4.3060 4.4617 4.4723 4.6078 4.6155 4.9076 4.9168 5.0143 5.0597 9.2511 9.2723 k = 0.1486 0.3432 1.0093 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3449 -22.3449 -7.5564 -7.5537 -7.3820 -7.3795 -7.0562 -7.0545 -6.2746 -6.2737 -6.1787 -6.1760 0.8191 0.8436 1.7425 1.7624 1.9186 1.9339 2.2365 2.2729 2.7055 2.8315 3.0906 3.1854 4.2455 4.3037 4.4417 4.4527 4.5865 4.5958 4.9009 4.9108 4.9732 5.0217 9.2472 9.2581 k = 0.1554 0.3275 1.0264 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3444 -22.3444 -7.5424 -7.5397 -7.3763 -7.3737 -7.0638 -7.0622 -6.2831 -6.2823 -6.1798 -6.1773 0.8106 0.8349 1.7307 1.7585 1.9154 1.9284 2.2328 2.2713 2.7172 2.8405 3.0906 3.1861 4.2394 4.3010 4.4229 4.4341 4.5680 4.5786 4.8920 4.9036 4.9332 4.9841 9.2140 9.2148 k = 0.1622 0.3118 1.0435 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3440 -22.3440 -7.5285 -7.5257 -7.3707 -7.3681 -7.0714 -7.0699 -6.2914 -6.2908 -6.1807 -6.1784 0.8016 0.8254 1.7192 1.7552 1.9095 1.9251 2.2294 2.2693 2.7312 2.8516 3.0908 3.1867 4.2333 4.2980 4.4053 4.4166 4.5522 4.5638 4.8728 4.8916 4.9042 4.9495 9.1724 9.1743 k = 0.1689 0.2961 1.0607 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3435 -22.3435 -7.5147 -7.5119 -7.3654 -7.3628 -7.0791 -7.0777 -6.2994 -6.2990 -6.1816 -6.1794 0.7922 0.8155 1.7082 1.7524 1.9019 1.9229 2.2263 2.2671 2.7471 2.8646 3.0909 3.1871 4.2277 4.2950 4.3892 4.4004 4.5388 4.5511 4.8358 4.8690 4.8943 4.9235 9.1333 9.1360 k = 0.1757 0.2804 1.0778 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3431 -22.3431 -7.5011 -7.4983 -7.3603 -7.3577 -7.0869 -7.0856 -6.3072 -6.3069 -6.1823 -6.1803 0.7826 0.8052 1.6979 1.7500 1.8934 1.9209 2.2239 2.2648 2.7645 2.8793 3.0910 3.1872 4.2227 4.2921 4.3744 4.3855 4.5275 4.5402 4.7939 4.8368 4.8882 4.9086 9.0975 9.1007 k = 0.1824 0.2646 1.0949 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8289 -42.6775 -42.6774 -22.3426 -22.3426 -7.4879 -7.4850 -7.3555 -7.3528 -7.0945 -7.0933 -6.3145 -6.3144 -6.1830 -6.1812 0.7730 0.7949 1.6884 1.7481 1.8847 1.9189 2.2221 2.2625 2.7831 2.8953 3.0909 3.1869 4.2187 4.2897 4.3609 4.3721 4.5180 4.5309 4.7515 4.7993 4.8831 4.8997 9.0652 9.0687 k = 0.1892 0.2489 1.1120 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6774 -22.3423 -22.3423 -7.4751 -7.4723 -7.3511 -7.3484 -7.1021 -7.1010 -6.3215 -6.3214 -6.1836 -6.1819 0.7636 0.7847 1.6796 1.7465 1.8758 1.9167 2.2209 2.2602 2.8025 2.9122 3.0905 3.1861 4.2161 4.2880 4.3488 4.3602 4.5099 4.5229 4.7099 4.7603 4.8785 4.8931 9.0363 9.0400 k = 0.1959 0.2332 1.1291 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3419 -22.3419 -7.4630 -7.4601 -7.3470 -7.3442 -7.1094 -7.1084 -6.3280 -6.3278 -6.1841 -6.1826 0.7546 0.7749 1.6717 1.7453 1.8672 1.9145 2.2204 2.2580 2.8222 2.9296 3.0897 3.1846 4.2151 4.2871 4.3379 4.3501 4.5027 4.5158 4.6698 4.7214 4.8745 4.8878 9.0108 9.0147 k = 0.2027 0.2175 1.1462 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3416 -22.3416 -7.4516 -7.4488 -7.3433 -7.3405 -7.1163 -7.1155 -6.3339 -6.3336 -6.1845 -6.1832 0.7462 0.7657 1.6647 1.7444 1.8590 1.9123 2.2204 2.2559 2.8418 2.9470 3.0886 3.1825 4.2158 4.2870 4.3282 4.3422 4.4959 4.5094 4.6323 4.6838 4.8709 4.8831 8.9886 8.9926 k = 0.2095 0.2018 1.1633 ( 6256 PWs) bands (ev): -74.4113 -74.4112 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3413 -22.3413 -7.4412 -7.4383 -7.3400 -7.3372 -7.1228 -7.1221 -6.3391 -6.3387 -6.1848 -6.1837 0.7386 0.7572 1.6585 1.7436 1.8515 1.9102 2.2208 2.2540 2.8609 2.9637 3.0873 3.1796 4.2184 4.2875 4.3195 4.3369 4.4884 4.5033 4.5987 4.6481 4.8678 4.8791 8.9696 8.9736 k = 0.2162 0.1861 1.1804 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3411 -22.3411 -7.4319 -7.4291 -7.3372 -7.3344 -7.1287 -7.1281 -6.3437 -6.3431 -6.1851 -6.1841 0.7319 0.7497 1.6532 1.7431 1.8447 1.9083 2.2215 2.2523 2.8790 2.9791 3.0860 3.1760 4.2228 4.2882 4.3118 4.3345 4.4793 4.4968 4.5708 4.6153 4.8652 4.8757 8.9537 8.9578 k = 0.2230 0.1703 1.1975 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3409 -22.3409 -7.4239 -7.4211 -7.3348 -7.3320 -7.1339 -7.1333 -6.3475 -6.3468 -6.1853 -6.1845 0.7262 0.7434 1.6488 1.7427 1.8390 1.9066 2.2223 2.2508 2.8956 2.9924 3.0852 3.1719 4.2287 4.2888 4.3053 4.3349 4.4677 4.4894 4.5502 4.5866 4.8630 4.8728 8.9408 8.9450 k = 0.2297 0.1546 1.2146 ( 6274 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3407 -22.3407 -7.4174 -7.4146 -7.3330 -7.3301 -7.1381 -7.1376 -6.3505 -6.3498 -6.1854 -6.1848 0.7217 0.7383 1.6453 1.7424 1.8344 1.9053 2.2232 2.2495 2.9098 3.0027 3.0851 3.1675 4.2355 4.2894 4.3001 4.3372 4.4549 4.4801 4.5374 4.5635 4.8614 4.8705 8.9309 8.9351 k = 0.2365 0.1389 1.2317 ( 6274 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3406 -22.3406 -7.4126 -7.4099 -7.3316 -7.3288 -7.1413 -7.1408 -6.3526 -6.3519 -6.1855 -6.1851 0.7184 0.7346 1.6429 1.7423 1.8310 1.9043 2.2239 2.2485 2.9211 3.0095 3.0860 3.1634 4.2422 4.2901 4.2963 4.3397 4.4448 4.4685 4.5306 4.5472 4.8602 4.8688 8.9239 8.9281 k = 0.2432 0.1232 1.2488 ( 6278 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3406 -22.3406 -7.4097 -7.4069 -7.3308 -7.3280 -7.1432 -7.1428 -6.3540 -6.3531 -6.1855 -6.1853 0.7164 0.7323 1.6414 1.7422 1.8290 1.9037 2.2244 2.2479 2.9283 3.0132 3.0872 3.1604 4.2472 4.2906 4.2943 4.3411 4.4412 4.4561 4.5279 4.5375 4.8595 4.8678 8.9197 8.9239 k = 0.2500 0.1075 1.2659 ( 6284 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4087 -7.4059 -7.3305 -7.3277 -7.1439 -7.1435 -6.3544 -6.3536 -6.1855 -6.1853 0.7158 0.7315 1.6409 1.7421 1.8283 1.9035 2.2245 2.2477 2.9309 3.0142 3.0878 3.1593 4.2491 4.2906 4.2940 4.3413 4.4438 4.4477 4.5275 4.5340 4.8592 4.8674 8.9183 8.9225 k = 0.2500 0.1075 1.2659 ( 6284 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4087 -7.4059 -7.3305 -7.3277 -7.1439 -7.1435 -6.3544 -6.3536 -6.1855 -6.1853 0.7158 0.7315 1.6409 1.7421 1.8283 1.9035 2.2245 2.2477 2.9309 3.0142 3.0878 3.1593 4.2491 4.2906 4.2940 4.3413 4.4438 4.4477 4.5275 4.5340 4.8592 4.8674 8.9183 8.9225 k = 0.2692 0.1157 1.2569 ( 6284 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4088 -7.4061 -7.3306 -7.3278 -7.1438 -7.1434 -6.3543 -6.3535 -6.1855 -6.1853 0.7159 0.7316 1.6413 1.7418 1.8286 1.9032 2.2246 2.2476 2.9308 3.0135 3.0883 3.1593 4.2487 4.2868 4.2978 4.3414 4.4426 4.4498 4.5276 4.5345 4.8593 4.8674 8.8990 8.9033 k = 0.2885 0.1240 1.2479 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4092 -7.4065 -7.3307 -7.3279 -7.1435 -7.1431 -6.3541 -6.3533 -6.1855 -6.1853 0.7164 0.7317 1.6426 1.7408 1.8296 1.9025 2.2247 2.2473 2.9307 3.0111 3.0900 3.1590 4.2481 4.2833 4.3015 4.3413 4.4411 4.4540 4.5279 4.5358 4.8594 4.8674 8.8558 8.8600 k = 0.3077 0.1323 1.2389 ( 6271 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3406 -22.3406 -7.4097 -7.4071 -7.3309 -7.3283 -7.1431 -7.1427 -6.3538 -6.3531 -6.1855 -6.1852 0.7172 0.7320 1.6448 1.7391 1.8314 1.9013 2.2248 2.2470 2.9306 3.0072 3.0926 3.1584 4.2473 4.2800 4.3047 4.3408 4.4404 4.4594 4.5286 4.5378 4.8597 4.8674 8.8058 8.8099 k = 0.3269 0.1406 1.2299 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3406 -22.3406 -7.4105 -7.4080 -7.3313 -7.3287 -7.1424 -7.1420 -6.3534 -6.3527 -6.1855 -6.1852 0.7183 0.7324 1.6479 1.7368 1.8338 1.8997 2.2248 2.2464 2.9307 3.0022 3.0957 3.1572 4.2464 4.2770 4.3072 4.3400 4.4408 4.4657 4.5296 4.5402 4.8600 4.8675 8.7568 8.7605 k = 0.3462 0.1488 1.2209 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3406 -22.3406 -7.4114 -7.4091 -7.3317 -7.3294 -7.1416 -7.1412 -6.3528 -6.3522 -6.1855 -6.1851 0.7198 0.7330 1.6516 1.7339 1.8370 1.8979 2.2248 2.2459 2.9311 2.9963 3.0990 3.1554 4.2455 4.2743 4.3091 4.3386 4.4426 4.4729 4.5309 4.5430 4.8605 4.8675 8.7118 8.7152 k = 0.3654 0.1571 1.2119 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3406 -22.3406 -7.4125 -7.4104 -7.3324 -7.3302 -7.1406 -7.1402 -6.3521 -6.3516 -6.1855 -6.1850 0.7217 0.7337 1.6561 1.7304 1.8409 1.8957 2.2246 2.2453 2.9316 2.9898 3.1022 3.1527 4.2447 4.2721 4.3104 4.3367 4.4456 4.4806 4.5325 4.5462 4.8611 4.8676 8.6722 8.6753 k = 0.3846 0.1654 1.2029 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3407 -22.3407 -7.4137 -7.4118 -7.3331 -7.3312 -7.1395 -7.1391 -6.3514 -6.3509 -6.1854 -6.1849 0.7240 0.7348 1.6612 1.7265 1.8453 1.8935 2.2243 2.2448 2.9324 2.9829 3.1050 3.1493 4.2437 4.2703 4.3111 4.3341 4.4499 4.4888 4.5345 4.5496 4.8619 4.8678 8.6390 8.6416 k = 0.4038 0.1736 1.1939 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3407 -22.3407 -7.4151 -7.4134 -7.3341 -7.3324 -7.1381 -7.1378 -6.3505 -6.3500 -6.1854 -6.1847 0.7267 0.7361 1.6668 1.7222 1.8504 1.8911 2.2237 2.2444 2.9333 2.9758 3.1073 3.1451 4.2427 4.2691 4.3115 4.3310 4.4553 4.4972 4.5369 4.5534 4.8627 4.8681 8.6125 8.6147 k = 0.4231 0.1819 1.1849 ( 6266 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3408 -22.3408 -7.4167 -7.4152 -7.3351 -7.3337 -7.1367 -7.1363 -6.3494 -6.3491 -6.1853 -6.1846 0.7297 0.7377 1.6728 1.7177 1.8559 1.8888 2.2229 2.2442 2.9343 2.9686 3.1090 3.1402 4.2414 4.2684 4.3119 4.3275 4.4616 4.5056 4.5397 4.5573 4.8638 4.8684 8.5930 8.5948 k = 0.4423 0.1902 1.1759 ( 6265 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3408 -22.3408 -7.4183 -7.4172 -7.3363 -7.3353 -7.1351 -7.1347 -6.3483 -6.3481 -6.1852 -6.1844 0.7329 0.7396 1.6790 1.7129 1.8618 1.8865 2.2219 2.2443 2.9353 2.9612 3.1100 3.1348 4.2397 4.2685 4.3122 4.3237 4.4687 4.5137 4.5431 4.5615 4.8650 4.8689 8.5806 8.5821 k = 0.4615 0.1984 1.1669 ( 6269 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3409 -22.3409 -7.4202 -7.4193 -7.3377 -7.3369 -7.1334 -7.1329 -6.3471 -6.3469 -6.1851 -6.1843 0.7364 0.7420 1.6853 1.7082 1.8680 1.8845 2.2206 2.2445 2.9360 2.9538 3.1103 3.1292 4.2376 4.2693 4.3121 4.3204 4.4762 4.5212 4.5473 4.5660 4.8663 4.8697 8.5753 8.5765 k = 0.4808 0.2067 1.1579 ( 6274 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3410 -22.3410 -7.4222 -7.4215 -7.3391 -7.3387 -7.1315 -7.1311 -6.3458 -6.3457 -6.1850 -6.1841 0.7398 0.7448 1.6914 1.7038 1.8743 1.8829 2.2192 2.2449 2.9362 2.9465 3.1094 3.1241 4.2351 4.2707 4.3104 4.3191 4.4839 4.5280 4.5525 4.5709 4.8677 4.8706 8.5771 8.5780 k = 0.5000 0.2150 1.1489 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3411 -22.3411 -7.4245 -7.4239 -7.3406 -7.3406 -7.1295 -7.1291 -6.3443 -6.3443 -6.1849 -6.1839 0.7432 0.7483 1.6953 1.7015 1.8793 1.8829 2.2177 2.2454 2.9341 2.9406 3.1068 3.1206 4.2321 4.2727 4.3069 4.3202 4.4918 4.5340 4.5587 4.5761 4.8692 4.8719 8.5856 8.5866 k = 0.5000 0.2150 1.1489 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3411 -22.3411 -7.4245 -7.4239 -7.3406 -7.3406 -7.1295 -7.1291 -6.3443 -6.3443 -6.1849 -6.1839 0.7432 0.7483 1.6953 1.7015 1.8793 1.8829 2.2177 2.2454 2.9341 2.9406 3.1068 3.1206 4.2321 4.2727 4.3069 4.3202 4.4918 4.5340 4.5587 4.5761 4.8692 4.8719 8.5856 8.5866 k = 0.5000 0.2150 1.1250 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3413 -22.3413 -7.4315 -7.4307 -7.3457 -7.3456 -7.1238 -7.1233 -6.3401 -6.3401 -6.1844 -6.1833 0.7529 0.7590 1.6968 1.7049 1.8862 1.8914 2.2133 2.2470 2.9214 2.9290 3.0965 3.1137 4.2238 4.2775 4.2987 4.3270 4.5130 4.5481 4.5783 4.5918 4.8741 4.8765 8.6202 8.6212 k = 0.5000 0.2150 1.1011 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3416 -22.3416 -7.4392 -7.4384 -7.3517 -7.3516 -7.1173 -7.1169 -6.3353 -6.3352 -6.1838 -6.1825 0.7643 0.7716 1.6982 1.7086 1.8945 1.9018 2.2086 2.2482 2.9067 2.9155 3.0854 3.1061 4.2157 4.2753 4.3004 4.3364 4.5345 4.5620 4.5997 4.6095 4.8810 4.8823 8.6601 8.6612 k = 0.5000 0.2150 1.0771 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6774 -22.3419 -22.3419 -7.4475 -7.4466 -7.3586 -7.3585 -7.1104 -7.1100 -6.3298 -6.3297 -6.1829 -6.1816 0.7774 0.7860 1.6994 1.7125 1.9041 1.9140 2.2034 2.2491 2.8902 2.9001 3.0738 3.0982 4.2085 4.2677 4.3103 4.3478 4.5557 4.5770 4.6205 4.6287 4.8897 4.8903 8.7049 8.7061 k = 0.5000 0.2150 1.0532 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6774 -22.3422 -22.3422 -7.4562 -7.4553 -7.3665 -7.3663 -7.1031 -7.1027 -6.3238 -6.3236 -6.1819 -6.1804 0.7921 0.8021 1.7004 1.7164 1.9150 1.9281 2.1979 2.2496 2.8719 2.8830 3.0621 3.0904 4.2022 4.2599 4.3237 4.3612 4.5764 4.5937 4.6395 4.6491 4.8992 4.9026 8.7539 8.7551 k = 0.5000 0.2150 1.0293 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8289 -42.6775 -42.6774 -22.3426 -22.3426 -7.4651 -7.4642 -7.3752 -7.3750 -7.0956 -7.0953 -6.3173 -6.3171 -6.1806 -6.1791 0.8084 0.8198 1.7011 1.7203 1.9272 1.9441 2.1919 2.2497 2.8521 2.8646 3.0507 3.0830 4.1972 4.2530 4.3393 4.3761 4.5963 4.6121 4.6558 4.6699 4.9112 4.9182 8.8063 8.8074 k = 0.5000 0.2150 1.0053 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3431 -22.3431 -7.4742 -7.4733 -7.3848 -7.3846 -7.0878 -7.0876 -6.3104 -6.3101 -6.1790 -6.1775 0.8262 0.8391 1.7014 1.7241 1.9405 1.9619 2.1856 2.2493 2.8310 2.8449 3.0399 3.0762 4.1935 4.2472 4.3569 4.3927 4.6151 4.6323 4.6691 4.6907 4.9260 4.9374 8.8611 8.8619 k = 0.5000 0.2150 0.9814 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3435 -22.3435 -7.4833 -7.4825 -7.3952 -7.3950 -7.0800 -7.0799 -6.3031 -6.3028 -6.1772 -6.1757 0.8453 0.8600 1.7014 1.7276 1.9547 1.9814 2.1791 2.2484 2.8087 2.8245 3.0300 3.0704 4.1909 4.2426 4.3765 4.4107 4.6325 4.6539 4.6794 4.7114 4.9441 4.9601 8.9170 8.9176 k = 0.5000 0.2150 0.9575 ( 6254 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3440 -22.3440 -7.4924 -7.4916 -7.4064 -7.4063 -7.0722 -7.0721 -6.2956 -6.2952 -6.1750 -6.1735 0.8658 0.8822 1.7009 1.7310 1.9697 2.0026 2.1724 2.2470 2.7856 2.8036 3.0214 3.0656 4.1895 4.2391 4.3978 4.4302 4.6479 4.6762 4.6875 4.7321 4.9653 4.9860 8.9725 8.9728 k = 0.5000 0.2150 0.9335 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3446 -22.3446 -7.5013 -7.5006 -7.4184 -7.4183 -7.0645 -7.0643 -6.2879 -6.2874 -6.1725 -6.1711 0.8876 0.9058 1.7000 1.7340 1.9850 2.0253 2.1657 2.2450 2.7619 2.7826 3.0141 3.0621 4.1892 4.2368 4.4208 4.4511 4.6609 4.6890 4.7038 4.7532 4.9897 5.0146 9.0258 9.0259 k = 0.5000 0.2150 0.9096 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3451 -22.3451 -7.5100 -7.5094 -7.4311 -7.4310 -7.0569 -7.0565 -6.2801 -6.2795 -6.1697 -6.1683 0.9104 0.9307 1.6987 1.7366 2.0003 2.0492 2.1594 2.2426 2.7379 2.7621 3.0084 3.0598 4.1899 4.2355 4.4455 4.4735 4.6711 4.6918 4.7290 4.7752 5.0168 5.0454 9.0745 9.0752 k = 0.5000 0.2150 0.8856 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8289 -42.8289 -42.6775 -42.6774 -22.3457 -22.3457 -7.5184 -7.5180 -7.4444 -7.4443 -7.0493 -7.0488 -6.2722 -6.2715 -6.1665 -6.1652 0.9343 0.9567 1.6971 1.7389 2.0150 2.0742 2.1538 2.2397 2.7140 2.7423 3.0045 3.0590 4.1915 4.2351 4.4718 4.4971 4.6785 4.6921 4.7557 4.7983 5.0463 5.0780 9.1166 9.1180 k = 0.5000 0.2150 0.8617 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3463 -22.3463 -7.5266 -7.5265 -7.4584 -7.4581 -7.0420 -7.0412 -6.2643 -6.2635 -6.1630 -6.1618 0.9592 0.9838 1.6951 1.7409 2.0282 2.0999 2.1493 2.2364 2.6906 2.7240 3.0023 3.0596 4.1940 4.2357 4.4997 4.5221 4.6834 4.6908 4.7835 4.8224 5.0778 5.1120 9.1498 9.1520 k = 0.5000 0.2150 0.8378 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3470 -22.3470 -7.5347 -7.5345 -7.4728 -7.4722 -7.0347 -7.0338 -6.2564 -6.2556 -6.1591 -6.1581 0.9849 1.0119 1.6929 1.7424 2.0392 2.1260 2.1467 2.2328 2.6681 2.7075 3.0019 3.0615 4.1973 4.2369 4.5290 4.5484 4.6859 4.6880 4.8120 4.8474 5.1108 5.1470 9.1724 9.1753 k = 0.5000 0.2150 0.8138 ( 6254 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0282 -42.8288 -42.8288 -42.6775 -42.6774 -22.3477 -22.3477 -7.5429 -7.5423 -7.4874 -7.4864 -7.0276 -7.0265 -6.2487 -6.2478 -6.1550 -6.1541 1.0114 1.0409 1.6904 1.7435 2.0470 2.1462 2.1519 2.2292 2.6471 2.6936 3.0033 3.0649 4.2013 4.2389 4.5598 4.5758 4.6842 4.6866 4.8411 4.8730 5.1449 5.1827 9.1830 9.1867 k = 0.5000 0.2150 0.7899 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8288 -42.6775 -42.6774 -22.3483 -22.3483 -7.5513 -7.5501 -7.5020 -7.5004 -7.0208 -7.0195 -6.2410 -6.2402 -6.1507 -6.1498 1.0385 1.0707 1.6877 1.7443 2.0513 2.1480 2.1765 2.2261 2.6281 2.6827 3.0065 3.0697 4.2058 4.2415 4.5919 4.6043 4.6795 4.6856 4.8706 4.8991 5.1799 5.2188 9.1819 9.1862 k = 0.5000 0.2150 0.7660 ( 6248 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8288 -42.8287 -42.6775 -42.6774 -22.3491 -22.3490 -7.5602 -7.5583 -7.5161 -7.5138 -7.0141 -7.0127 -6.2335 -6.2326 -6.1461 -6.1454 1.0662 1.1012 1.6848 1.7447 2.0523 2.1514 2.1969 2.2258 2.6120 2.6755 3.0113 3.0757 4.2109 4.2446 4.6253 4.6330 4.6748 4.6833 4.9001 4.9253 5.2155 5.2553 9.1702 9.1751 k = 0.5000 0.2150 0.7420 ( 6244 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3498 -22.3498 -7.5703 -7.5675 -7.5289 -7.5258 -7.0077 -7.0060 -6.2261 -6.2253 -6.1414 -6.1408 1.0943 1.1322 1.6819 1.7447 2.0509 2.1551 2.2050 2.2354 2.5997 2.6724 3.0178 3.0830 4.2165 4.2482 4.6559 4.6596 4.6761 4.6800 4.9297 4.9515 5.2514 5.2918 9.1503 9.1555 k = 0.5000 0.2150 0.7181 ( 6244 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3505 -22.3505 -7.5819 -7.5784 -7.5397 -7.5360 -7.0015 -6.9997 -6.2189 -6.2182 -6.1366 -6.1361 1.1228 1.1638 1.6789 1.7445 2.0479 2.1580 2.2036 2.2513 2.5924 2.6739 3.0259 3.0915 4.2224 4.2521 4.6555 4.6749 4.6959 4.7009 4.9591 4.9775 5.2874 5.3281 9.1245 9.1299 k = 0.5000 0.2150 0.6942 ( 6244 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3513 -22.3513 -7.5953 -7.5916 -7.5480 -7.5440 -6.9956 -6.9936 -6.2119 -6.2112 -6.1318 -6.1313 1.1516 1.1957 1.6760 1.7440 2.0440 2.1593 2.1996 2.2653 2.5912 2.6801 3.0353 3.1010 4.2286 4.2563 4.6484 4.6696 4.7322 4.7324 4.9882 5.0030 5.3234 5.3643 9.0955 9.1010 k = 0.5000 0.2150 0.6702 ( 6240 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8287 -42.8287 -42.6775 -42.6774 -22.3520 -22.3520 -7.6102 -7.6065 -7.5541 -7.5500 -6.9899 -6.9878 -6.2050 -6.2044 -6.1269 -6.1265 1.1805 1.2278 1.6732 1.7432 2.0398 2.1586 2.1950 2.2747 2.5970 2.6910 3.0462 3.1117 4.2351 4.2607 4.6400 4.6635 4.7653 4.7695 5.0169 5.0280 5.3592 5.4000 9.0654 9.0708 k = 0.5000 0.2150 0.6463 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0282 -44.0281 -42.8286 -42.8286 -42.6775 -42.6774 -22.3528 -22.3528 -7.6261 -7.6226 -7.5584 -7.5545 -6.9845 -6.9823 -6.1983 -6.1978 -6.1222 -6.1218 1.2095 1.2601 1.6706 1.7424 2.0355 2.1559 2.1901 2.2790 2.6099 2.7062 3.0583 3.1232 4.2417 4.2652 4.6308 4.6565 4.7987 4.8074 5.0450 5.0523 5.3946 5.4352 9.0361 9.0413 k = 0.5000 0.2150 0.6223 ( 6246 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3535 -22.3535 -7.6427 -7.6394 -7.5614 -7.5578 -6.9794 -6.9771 -6.1918 -6.1914 -6.1175 -6.1172 1.2385 1.2925 1.6682 1.7414 2.0314 2.1512 2.1852 2.2786 2.6294 2.7256 3.0715 3.1357 4.2485 4.2698 4.6210 4.6490 4.8323 4.8456 5.0727 5.0760 5.4294 5.4696 9.0091 9.0140 k = 0.5000 0.2150 0.5984 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3543 -22.3543 -7.6597 -7.6566 -7.5634 -7.5600 -6.9746 -6.9722 -6.1855 -6.1851 -6.1130 -6.1127 1.2673 1.3248 1.6661 1.7405 2.0274 2.1450 2.1802 2.2743 2.6544 2.7486 3.0858 3.1489 4.2553 4.2744 4.6106 4.6408 4.8656 4.8836 5.0991 5.1000 5.4635 5.5033 8.9853 8.9898 k = 0.5000 0.2150 0.5745 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8286 -42.6775 -42.6774 -22.3551 -22.3551 -7.6768 -7.6739 -7.5645 -7.5613 -6.9701 -6.9676 -6.1793 -6.1791 -6.1087 -6.1084 1.2960 1.3569 1.6644 1.7396 2.0238 2.1375 2.1752 2.2673 2.6839 2.7746 3.1011 3.1629 4.2622 4.2789 4.5997 4.6321 4.8983 4.9211 5.1219 5.1270 5.4968 5.5360 8.9657 8.9697 k = 0.5000 0.2150 0.5505 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8286 -42.8285 -42.6775 -42.6774 -22.3558 -22.3558 -7.6940 -7.6912 -7.5649 -7.5618 -6.9660 -6.9634 -6.1734 -6.1732 -6.1045 -6.1043 1.3243 1.3887 1.6631 1.7388 2.0204 2.1292 2.1702 2.2585 2.7168 2.8032 3.1172 3.1775 4.2690 4.2832 4.5884 4.6230 4.9297 4.9571 5.1449 5.1542 5.5291 5.5676 8.9509 8.9541 k = 0.5000 0.2150 0.5266 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3566 -22.3566 -7.7110 -7.7084 -7.5646 -7.5617 -6.9622 -6.9596 -6.1676 -6.1676 -6.1006 -6.1004 1.3523 1.4200 1.6622 1.7382 2.0173 2.1205 2.1652 2.2486 2.7521 2.8340 3.1340 3.1927 4.2756 4.2872 4.5767 4.6135 4.9593 4.9909 5.1689 5.1818 5.5602 5.5979 8.9411 8.9432 k = 0.5000 0.2150 0.5027 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3573 -22.3573 -7.7278 -7.7254 -7.5637 -7.5609 -6.9587 -6.9561 -6.1622 -6.1621 -6.0969 -6.0967 1.3799 1.4508 1.6617 1.7378 2.0145 2.1115 2.1602 2.2382 2.7893 2.8665 3.1515 3.2083 4.2820 4.2909 4.5647 4.6036 4.9864 5.0212 5.1950 5.2105 5.5901 5.6269 8.9363 8.9371 k = 0.5000 0.2150 0.4787 ( 6254 PWs) bands (ev): -74.4113 -74.4113 -44.0281 -44.0280 -42.8285 -42.8285 -42.6775 -42.6774 -22.3580 -22.3580 -7.7443 -7.7421 -7.5621 -7.5595 -6.9556 -6.9530 -6.1570 -6.1568 -6.0934 -6.0933 1.4069 1.4810 1.6618 1.7377 2.0119 2.1027 2.1551 2.2277 2.8279 2.9005 3.1696 3.2244 4.2881 4.2943 4.5525 4.5935 5.0104 5.0470 5.2239 5.2406 5.6187 5.6545 8.9350 8.9364 k = 0.5000 0.2150 0.4548 ( 6254 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0280 -42.8285 -42.8284 -42.6775 -42.6774 -22.3587 -22.3587 -7.7605 -7.7584 -7.5601 -7.5576 -6.9528 -6.9502 -6.1521 -6.1519 -6.0901 -6.0900 1.4334 1.5103 1.6623 1.7378 2.0097 2.0940 2.1501 2.2173 2.8674 2.9355 3.1881 3.2407 4.2939 4.2971 4.5400 4.5832 5.0309 5.0675 5.2563 5.2726 5.6457 5.6805 8.9357 8.9405 k = 0.5000 0.2150 0.4309 ( 6250 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3594 -22.3594 -7.7762 -7.7742 -7.5576 -7.5552 -6.9504 -6.9478 -6.1474 -6.1472 -6.0869 -6.0869 1.4592 1.5388 1.6634 1.7382 2.0076 2.0858 2.1450 2.2071 2.9076 2.9714 3.2070 3.2573 4.2991 4.2993 4.5275 4.5728 5.0477 5.0830 5.2921 5.3064 5.6712 5.7048 8.9353 8.9461 k = 0.5000 0.2150 0.4069 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3601 -22.3601 -7.7914 -7.7895 -7.5547 -7.5524 -6.9484 -6.9458 -6.1431 -6.1428 -6.0840 -6.0840 1.4843 1.5662 1.6650 1.7389 2.0059 2.0780 2.1398 2.1973 2.9481 3.0077 3.2261 3.2739 4.3007 4.3036 4.5150 4.5624 5.0609 5.0938 5.3307 5.3421 5.6949 5.7274 8.9239 8.9461 k = 0.5000 0.2150 0.3830 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3607 -22.3607 -7.8060 -7.8043 -7.5515 -7.5493 -6.9466 -6.9441 -6.1391 -6.1388 -6.0812 -6.0812 1.5087 1.5924 1.6671 1.7398 2.0043 2.0709 2.1345 2.1879 2.9887 3.0443 3.2454 3.2906 4.3013 4.3073 4.5029 4.5521 5.0706 5.1008 5.3713 5.3794 5.7170 5.7483 8.8774 8.8854 k = 0.5000 0.2150 0.3590 ( 6256 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8284 -42.6775 -42.6774 -22.3613 -22.3613 -7.8200 -7.8184 -7.5479 -7.5458 -6.9452 -6.9428 -6.1355 -6.1351 -6.0786 -6.0785 1.5323 1.6172 1.6696 1.7411 2.0031 2.0644 2.1292 2.1789 3.0292 3.0810 3.2647 3.3072 4.3009 4.3100 4.4912 4.5421 5.0774 5.1046 5.4131 5.4178 5.7373 5.7674 8.8024 8.8129 k = 0.5000 0.2150 0.3351 ( 6252 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8284 -42.8283 -42.6775 -42.6774 -22.3619 -22.3619 -7.8333 -7.8318 -7.5441 -7.5422 -6.9441 -6.9418 -6.1322 -6.1319 -6.0761 -6.0759 1.5550 1.6406 1.6726 1.7425 2.0022 2.0585 2.1237 2.1702 3.0692 3.1175 3.2839 3.3236 4.2995 4.3113 4.4804 4.5324 5.0816 5.1059 5.4557 5.4571 5.7559 5.7847 8.7211 8.7356 k = 0.5000 0.2150 0.3112 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3625 -22.3625 -7.8459 -7.8445 -7.5402 -7.5383 -6.9433 -6.9410 -6.1292 -6.1289 -6.0737 -6.0734 1.5769 1.6622 1.6760 1.7443 2.0017 2.0534 2.1182 2.1619 3.1086 3.1534 3.3030 3.3397 4.2969 4.3110 4.4706 4.5232 5.0836 5.1052 5.4966 5.4983 5.7727 5.8002 8.6299 8.6637 k = 0.5000 0.2150 0.2872 ( 6278 PWs) bands (ev): -74.4113 -74.4113 -44.0280 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3630 -22.3630 -7.8577 -7.8565 -7.5361 -7.5344 -6.9427 -6.9406 -6.1266 -6.1264 -6.0713 -6.0711 1.5979 1.6798 1.6819 1.7463 2.0017 2.0490 2.1126 2.1538 3.1470 3.1886 3.3219 3.3555 4.2931 4.3089 4.4623 4.5147 5.0838 5.1030 5.5361 5.5406 5.7878 5.8141 8.5387 8.5706 k = 0.5000 0.2150 0.2633 ( 6286 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3635 -22.3635 -7.8688 -7.8676 -7.5320 -7.5304 -6.9424 -6.9404 -6.1244 -6.1242 -6.0691 -6.0688 1.6180 1.6839 1.6993 1.7488 2.0023 2.0453 2.1069 2.1459 3.1841 3.2227 3.3404 3.3708 4.2881 4.3047 4.4556 4.5068 5.0827 5.0995 5.5751 5.5820 5.8013 5.8263 8.4502 8.4804 k = 0.5000 0.2150 0.2394 ( 6286 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3640 -22.3640 -7.8789 -7.8779 -7.5280 -7.5265 -6.9422 -6.9404 -6.1225 -6.1223 -6.0670 -6.0666 1.6371 1.6883 1.7138 1.7520 2.0034 2.0423 2.1013 2.1381 3.2197 3.2553 3.3585 3.3856 4.2821 4.2986 4.4507 4.4997 5.0806 5.0953 5.6131 5.6221 5.8134 5.8371 8.3660 8.3944 k = 0.5000 0.2150 0.2154 ( 6286 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3644 -22.3644 -7.8882 -7.8873 -7.5240 -7.5227 -6.9423 -6.9406 -6.1209 -6.1208 -6.0649 -6.0646 1.6551 1.6930 1.7248 1.7565 2.0054 2.0400 2.0956 2.1304 3.2533 3.2861 3.3762 3.3999 4.2750 4.2908 4.4476 4.4933 5.0777 5.0905 5.6495 5.6602 5.8242 5.8465 8.2868 8.3134 k = 0.5000 0.2150 0.1915 ( 6282 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8283 -42.6775 -42.6774 -22.3647 -22.3647 -7.8966 -7.8958 -7.5203 -7.5191 -6.9424 -6.9409 -6.1196 -6.1195 -6.0630 -6.0627 1.6720 1.6979 1.7320 1.7622 2.0081 2.0385 2.0899 2.1227 3.2844 3.3144 3.3934 3.4137 4.2672 4.2816 4.4460 4.4876 5.0745 5.0855 5.6840 5.6959 5.8339 5.8549 8.2135 8.2381 k = 0.5000 0.2150 0.1676 ( 6274 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8283 -42.8282 -42.6775 -42.6774 -22.3651 -22.3651 -7.9041 -7.9034 -7.5167 -7.5157 -6.9427 -6.9413 -6.1185 -6.1184 -6.0613 -6.0610 1.6874 1.7034 1.7361 1.7684 2.0117 2.0377 2.0843 2.1150 3.3125 3.3397 3.4101 3.4271 4.2589 4.2716 4.4456 4.4827 5.0711 5.0804 5.7158 5.7284 5.8429 5.8623 8.1469 8.1693 k = 0.5000 0.2150 0.1436 ( 6278 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3654 -22.3654 -7.9106 -7.9100 -7.5135 -7.5126 -6.9430 -6.9418 -6.1177 -6.1176 -6.0597 -6.0594 1.7001 1.7105 1.7380 1.7738 2.0161 2.0376 2.0787 2.1072 3.3374 3.3615 3.4261 3.4400 4.2505 4.2612 4.4461 4.4782 5.0678 5.0756 5.7442 5.7570 5.8515 5.8690 8.0876 8.1075 k = 0.5000 0.2150 0.1197 ( 6278 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6775 -42.6774 -22.3656 -22.3656 -7.9161 -7.9156 -7.5107 -7.5099 -6.9433 -6.9423 -6.1170 -6.1170 -6.0584 -6.0581 1.7083 1.7209 1.7387 1.7778 2.0214 2.0383 2.0732 2.0993 3.3585 3.3793 3.4414 3.4523 4.2424 4.2511 4.4474 4.4743 5.0647 5.0710 5.7687 5.7807 5.8601 5.8754 8.0363 8.0535 k = 0.5000 0.2150 0.0957 ( 6276 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3658 -22.3658 -7.9207 -7.9203 -7.5083 -7.5077 -6.9436 -6.9428 -6.1165 -6.1165 -6.0572 -6.0570 1.7140 1.7325 1.7383 1.7799 2.0273 2.0398 2.0679 2.0913 3.3759 3.3929 3.4553 3.4638 4.2351 4.2419 4.4491 4.4707 5.0620 5.0670 5.7887 5.7989 5.8691 5.8815 7.9936 8.0078 k = 0.5000 0.2150 0.0718 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3660 -22.3660 -7.9242 -7.9239 -7.5063 -7.5059 -6.9438 -6.9432 -6.1161 -6.1161 -6.0563 -6.0561 1.7187 1.7372 1.7435 1.7801 2.0337 2.0421 2.0628 2.0832 3.3896 3.4025 3.4674 3.4736 4.2290 4.2339 4.4513 4.4675 5.0599 5.0636 5.8039 5.8116 5.8781 5.8871 7.9602 7.9711 k = 0.5000 0.2150 0.0479 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3661 -22.3661 -7.9267 -7.9265 -7.5049 -7.5046 -6.9439 -6.9436 -6.1159 -6.1159 -6.0556 -6.0555 1.7230 1.7355 1.7535 1.7782 2.0398 2.0459 2.0580 2.0751 3.3998 3.4084 3.4770 3.4811 4.2245 4.2277 4.4536 4.4644 5.0586 5.0610 5.8144 5.8194 5.8862 5.8918 7.9365 7.9439 k = 0.5000 0.2150 0.0239 ( 6260 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9282 -7.9281 -7.5040 -7.5038 -6.9440 -6.9438 -6.1157 -6.1157 -6.0552 -6.0551 1.7268 1.7331 1.7620 1.7745 2.0448 2.0518 2.0534 2.0670 3.4066 3.4110 3.4834 3.4854 4.2219 4.2235 4.4561 4.4615 5.0580 5.0592 5.8208 5.8232 5.8920 5.8946 7.9229 7.9266 k = 0.5000 0.2150-0.0000 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0279 -44.0279 -42.8282 -42.8282 -42.6774 -42.6774 -22.3662 -22.3662 -7.9287 -7.9287 -7.5036 -7.5036 -6.9440 -6.9440 -6.1157 -6.1157 -6.0550 -6.0550 1.7302 1.7302 1.7691 1.7691 2.0491 2.0491 2.0591 2.0591 3.4103 3.4103 3.4862 3.4862 4.2216 4.2216 4.4588 4.4588 5.0581 5.0581 5.8236 5.8236 5.8948 5.8948 7.9196 7.9196 k = 0.0000 0.0000 1.2659 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4071 -7.4071 -7.3294 -7.3294 -7.1436 -7.1436 -6.3540 -6.3540 -6.1854 -6.1854 0.7227 0.7227 1.6923 1.6923 1.8646 1.8646 2.2344 2.2344 2.9649 2.9649 3.1351 3.1351 4.2573 4.2573 4.3333 4.3333 4.4460 4.4460 4.5330 4.5330 4.8622 4.8622 8.5071 8.5071 k = 0.0208 0.0090 1.2659 ( 6270 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4073 -7.4070 -7.3296 -7.3292 -7.1437 -7.1436 -6.3540 -6.3539 -6.1854 -6.1854 0.7217 0.7237 1.6856 1.6989 1.8596 1.8696 2.2329 2.2359 2.9602 2.9699 3.1309 3.1391 4.2557 4.2591 4.3311 4.3352 4.4457 4.4462 4.5325 4.5334 4.8617 4.8628 8.5106 8.5112 k = 0.0417 0.0179 1.2659 ( 6264 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4075 -7.4068 -7.3297 -7.3290 -7.1437 -7.1436 -6.3541 -6.3539 -6.1854 -6.1854 0.7207 0.7248 1.6790 1.7055 1.8547 1.8745 2.2316 2.2374 2.9557 2.9749 3.1264 3.1426 4.2544 4.2611 4.3286 4.3368 4.4454 4.4465 4.5320 4.5337 4.8613 4.8634 8.5217 8.5227 k = 0.0625 0.0269 1.2659 ( 6266 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4077 -7.4066 -7.3299 -7.3288 -7.1437 -7.1436 -6.3541 -6.3538 -6.1854 -6.1854 0.7198 0.7258 1.6727 1.7117 1.8501 1.8793 2.2303 2.2390 2.9514 2.9801 3.1217 3.1459 4.2533 4.2634 4.3257 4.3380 4.4452 4.4467 4.5314 4.5339 4.8608 4.8640 8.5401 8.5417 k = 0.0833 0.0358 1.2659 ( 6262 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4079 -7.4065 -7.3300 -7.3286 -7.1438 -7.1436 -6.3542 -6.3538 -6.1855 -6.1854 0.7190 0.7269 1.6666 1.7177 1.8458 1.8839 2.2291 2.2405 2.9474 2.9853 3.1168 3.1487 4.2524 4.2659 4.3226 4.3390 4.4449 4.4469 4.5308 4.5341 4.8605 4.8646 8.5659 8.5680 k = 0.1042 0.0448 1.2659 ( 6254 PWs) bands (ev): -74.4112 -74.4112 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4080 -7.4064 -7.3301 -7.3284 -7.1438 -7.1435 -6.3542 -6.3537 -6.1855 -6.1853 0.7183 0.7278 1.6610 1.7231 1.8418 1.8881 2.2281 2.2420 2.9438 2.9904 3.1118 3.1513 4.2517 4.2687 4.3191 4.3398 4.4447 4.4471 4.5301 4.5342 4.8602 4.8652 8.5987 8.6012 k = 0.1250 0.0537 1.2659 ( 6268 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4082 -7.4063 -7.3303 -7.3282 -7.1438 -7.1435 -6.3543 -6.3537 -6.1855 -6.1853 0.7176 0.7287 1.6560 1.7280 1.8383 1.8920 2.2271 2.2433 2.9405 2.9954 3.1068 3.1534 4.2510 4.2717 4.3154 4.3402 4.4444 4.4472 4.5295 4.5342 4.8599 4.8657 8.6382 8.6412 k = 0.1458 0.0627 1.2659 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4084 -7.4062 -7.3303 -7.3281 -7.1438 -7.1435 -6.3543 -6.3536 -6.1855 -6.1853 0.7170 0.7295 1.6515 1.7322 1.8353 1.8953 2.2264 2.2446 2.9377 3.0003 3.1020 3.1552 4.2505 4.2749 4.3115 4.3406 4.4442 4.4473 4.5290 4.5342 4.8597 4.8662 8.6840 8.6873 k = 0.1667 0.0717 1.2659 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4085 -7.4061 -7.3304 -7.3279 -7.1439 -7.1435 -6.3543 -6.3536 -6.1855 -6.1853 0.7166 0.7302 1.6478 1.7358 1.8328 1.8982 2.2257 2.2456 2.9353 3.0047 3.0975 3.1567 4.2501 4.2784 4.3075 4.3408 4.4441 4.4475 4.5285 4.5341 4.8595 4.8666 8.7352 8.7389 k = 0.1875 0.0806 1.2659 ( 6286 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4086 -7.4060 -7.3305 -7.3278 -7.1439 -7.1435 -6.3544 -6.3536 -6.1855 -6.1853 0.7162 0.7308 1.6448 1.7385 1.8308 1.9005 2.2252 2.2465 2.9334 3.0085 3.0936 3.1578 4.2497 4.2820 4.3033 4.3409 4.4439 4.4475 4.5280 4.5341 4.8594 4.8670 8.7904 8.7944 k = 0.2083 0.0896 1.2659 ( 6272 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4086 -7.4060 -7.3305 -7.3278 -7.1439 -7.1435 -6.3544 -6.3536 -6.1855 -6.1853 0.7160 0.7312 1.6426 1.7405 1.8294 1.9021 2.2248 2.2471 2.9320 3.0116 3.0905 3.1586 4.2495 4.2859 4.2991 4.3411 4.4439 4.4476 4.5278 4.5341 4.8593 4.8673 8.8467 8.8509 k = 0.2292 0.0985 1.2659 ( 6288 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4087 -7.4060 -7.3305 -7.3277 -7.1439 -7.1435 -6.3544 -6.3536 -6.1855 -6.1853 0.7158 0.7315 1.6413 1.7417 1.8286 1.9031 2.2246 2.2475 2.9312 3.0136 3.0885 3.1591 4.2492 4.2898 4.2948 4.3411 4.4438 4.4477 4.5275 4.5340 4.8593 4.8674 8.8960 8.9002 k = 0.2500 0.1075 1.2659 ( 6284 PWs) bands (ev): -74.4113 -74.4113 -44.0283 -44.0283 -42.8290 -42.8290 -42.6775 -42.6775 -22.3405 -22.3405 -7.4087 -7.4059 -7.3305 -7.3277 -7.1439 -7.1435 -6.3544 -6.3536 -6.1855 -6.1853 0.7158 0.7315 1.6409 1.7421 1.8283 1.9035 2.2245 2.2477 2.9309 3.0142 3.0878 3.1593 4.2491 4.2906 4.2940 4.3413 4.4438 4.4477 4.5275 4.5340 4.8592 4.8674 8.9183 8.9225 Writing output data file RbMnSe2.save init_run : 5.52s CPU 12.87s WALL ( 1 calls) electrons : 1214.67s CPU 1226.54s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.61s CPU 1.77s WALL ( 1 calls) Called by electrons: c_bands : 1214.65s CPU 1226.34s WALL ( 1 calls) v_of_rho : 0.30s CPU 1.10s WALL ( 1 calls) v_h : 0.02s CPU 0.02s WALL ( 1 calls) v_xc : 0.27s CPU 0.73s WALL ( 1 calls) newd : 0.79s CPU 0.95s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.30s WALL ( 323 calls) cegterg : 1133.39s CPU 1141.31s WALL ( 755 calls) Called by sum_band: Called by *egterg: h_psi : 921.55s CPU 933.58s WALL ( 13244 calls) s_psi : 17.03s CPU 17.27s WALL ( 13244 calls) g_psi : 0.78s CPU 0.85s WALL ( 12166 calls) cdiaghg : 153.13s CPU 150.38s WALL ( 12489 calls) cegterg:over : 49.89s CPU 47.66s WALL ( 12166 calls) cegterg:upda : 10.29s CPU 13.78s WALL ( 12166 calls) cegterg:last : 9.80s CPU 10.58s WALL ( 2047 calls) Called by h_psi: h_psi:vloc : 882.41s CPU 893.06s WALL ( 13244 calls) h_psi:vnl : 38.69s CPU 39.53s WALL ( 13244 calls) add_vuspsi : 10.72s CPU 13.92s WALL ( 13244 calls) General routines calbec : 27.92s CPU 25.49s WALL ( 13244 calls) fft : 0.36s CPU 1.44s WALL ( 19 calls) ffts : 0.01s CPU 0.09s WALL ( 4 calls) fftw : 564.25s CPU 565.37s WALL ( 1067196 calls) interpolate : 0.06s CPU 0.16s WALL ( 4 calls) davcio : 0.03s CPU 1.80s WALL ( 646 calls) Parallel routines fft_scatter : 299.67s CPU 297.04s WALL ( 1067219 calls) PWSCF : 21m15.92s CPU 23m54.77s WALL This run was terminated on: 0:30:13 21Jun2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=