Program PWSCF v.5.1.1 starts on 27Jul2015 at 20:18:31 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 32 processors R & G space division: proc/nbgrp/npool/nimage = 32 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: ./CrBr3.save/ file Cr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3P 3P renormalized file Br.rel-pbe-n-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 161 70 19 7162 2048 304 Max 162 71 20 7165 2088 307 Sum 5157 2247 623 229213 66255 9771 bravais-lattice index = 14 lattice parameter (alat) = 13.3446 a.u. unit-cell volume = 1389.3957 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 70.00 number of Kohn-Sham states= 84 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 457.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 13.344594 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.607079 celldm(5)= 0.607079 celldm(6)= 0.607079 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.607079 0.794642 0.000000 ) a(3) = ( 0.607079 0.300178 0.735764 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.763965 -0.513416 ) b(2) = ( 0.000000 1.258429 -0.513416 ) b(3) = ( 0.000000 0.000000 1.359132 ) PseudoPot. # 1 for Cr read from file: /home/autes/Pseudo/Cr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 5eb7f017135fb502322d448d1515490d Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1183 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 Br read from file: /home/autes/Pseudo/Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5d639767687de88634f0d235e6526498 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1213 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Cr 14.00 51.99610 Cr( 1.00) Br 7.00 79.90400 Br( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 222 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045045 k( 2) = ( 0.0161290 -0.0123220 -0.0082809), wk = 0.0045045 k( 3) = ( 0.0322581 -0.0246440 -0.0165618), wk = 0.0045045 k( 4) = ( 0.0483871 -0.0369661 -0.0248427), wk = 0.0045045 k( 5) = ( 0.0645161 -0.0492881 -0.0331236), wk = 0.0045045 k( 6) = ( 0.0806452 -0.0616101 -0.0414045), wk = 0.0045045 k( 7) = ( 0.0967742 -0.0739321 -0.0496854), wk = 0.0045045 k( 8) = ( 0.1129032 -0.0862541 -0.0579663), wk = 0.0045045 k( 9) = ( 0.1290323 -0.0985762 -0.0662472), wk = 0.0045045 k( 10) = ( 0.1451613 -0.1108982 -0.0745281), wk = 0.0045045 k( 11) = ( 0.1612903 -0.1232202 -0.0828090), wk = 0.0045045 k( 12) = ( 0.1774194 -0.1355422 -0.0910899), wk = 0.0045045 k( 13) = ( 0.1935484 -0.1478642 -0.0993708), wk = 0.0045045 k( 14) = ( 0.2096774 -0.1601863 -0.1076517), wk = 0.0045045 k( 15) = ( 0.2258064 -0.1725083 -0.1159326), wk = 0.0045045 k( 16) = ( 0.2419355 -0.1848303 -0.1242135), wk = 0.0045045 k( 17) = ( 0.2580645 -0.1971523 -0.1324944), wk = 0.0045045 k( 18) = ( 0.2741936 -0.2094743 -0.1407753), wk = 0.0045045 k( 19) = ( 0.2903226 -0.2217964 -0.1490562), wk = 0.0045045 k( 20) = ( 0.3064516 -0.2341184 -0.1573371), wk = 0.0045045 k( 21) = ( 0.3225807 -0.2464404 -0.1656180), wk = 0.0045045 k( 22) = ( 0.3387097 -0.2587624 -0.1738989), wk = 0.0045045 k( 23) = ( 0.3548387 -0.2710844 -0.1821799), wk = 0.0045045 k( 24) = ( 0.3709677 -0.2834064 -0.1904608), wk = 0.0045045 k( 25) = ( 0.3870968 -0.2957285 -0.1987417), wk = 0.0045045 k( 26) = ( 0.4032258 -0.3080505 -0.2070226), wk = 0.0045045 k( 27) = ( 0.4193548 -0.3203725 -0.2153035), wk = 0.0045045 k( 28) = ( 0.4354839 -0.3326945 -0.2235844), wk = 0.0045045 k( 29) = ( 0.4516129 -0.3450165 -0.2318653), wk = 0.0045045 k( 30) = ( 0.4677419 -0.3573386 -0.2401462), wk = 0.0045045 k( 31) = ( 0.4838710 -0.3696606 -0.2484271), wk = 0.0045045 k( 32) = ( 0.5000000 -0.3819826 -0.2567080), wk = 0.0045045 k( 33) = ( 0.5000000 -0.3819826 -0.2567080), wk = 0.0045045 k( 34) = ( 0.5000000 -0.3696271 -0.2750931), wk = 0.0045045 k( 35) = ( 0.5000000 -0.3572715 -0.2934782), wk = 0.0045045 k( 36) = ( 0.5000000 -0.3449159 -0.3118633), wk = 0.0045045 k( 37) = ( 0.5000000 -0.3325604 -0.3302485), wk = 0.0045045 k( 38) = ( 0.5000000 -0.3202048 -0.3486336), wk = 0.0045045 k( 39) = ( 0.5000000 -0.3078493 -0.3670187), wk = 0.0045045 k( 40) = ( 0.5000000 -0.2954937 -0.3854038), wk = 0.0045045 k( 41) = ( 0.5000000 -0.2831382 -0.4037890), wk = 0.0045045 k( 42) = ( 0.5000000 -0.2707826 -0.4221741), wk = 0.0045045 k( 43) = ( 0.5000000 -0.2584270 -0.4405592), wk = 0.0045045 k( 44) = ( 0.5000000 -0.2460715 -0.4589443), wk = 0.0045045 k( 45) = ( 0.5000000 -0.2337159 -0.4773294), wk = 0.0045045 k( 46) = ( 0.5000000 -0.2213604 -0.4957146), wk = 0.0045045 k( 47) = ( 0.5000000 -0.2090048 -0.5140997), wk = 0.0045045 k( 48) = ( 0.5000000 -0.1966493 -0.5324848), wk = 0.0045045 k( 49) = ( 0.5000000 -0.1842937 -0.5508700), wk = 0.0045045 k( 50) = ( 0.5000000 -0.1719381 -0.5692551), wk = 0.0045045 k( 51) = ( 0.5000000 -0.1595826 -0.5876402), wk = 0.0045045 k( 52) = ( 0.5000000 -0.1472270 -0.6060253), wk = 0.0045045 k( 53) = ( 0.5000000 -0.1348715 -0.6244104), wk = 0.0045045 k( 54) = ( 0.5000000 -0.1225159 -0.6427956), wk = 0.0045045 k( 55) = ( 0.5000000 -0.1101604 -0.6611807), wk = 0.0045045 k( 56) = ( 0.5000000 -0.0978048 -0.6795658), wk = 0.0045045 k( 57) = ( 0.7741805 0.0377674 -0.3472661), wk = 0.0045045 k( 58) = ( 0.7643883 0.0452483 -0.3289298), wk = 0.0045045 k( 59) = ( 0.7545961 0.0527292 -0.3105935), wk = 0.0045045 k( 60) = ( 0.7448040 0.0602100 -0.2922572), wk = 0.0045045 k( 61) = ( 0.7350118 0.0676909 -0.2739209), wk = 0.0045045 k( 62) = ( 0.7252197 0.0751718 -0.2555847), wk = 0.0045045 k( 63) = ( 0.7154275 0.0826526 -0.2372484), wk = 0.0045045 k( 64) = ( 0.7056353 0.0901335 -0.2189121), wk = 0.0045045 k( 65) = ( 0.6958432 0.0976144 -0.2005758), wk = 0.0045045 k( 66) = ( 0.6860510 0.1050952 -0.1822395), wk = 0.0045045 k( 67) = ( 0.6762589 0.1125761 -0.1639032), wk = 0.0045045 k( 68) = ( 0.6664667 0.1200570 -0.1455669), wk = 0.0045045 k( 69) = ( 0.6566745 0.1275379 -0.1272307), wk = 0.0045045 k( 70) = ( 0.6468824 0.1350187 -0.1088944), wk = 0.0045045 k( 71) = ( 0.6370902 0.1424996 -0.0905581), wk = 0.0045045 k( 72) = ( 0.6272981 0.1499805 -0.0722218), wk = 0.0045045 k( 73) = ( 0.6175059 0.1574613 -0.0538855), wk = 0.0045045 k( 74) = ( 0.6077138 0.1649422 -0.0355492), wk = 0.0045045 k( 75) = ( 0.5979216 0.1724231 -0.0172130), wk = 0.0045045 k( 76) = ( 0.5881294 0.1799039 0.0011233), wk = 0.0045045 k( 77) = ( 0.5783373 0.1873848 0.0194596), wk = 0.0045045 k( 78) = ( 0.5685451 0.1948657 0.0377959), wk = 0.0045045 k( 79) = ( 0.5587530 0.2023465 0.0561322), wk = 0.0045045 k( 80) = ( 0.5489608 0.2098274 0.0744684), wk = 0.0045045 k( 81) = ( 0.5391686 0.2173083 0.0928047), wk = 0.0045045 k( 82) = ( 0.5293765 0.2247891 0.1111410), wk = 0.0045045 k( 83) = ( 0.5195843 0.2322700 0.1294773), wk = 0.0045045 k( 84) = ( 0.5097922 0.2397509 0.1478136), wk = 0.0045045 k( 85) = ( 0.5000000 0.2472318 0.1661499), wk = 0.0045045 k( 86) = ( 0.5000000 0.2472318 0.1661499), wk = 0.0045045 k( 87) = ( 0.4807692 0.2377228 0.1597595), wk = 0.0045045 k( 88) = ( 0.4615385 0.2282139 0.1533691), wk = 0.0045045 k( 89) = ( 0.4423077 0.2187050 0.1469787), wk = 0.0045045 k( 90) = ( 0.4230769 0.2091961 0.1405884), wk = 0.0045045 k( 91) = ( 0.4038462 0.1996872 0.1341980), wk = 0.0045045 k( 92) = ( 0.3846154 0.1901783 0.1278076), wk = 0.0045045 k( 93) = ( 0.3653846 0.1806694 0.1214172), wk = 0.0045045 k( 94) = ( 0.3461538 0.1711604 0.1150268), wk = 0.0045045 k( 95) = ( 0.3269231 0.1616515 0.1086365), wk = 0.0045045 k( 96) = ( 0.3076923 0.1521426 0.1022461), wk = 0.0045045 k( 97) = ( 0.2884615 0.1426337 0.0958557), wk = 0.0045045 k( 98) = ( 0.2692308 0.1331248 0.0894653), wk = 0.0045045 k( 99) = ( 0.2500000 0.1236159 0.0830749), wk = 0.0045045 k( 100) = ( 0.2307692 0.1141070 0.0766846), wk = 0.0045045 k( 101) = ( 0.2115385 0.1045980 0.0702942), wk = 0.0045045 k( 102) = ( 0.1923077 0.0950891 0.0639038), wk = 0.0045045 k( 103) = ( 0.1730769 0.0855802 0.0575134), wk = 0.0045045 k( 104) = ( 0.1538461 0.0760713 0.0511230), wk = 0.0045045 k( 105) = ( 0.1346154 0.0665624 0.0447327), wk = 0.0045045 k( 106) = ( 0.1153846 0.0570535 0.0383423), wk = 0.0045045 k( 107) = ( 0.0961538 0.0475446 0.0319519), wk = 0.0045045 k( 108) = ( 0.0769231 0.0380357 0.0255615), wk = 0.0045045 k( 109) = ( 0.0576923 0.0285267 0.0191711), wk = 0.0045045 k( 110) = ( 0.0384615 0.0190178 0.0127808), wk = 0.0045045 k( 111) = ( 0.0192308 0.0095089 0.0063904), wk = 0.0045045 k( 112) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045045 k( 113) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045045 k( 114) = ( 0.0098084 -0.0074933 -0.0183666), wk = 0.0045045 k( 115) = ( 0.0196167 -0.0149865 -0.0367333), wk = 0.0045045 k( 116) = ( 0.0294251 -0.0224798 -0.0550999), wk = 0.0045045 k( 117) = ( 0.0392335 -0.0299730 -0.0734666), wk = 0.0045045 k( 118) = ( 0.0490419 -0.0374663 -0.0918332), wk = 0.0045045 k( 119) = ( 0.0588502 -0.0449595 -0.1101999), wk = 0.0045045 k( 120) = ( 0.0686586 -0.0524528 -0.1285665), wk = 0.0045045 k( 121) = ( 0.0784670 -0.0599460 -0.1469332), wk = 0.0045045 k( 122) = ( 0.0882754 -0.0674393 -0.1652998), wk = 0.0045045 k( 123) = ( 0.0980837 -0.0749326 -0.1836664), wk = 0.0045045 k( 124) = ( 0.1078921 -0.0824258 -0.2020331), wk = 0.0045045 k( 125) = ( 0.1177005 -0.0899191 -0.2203997), wk = 0.0045045 k( 126) = ( 0.1275088 -0.0974123 -0.2387664), wk = 0.0045045 k( 127) = ( 0.1373172 -0.1049056 -0.2571330), wk = 0.0045045 k( 128) = ( 0.1471256 -0.1123988 -0.2754996), wk = 0.0045045 k( 129) = ( 0.1569340 -0.1198921 -0.2938663), wk = 0.0045045 k( 130) = ( 0.1667423 -0.1273853 -0.3122329), wk = 0.0045045 k( 131) = ( 0.1765507 -0.1348786 -0.3305996), wk = 0.0045045 k( 132) = ( 0.1863591 -0.1423718 -0.3489662), wk = 0.0045045 k( 133) = ( 0.1961674 -0.1498651 -0.3673329), wk = 0.0045045 k( 134) = ( 0.2059758 -0.1573584 -0.3856995), wk = 0.0045045 k( 135) = ( 0.2157842 -0.1648516 -0.4040662), wk = 0.0045045 k( 136) = ( 0.2255926 -0.1723449 -0.4224328), wk = 0.0045045 k( 137) = ( 0.2354009 -0.1798381 -0.4407994), wk = 0.0045045 k( 138) = ( 0.2452093 -0.1873314 -0.4591661), wk = 0.0045045 k( 139) = ( 0.2550177 -0.1948246 -0.4775327), wk = 0.0045045 k( 140) = ( 0.2648260 -0.2023179 -0.4958994), wk = 0.0045045 k( 141) = ( 0.2746344 -0.2098111 -0.5142660), wk = 0.0045045 k( 142) = ( 0.2844428 -0.2173044 -0.5326327), wk = 0.0045045 k( 143) = ( 0.2942512 -0.2247977 -0.5509993), wk = 0.0045045 k( 144) = ( 0.3040595 -0.2322909 -0.5693660), wk = 0.0045045 k( 145) = ( 0.3138679 -0.2397842 -0.5877326), wk = 0.0045045 k( 146) = ( 0.3236763 -0.2472774 -0.6060992), wk = 0.0045045 k( 147) = ( 0.3334847 -0.2547707 -0.6244659), wk = 0.0045045 k( 148) = ( 0.3432930 -0.2622639 -0.6428325), wk = 0.0045045 k( 149) = ( 0.3531014 -0.2697572 -0.6611992), wk = 0.0045045 k( 150) = ( 0.3629098 -0.2772504 -0.6795658), wk = 0.0045045 k( 151) = ( 0.6370902 -0.0300187 -0.5134159), wk = 0.0045045 k( 152) = ( 0.6272981 -0.0102151 -0.5134159), wk = 0.0045045 k( 153) = ( 0.6175059 0.0095885 -0.5134159), wk = 0.0045045 k( 154) = ( 0.6077138 0.0293921 -0.5134159), wk = 0.0045045 k( 155) = ( 0.5979216 0.0491957 -0.5134159), wk = 0.0045045 k( 156) = ( 0.5881294 0.0689993 -0.5134159), wk = 0.0045045 k( 157) = ( 0.5783373 0.0888029 -0.5134159), wk = 0.0045045 k( 158) = ( 0.5685451 0.1086065 -0.5134159), wk = 0.0045045 k( 159) = ( 0.5587530 0.1284101 -0.5134159), wk = 0.0045045 k( 160) = ( 0.5489608 0.1482137 -0.5134159), wk = 0.0045045 k( 161) = ( 0.5391686 0.1680173 -0.5134159), wk = 0.0045045 k( 162) = ( 0.5293765 0.1878209 -0.5134159), wk = 0.0045045 k( 163) = ( 0.5195843 0.2076245 -0.5134159), wk = 0.0045045 k( 164) = ( 0.5097922 0.2274281 -0.5134159), wk = 0.0045045 k( 165) = ( 0.5000000 0.2472318 -0.5134159), wk = 0.0045045 k( 166) = ( 0.5000000 0.2472318 -0.5134159), wk = 0.0045045 k( 167) = ( 0.5124627 0.2533941 -0.4983114), wk = 0.0045045 k( 168) = ( 0.5249255 0.2595565 -0.4832069), wk = 0.0045045 k( 169) = ( 0.5373882 0.2657189 -0.4681023), wk = 0.0045045 k( 170) = ( 0.5498510 0.2718812 -0.4529978), wk = 0.0045045 k( 171) = ( 0.5623137 0.2780436 -0.4378933), wk = 0.0045045 k( 172) = ( 0.5747765 0.2842060 -0.4227887), wk = 0.0045045 k( 173) = ( 0.5872392 0.2903684 -0.4076842), wk = 0.0045045 k( 174) = ( 0.5997020 0.2965307 -0.3925797), wk = 0.0045045 k( 175) = ( 0.6121647 0.3026931 -0.3774751), wk = 0.0045045 k( 176) = ( 0.6246275 0.3088555 -0.3623706), wk = 0.0045045 k( 177) = ( 0.6370902 0.3150179 -0.3472661), wk = 0.0045045 k( 178) = ( 0.6370902 0.3150179 -0.3472661), wk = 0.0045045 k( 179) = ( 0.6313781 0.3121934 -0.3258737), wk = 0.0045045 k( 180) = ( 0.6256660 0.3093690 -0.3044814), wk = 0.0045045 k( 181) = ( 0.6199539 0.3065446 -0.2830891), wk = 0.0045045 k( 182) = ( 0.6142419 0.3037202 -0.2616967), wk = 0.0045045 k( 183) = ( 0.6085298 0.3008958 -0.2403044), wk = 0.0045045 k( 184) = ( 0.6028177 0.2980713 -0.2189121), wk = 0.0045045 k( 185) = ( 0.5971056 0.2952469 -0.1975197), wk = 0.0045045 k( 186) = ( 0.5913935 0.2924225 -0.1761274), wk = 0.0045045 k( 187) = ( 0.5856814 0.2895981 -0.1547351), wk = 0.0045045 k( 188) = ( 0.5799693 0.2867737 -0.1333428), wk = 0.0045045 k( 189) = ( 0.5742572 0.2839492 -0.1119504), wk = 0.0045045 k( 190) = ( 0.5685451 0.2811248 -0.0905581), wk = 0.0045045 k( 191) = ( 0.5628330 0.2783004 -0.0691658), wk = 0.0045045 k( 192) = ( 0.5571209 0.2754760 -0.0477734), wk = 0.0045045 k( 193) = ( 0.5514088 0.2726515 -0.0263811), wk = 0.0045045 k( 194) = ( 0.5456967 0.2698271 -0.0049888), wk = 0.0045045 k( 195) = ( 0.5399846 0.2670027 0.0164036), wk = 0.0045045 k( 196) = ( 0.5342726 0.2641783 0.0377959), wk = 0.0045045 k( 197) = ( 0.5285605 0.2613539 0.0591882), wk = 0.0045045 k( 198) = ( 0.5228484 0.2585294 0.0805806), wk = 0.0045045 k( 199) = ( 0.5171363 0.2557050 0.1019729), wk = 0.0045045 k( 200) = ( 0.5114242 0.2528806 0.1233652), wk = 0.0045045 k( 201) = ( 0.5057121 0.2500562 0.1447575), wk = 0.0045045 k( 202) = ( 0.5000000 0.2472318 0.1661499), wk = 0.0045045 k( 203) = ( 0.5000000 -0.3819826 -0.2567080), wk = 0.0045045 k( 204) = ( 0.5144306 -0.3689704 -0.2479632), wk = 0.0045045 k( 205) = ( 0.5288611 -0.3559582 -0.2392185), wk = 0.0045045 k( 206) = ( 0.5432917 -0.3429460 -0.2304738), wk = 0.0045045 k( 207) = ( 0.5577222 -0.3299338 -0.2217290), wk = 0.0045045 k( 208) = ( 0.5721527 -0.3169216 -0.2129843), wk = 0.0045045 k( 209) = ( 0.5865833 -0.3039094 -0.2042396), wk = 0.0045045 k( 210) = ( 0.6010138 -0.2908972 -0.1954949), wk = 0.0045045 k( 211) = ( 0.6154444 -0.2778850 -0.1867501), wk = 0.0045045 k( 212) = ( 0.6298750 -0.2648728 -0.1780054), wk = 0.0045045 k( 213) = ( 0.6443055 -0.2518606 -0.1692607), wk = 0.0045045 k( 214) = ( 0.6587361 -0.2388484 -0.1605159), wk = 0.0045045 k( 215) = ( 0.6731666 -0.2258362 -0.1517712), wk = 0.0045045 k( 216) = ( 0.6875971 -0.2128240 -0.1430265), wk = 0.0045045 k( 217) = ( 0.7020277 -0.1998118 -0.1342817), wk = 0.0045045 k( 218) = ( 0.7164582 -0.1867996 -0.1255370), wk = 0.0045045 k( 219) = ( 0.7308888 -0.1737874 -0.1167923), wk = 0.0045045 k( 220) = ( 0.7453194 -0.1607753 -0.1080476), wk = 0.0045045 k( 221) = ( 0.7597499 -0.1477630 -0.0993028), wk = 0.0045045 k( 222) = ( 0.7741805 -0.1347509 -0.0905581), wk = 0.0045045 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045045 k( 2) = ( 0.0161290 0.0000000 0.0000000), wk = 0.0045045 k( 3) = ( 0.0322581 0.0000000 0.0000000), wk = 0.0045045 k( 4) = ( 0.0483871 0.0000000 0.0000000), wk = 0.0045045 k( 5) = ( 0.0645161 0.0000000 0.0000000), wk = 0.0045045 k( 6) = ( 0.0806452 0.0000000 0.0000000), wk = 0.0045045 k( 7) = ( 0.0967742 0.0000000 -0.0000000), wk = 0.0045045 k( 8) = ( 0.1129032 -0.0000000 0.0000000), wk = 0.0045045 k( 9) = ( 0.1290323 0.0000000 0.0000000), wk = 0.0045045 k( 10) = ( 0.1451613 0.0000000 0.0000000), wk = 0.0045045 k( 11) = ( 0.1612903 0.0000000 0.0000000), wk = 0.0045045 k( 12) = ( 0.1774194 0.0000000 -0.0000000), wk = 0.0045045 k( 13) = ( 0.1935484 0.0000000 0.0000000), wk = 0.0045045 k( 14) = ( 0.2096774 0.0000000 -0.0000000), wk = 0.0045045 k( 15) = ( 0.2258064 0.0000000 -0.0000000), wk = 0.0045045 k( 16) = ( 0.2419355 0.0000000 0.0000000), wk = 0.0045045 k( 17) = ( 0.2580645 0.0000000 0.0000000), wk = 0.0045045 k( 18) = ( 0.2741936 0.0000000 0.0000000), wk = 0.0045045 k( 19) = ( 0.2903226 0.0000000 0.0000000), wk = 0.0045045 k( 20) = ( 0.3064516 0.0000000 0.0000000), wk = 0.0045045 k( 21) = ( 0.3225807 0.0000000 0.0000000), wk = 0.0045045 k( 22) = ( 0.3387097 0.0000000 0.0000000), wk = 0.0045045 k( 23) = ( 0.3548387 0.0000000 0.0000000), wk = 0.0045045 k( 24) = ( 0.3709677 0.0000000 0.0000000), wk = 0.0045045 k( 25) = ( 0.3870968 0.0000000 0.0000000), wk = 0.0045045 k( 26) = ( 0.4032258 0.0000000 0.0000000), wk = 0.0045045 k( 27) = ( 0.4193548 0.0000000 -0.0000000), wk = 0.0045045 k( 28) = ( 0.4354839 0.0000000 -0.0000000), wk = 0.0045045 k( 29) = ( 0.4516129 0.0000000 -0.0000000), wk = 0.0045045 k( 30) = ( 0.4677419 0.0000000 -0.0000000), wk = 0.0045045 k( 31) = ( 0.4838710 0.0000000 0.0000000), wk = 0.0045045 k( 32) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0045045 k( 33) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0045045 k( 34) = ( 0.5000000 0.0098182 -0.0098182), wk = 0.0045045 k( 35) = ( 0.5000000 0.0196365 -0.0196365), wk = 0.0045045 k( 36) = ( 0.5000000 0.0294547 -0.0294547), wk = 0.0045045 k( 37) = ( 0.5000000 0.0392730 -0.0392730), wk = 0.0045045 k( 38) = ( 0.5000000 0.0490912 -0.0490912), wk = 0.0045045 k( 39) = ( 0.5000000 0.0589095 -0.0589094), wk = 0.0045045 k( 40) = ( 0.5000000 0.0687277 -0.0687277), wk = 0.0045045 k( 41) = ( 0.5000000 0.0785459 -0.0785459), wk = 0.0045045 k( 42) = ( 0.5000000 0.0883642 -0.0883642), wk = 0.0045045 k( 43) = ( 0.5000000 0.0981824 -0.0981824), wk = 0.0045045 k( 44) = ( 0.5000000 0.1080007 -0.1080006), wk = 0.0045045 k( 45) = ( 0.5000000 0.1178189 -0.1178189), wk = 0.0045045 k( 46) = ( 0.5000000 0.1276371 -0.1276371), wk = 0.0045045 k( 47) = ( 0.5000000 0.1374554 -0.1374554), wk = 0.0045045 k( 48) = ( 0.5000000 0.1472736 -0.1472736), wk = 0.0045045 k( 49) = ( 0.5000000 0.1570919 -0.1570919), wk = 0.0045045 k( 50) = ( 0.5000000 0.1669101 -0.1669101), wk = 0.0045045 k( 51) = ( 0.5000000 0.1767283 -0.1767283), wk = 0.0045045 k( 52) = ( 0.5000000 0.1865466 -0.1865466), wk = 0.0045045 k( 53) = ( 0.5000000 0.1963648 -0.1963648), wk = 0.0045045 k( 54) = ( 0.5000000 0.2061831 -0.2061831), wk = 0.0045045 k( 55) = ( 0.5000000 0.2160013 -0.2160013), wk = 0.0045045 k( 56) = ( 0.5000000 0.2258196 -0.2258196), wk = 0.0045045 k( 57) = ( 0.7741805 0.5000000 0.2258196), wk = 0.0045045 k( 58) = ( 0.7643883 0.5000000 0.2356117), wk = 0.0045045 k( 59) = ( 0.7545961 0.5000000 0.2454039), wk = 0.0045045 k( 60) = ( 0.7448040 0.5000000 0.2551960), wk = 0.0045045 k( 61) = ( 0.7350118 0.5000000 0.2649882), wk = 0.0045045 k( 62) = ( 0.7252197 0.5000000 0.2747803), wk = 0.0045045 k( 63) = ( 0.7154275 0.5000000 0.2845725), wk = 0.0045045 k( 64) = ( 0.7056353 0.5000000 0.2943647), wk = 0.0045045 k( 65) = ( 0.6958432 0.5000000 0.3041568), wk = 0.0045045 k( 66) = ( 0.6860510 0.5000000 0.3139490), wk = 0.0045045 k( 67) = ( 0.6762589 0.5000000 0.3237411), wk = 0.0045045 k( 68) = ( 0.6664667 0.5000000 0.3335333), wk = 0.0045045 k( 69) = ( 0.6566745 0.5000000 0.3433255), wk = 0.0045045 k( 70) = ( 0.6468824 0.5000000 0.3531176), wk = 0.0045045 k( 71) = ( 0.6370902 0.5000000 0.3629098), wk = 0.0045045 k( 72) = ( 0.6272981 0.5000000 0.3727019), wk = 0.0045045 k( 73) = ( 0.6175059 0.5000000 0.3824941), wk = 0.0045045 k( 74) = ( 0.6077138 0.5000000 0.3922862), wk = 0.0045045 k( 75) = ( 0.5979216 0.5000000 0.4020784), wk = 0.0045045 k( 76) = ( 0.5881294 0.5000000 0.4118706), wk = 0.0045045 k( 77) = ( 0.5783373 0.5000000 0.4216627), wk = 0.0045045 k( 78) = ( 0.5685451 0.5000000 0.4314549), wk = 0.0045045 k( 79) = ( 0.5587530 0.5000000 0.4412470), wk = 0.0045045 k( 80) = ( 0.5489608 0.5000000 0.4510392), wk = 0.0045045 k( 81) = ( 0.5391686 0.5000000 0.4608314), wk = 0.0045045 k( 82) = ( 0.5293765 0.5000000 0.4706235), wk = 0.0045045 k( 83) = ( 0.5195843 0.5000000 0.4804157), wk = 0.0045045 k( 84) = ( 0.5097922 0.5000000 0.4902078), wk = 0.0045045 k( 85) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045045 k( 86) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045045 k( 87) = ( 0.4807692 0.4807692 0.4807692), wk = 0.0045045 k( 88) = ( 0.4615385 0.4615385 0.4615385), wk = 0.0045045 k( 89) = ( 0.4423077 0.4423077 0.4423077), wk = 0.0045045 k( 90) = ( 0.4230769 0.4230769 0.4230769), wk = 0.0045045 k( 91) = ( 0.4038462 0.4038462 0.4038462), wk = 0.0045045 k( 92) = ( 0.3846154 0.3846154 0.3846154), wk = 0.0045045 k( 93) = ( 0.3653846 0.3653846 0.3653846), wk = 0.0045045 k( 94) = ( 0.3461538 0.3461538 0.3461538), wk = 0.0045045 k( 95) = ( 0.3269231 0.3269231 0.3269231), wk = 0.0045045 k( 96) = ( 0.3076923 0.3076923 0.3076923), wk = 0.0045045 k( 97) = ( 0.2884615 0.2884615 0.2884615), wk = 0.0045045 k( 98) = ( 0.2692308 0.2692308 0.2692308), wk = 0.0045045 k( 99) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0045045 k( 100) = ( 0.2307692 0.2307692 0.2307692), wk = 0.0045045 k( 101) = ( 0.2115385 0.2115385 0.2115385), wk = 0.0045045 k( 102) = ( 0.1923077 0.1923077 0.1923077), wk = 0.0045045 k( 103) = ( 0.1730769 0.1730769 0.1730769), wk = 0.0045045 k( 104) = ( 0.1538461 0.1538462 0.1538462), wk = 0.0045045 k( 105) = ( 0.1346154 0.1346154 0.1346154), wk = 0.0045045 k( 106) = ( 0.1153846 0.1153846 0.1153846), wk = 0.0045045 k( 107) = ( 0.0961538 0.0961539 0.0961538), wk = 0.0045045 k( 108) = ( 0.0769231 0.0769231 0.0769231), wk = 0.0045045 k( 109) = ( 0.0576923 0.0576923 0.0576923), wk = 0.0045045 k( 110) = ( 0.0384615 0.0384615 0.0384615), wk = 0.0045045 k( 111) = ( 0.0192308 0.0192308 0.0192308), wk = 0.0045045 k( 112) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045045 k( 113) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045045 k( 114) = ( 0.0098084 0.0000000 -0.0098084), wk = 0.0045045 k( 115) = ( 0.0196167 0.0000000 -0.0196167), wk = 0.0045045 k( 116) = ( 0.0294251 0.0000000 -0.0294251), wk = 0.0045045 k( 117) = ( 0.0392335 0.0000000 -0.0392335), wk = 0.0045045 k( 118) = ( 0.0490419 0.0000000 -0.0490419), wk = 0.0045045 k( 119) = ( 0.0588502 0.0000000 -0.0588502), wk = 0.0045045 k( 120) = ( 0.0686586 0.0000000 -0.0686586), wk = 0.0045045 k( 121) = ( 0.0784670 0.0000000 -0.0784670), wk = 0.0045045 k( 122) = ( 0.0882754 0.0000000 -0.0882753), wk = 0.0045045 k( 123) = ( 0.0980837 0.0000000 -0.0980837), wk = 0.0045045 k( 124) = ( 0.1078921 0.0000000 -0.1078921), wk = 0.0045045 k( 125) = ( 0.1177005 0.0000000 -0.1177005), wk = 0.0045045 k( 126) = ( 0.1275088 0.0000000 -0.1275088), wk = 0.0045045 k( 127) = ( 0.1373172 0.0000000 -0.1373172), wk = 0.0045045 k( 128) = ( 0.1471256 0.0000000 -0.1471256), wk = 0.0045045 k( 129) = ( 0.1569340 0.0000000 -0.1569340), wk = 0.0045045 k( 130) = ( 0.1667423 0.0000000 -0.1667423), wk = 0.0045045 k( 131) = ( 0.1765507 0.0000000 -0.1765507), wk = 0.0045045 k( 132) = ( 0.1863591 0.0000000 -0.1863591), wk = 0.0045045 k( 133) = ( 0.1961674 0.0000000 -0.1961674), wk = 0.0045045 k( 134) = ( 0.2059758 0.0000000 -0.2059758), wk = 0.0045045 k( 135) = ( 0.2157842 0.0000000 -0.2157842), wk = 0.0045045 k( 136) = ( 0.2255926 0.0000000 -0.2255926), wk = 0.0045045 k( 137) = ( 0.2354009 0.0000000 -0.2354009), wk = 0.0045045 k( 138) = ( 0.2452093 0.0000000 -0.2452093), wk = 0.0045045 k( 139) = ( 0.2550177 0.0000000 -0.2550177), wk = 0.0045045 k( 140) = ( 0.2648260 0.0000000 -0.2648260), wk = 0.0045045 k( 141) = ( 0.2746344 0.0000000 -0.2746344), wk = 0.0045045 k( 142) = ( 0.2844428 0.0000000 -0.2844428), wk = 0.0045045 k( 143) = ( 0.2942512 0.0000000 -0.2942512), wk = 0.0045045 k( 144) = ( 0.3040595 0.0000000 -0.3040595), wk = 0.0045045 k( 145) = ( 0.3138679 0.0000000 -0.3138679), wk = 0.0045045 k( 146) = ( 0.3236763 0.0000000 -0.3236763), wk = 0.0045045 k( 147) = ( 0.3334847 0.0000000 -0.3334847), wk = 0.0045045 k( 148) = ( 0.3432930 0.0000000 -0.3432930), wk = 0.0045045 k( 149) = ( 0.3531014 0.0000000 -0.3531014), wk = 0.0045045 k( 150) = ( 0.3629098 0.0000000 -0.3629098), wk = 0.0045045 k( 151) = ( 0.6370902 0.3629098 0.0000000), wk = 0.0045045 k( 152) = ( 0.6272981 0.3727019 0.0000000), wk = 0.0045045 k( 153) = ( 0.6175059 0.3824941 -0.0000000), wk = 0.0045045 k( 154) = ( 0.6077138 0.3922863 0.0000000), wk = 0.0045045 k( 155) = ( 0.5979216 0.4020784 0.0000000), wk = 0.0045045 k( 156) = ( 0.5881294 0.4118706 -0.0000000), wk = 0.0045045 k( 157) = ( 0.5783373 0.4216627 0.0000000), wk = 0.0045045 k( 158) = ( 0.5685451 0.4314549 0.0000000), wk = 0.0045045 k( 159) = ( 0.5587530 0.4412470 0.0000000), wk = 0.0045045 k( 160) = ( 0.5489608 0.4510392 -0.0000000), wk = 0.0045045 k( 161) = ( 0.5391686 0.4608314 0.0000000), wk = 0.0045045 k( 162) = ( 0.5293765 0.4706235 0.0000000), wk = 0.0045045 k( 163) = ( 0.5195843 0.4804157 0.0000000), wk = 0.0045045 k( 164) = ( 0.5097922 0.4902078 -0.0000000), wk = 0.0045045 k( 165) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0045045 k( 166) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0045045 k( 167) = ( 0.5124627 0.5124628 0.0205290), wk = 0.0045045 k( 168) = ( 0.5249255 0.5249255 0.0410581), wk = 0.0045045 k( 169) = ( 0.5373882 0.5373882 0.0615871), wk = 0.0045045 k( 170) = ( 0.5498510 0.5498510 0.0821162), wk = 0.0045045 k( 171) = ( 0.5623137 0.5623137 0.1026452), wk = 0.0045045 k( 172) = ( 0.5747765 0.5747765 0.1231743), wk = 0.0045045 k( 173) = ( 0.5872392 0.5872392 0.1437034), wk = 0.0045045 k( 174) = ( 0.5997020 0.5997020 0.1642324), wk = 0.0045045 k( 175) = ( 0.6121647 0.6121647 0.1847614), wk = 0.0045045 k( 176) = ( 0.6246275 0.6246275 0.2052905), wk = 0.0045045 k( 177) = ( 0.6370902 0.6370902 0.2258195), wk = 0.0045045 k( 178) = ( 0.6370902 0.6370902 0.2258195), wk = 0.0045045 k( 179) = ( 0.6313781 0.6313781 0.2372437), wk = 0.0045045 k( 180) = ( 0.6256660 0.6256660 0.2486679), wk = 0.0045045 k( 181) = ( 0.6199539 0.6199540 0.2600921), wk = 0.0045045 k( 182) = ( 0.6142419 0.6142419 0.2715163), wk = 0.0045045 k( 183) = ( 0.6085298 0.6085298 0.2829405), wk = 0.0045045 k( 184) = ( 0.6028177 0.6028177 0.2943647), wk = 0.0045045 k( 185) = ( 0.5971056 0.5971056 0.3057889), wk = 0.0045045 k( 186) = ( 0.5913935 0.5913935 0.3172130), wk = 0.0045045 k( 187) = ( 0.5856814 0.5856814 0.3286372), wk = 0.0045045 k( 188) = ( 0.5799693 0.5799693 0.3400614), wk = 0.0045045 k( 189) = ( 0.5742572 0.5742572 0.3514856), wk = 0.0045045 k( 190) = ( 0.5685451 0.5685451 0.3629098), wk = 0.0045045 k( 191) = ( 0.5628330 0.5628330 0.3743340), wk = 0.0045045 k( 192) = ( 0.5571209 0.5571209 0.3857581), wk = 0.0045045 k( 193) = ( 0.5514088 0.5514088 0.3971823), wk = 0.0045045 k( 194) = ( 0.5456967 0.5456967 0.4086065), wk = 0.0045045 k( 195) = ( 0.5399846 0.5399846 0.4200307), wk = 0.0045045 k( 196) = ( 0.5342726 0.5342726 0.4314549), wk = 0.0045045 k( 197) = ( 0.5285605 0.5285605 0.4428791), wk = 0.0045045 k( 198) = ( 0.5228484 0.5228484 0.4543033), wk = 0.0045045 k( 199) = ( 0.5171363 0.5171363 0.4657274), wk = 0.0045045 k( 200) = ( 0.5114242 0.5114242 0.4771516), wk = 0.0045045 k( 201) = ( 0.5057121 0.5057121 0.4885758), wk = 0.0045045 k( 202) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045045 k( 203) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0045045 k( 204) = ( 0.5144306 0.0191005 0.0191005), wk = 0.0045045 k( 205) = ( 0.5288611 0.0382010 0.0382010), wk = 0.0045045 k( 206) = ( 0.5432917 0.0573015 0.0573015), wk = 0.0045045 k( 207) = ( 0.5577222 0.0764021 0.0764021), wk = 0.0045045 k( 208) = ( 0.5721527 0.0955026 0.0955026), wk = 0.0045045 k( 209) = ( 0.5865833 0.1146031 0.1146031), wk = 0.0045045 k( 210) = ( 0.6010138 0.1337036 0.1337036), wk = 0.0045045 k( 211) = ( 0.6154444 0.1528041 0.1528041), wk = 0.0045045 k( 212) = ( 0.6298750 0.1719046 0.1719046), wk = 0.0045045 k( 213) = ( 0.6443055 0.1910051 0.1910051), wk = 0.0045045 k( 214) = ( 0.6587361 0.2101057 0.2101057), wk = 0.0045045 k( 215) = ( 0.6731666 0.2292062 0.2292062), wk = 0.0045045 k( 216) = ( 0.6875971 0.2483067 0.2483067), wk = 0.0045045 k( 217) = ( 0.7020277 0.2674072 0.2674072), wk = 0.0045045 k( 218) = ( 0.7164582 0.2865077 0.2865077), wk = 0.0045045 k( 219) = ( 0.7308888 0.3056082 0.3056082), wk = 0.0045045 k( 220) = ( 0.7453194 0.3247087 0.3247087), wk = 0.0045045 k( 221) = ( 0.7597499 0.3438093 0.3438093), wk = 0.0045045 k( 222) = ( 0.7741805 0.3629098 0.3629098), wk = 0.0045045 Dense grid: 229213 G-vectors FFT dimensions: ( 96, 96, 96) Smooth grid: 66255 G-vectors FFT dimensions: ( 64, 64, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.66 Mb ( 514, 84) NL pseudopotentials 0.60 Mb ( 257, 152) Each V/rho on FFT grid 0.42 Mb ( 27648) Each G-vector array 0.05 Mb ( 7163) G-vector shells 0.04 Mb ( 5524) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.64 Mb ( 514, 336) Each subspace H/S matrix 1.72 Mb ( 336, 336) Each matrix 0.39 Mb ( 152, 2, 84) The potential is recalculated from file : ./CrBr3.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.3 secs Computing kpt #: 2 total cpu time spent up to now is 7.5 secs Computing kpt #: 3 total cpu time spent up to now is 9.8 secs Computing kpt #: 4 total cpu time spent up to now is 12.1 secs Computing kpt #: 5 total cpu time spent up to now is 14.3 secs Computing kpt #: 6 total cpu time spent up to now is 16.7 secs Computing kpt #: 7 total cpu time spent up to now is 19.0 secs Computing kpt #: 8 total cpu time spent up to now is 21.3 secs Computing kpt #: 9 total cpu time spent up to now is 23.7 secs Computing kpt #: 10 total cpu time spent up to now is 26.0 secs Computing kpt #: 11 total cpu time spent up to now is 28.3 secs Computing kpt #: 12 total cpu time spent up to now is 30.7 secs Computing kpt #: 13 total cpu time spent up to now is 33.1 secs Computing kpt #: 14 total cpu time spent up to now is 35.4 secs Computing kpt #: 15 total cpu time spent up to now is 37.9 secs Computing kpt #: 16 total cpu time spent up to now is 40.2 secs Computing kpt #: 17 total cpu time spent up to now is 42.6 secs Computing kpt #: 18 total cpu time spent up to now is 45.1 secs Computing kpt #: 19 total cpu time spent up to now is 47.5 secs Computing kpt #: 20 total cpu time spent up to now is 49.9 secs Computing kpt #: 21 total cpu time spent up to now is 52.3 secs Computing kpt #: 22 total cpu time spent up to now is 54.7 secs Computing kpt #: 23 total cpu time spent up to now is 57.1 secs Computing kpt #: 24 total cpu time spent up to now is 59.6 secs Computing kpt #: 25 total cpu time spent up to now is 62.0 secs Computing kpt #: 26 total cpu time spent up to now is 64.4 secs Computing kpt #: 27 total cpu time spent up to now is 66.8 secs Computing kpt #: 28 total cpu time spent up to now is 69.2 secs Computing kpt #: 29 total cpu time spent up to now is 71.7 secs Computing kpt #: 30 total cpu time spent up to now is 74.1 secs Computing kpt #: 31 total cpu time spent up to now is 76.6 secs Computing kpt #: 32 total cpu time spent up to now is 79.0 secs Computing kpt #: 33 total cpu time spent up to now is 81.4 secs Computing kpt #: 34 total cpu time spent up to now is 83.8 secs Computing kpt #: 35 total cpu time spent up to now is 86.2 secs Computing kpt #: 36 total cpu time spent up to now is 88.7 secs Computing kpt #: 37 total cpu time spent up to now is 91.1 secs Computing kpt #: 38 total cpu time spent up to now is 93.6 secs Computing kpt #: 39 total cpu time spent up to now is 96.0 secs Computing kpt #: 40 total cpu time spent up to now is 98.4 secs Computing kpt #: 41 total cpu time spent up to now is 100.9 secs Computing kpt #: 42 total cpu time spent up to now is 103.4 secs Computing kpt #: 43 total cpu time spent up to now is 105.8 secs Computing kpt #: 44 total cpu time spent up to now is 108.3 secs Computing kpt #: 45 total cpu time spent up to now is 110.7 secs Computing kpt #: 46 total cpu time spent up to now is 113.1 secs Computing kpt #: 47 total cpu time spent up to now is 115.5 secs Computing kpt #: 48 total cpu time spent up to now is 117.9 secs Computing kpt #: 49 total cpu time spent up to now is 120.4 secs Computing kpt #: 50 total cpu time spent up to now is 122.8 secs Computing kpt #: 51 total cpu time spent up to now is 125.3 secs Computing kpt #: 52 total cpu time spent up to now is 127.7 secs Computing kpt #: 53 total cpu time spent up to now is 130.1 secs Computing kpt #: 54 total cpu time spent up to now is 132.6 secs Computing kpt #: 55 total cpu time spent up to now is 135.0 secs Computing kpt #: 56 total cpu time spent up to now is 137.4 secs Computing kpt #: 57 total cpu time spent up to now is 139.9 secs Computing kpt #: 58 total cpu time spent up to now is 142.3 secs Computing kpt #: 59 total cpu time spent up to now is 144.8 secs Computing kpt #: 60 total cpu time spent up to now is 147.3 secs Computing kpt #: 61 total cpu time spent up to now is 149.7 secs Computing kpt #: 62 total cpu time spent up to now is 152.2 secs Computing kpt #: 63 total cpu time spent up to now is 154.6 secs Computing kpt #: 64 total cpu time spent up to now is 157.0 secs Computing kpt #: 65 total cpu time spent up to now is 159.5 secs Computing kpt #: 66 total cpu time spent up to now is 162.0 secs Computing kpt #: 67 total cpu time spent up to now is 164.4 secs Computing kpt #: 68 total cpu time spent up to now is 166.9 secs Computing kpt #: 69 total cpu time spent up to now is 169.3 secs Computing kpt #: 70 total cpu time spent up to now is 171.8 secs Computing kpt #: 71 total cpu time spent up to now is 174.2 secs Computing kpt #: 72 total cpu time spent up to now is 176.6 secs Computing kpt #: 73 total cpu time spent up to now is 179.0 secs Computing kpt #: 74 total cpu time spent up to now is 181.5 secs Computing kpt #: 75 total cpu time spent up to now is 183.9 secs Computing kpt #: 76 total cpu time spent up to now is 186.2 secs Computing kpt #: 77 total cpu time spent up to now is 188.6 secs Computing kpt #: 78 total cpu time spent up to now is 191.0 secs Computing kpt #: 79 total cpu time spent up to now is 193.3 secs Computing kpt #: 80 total cpu time spent up to now is 195.6 secs Computing kpt #: 81 total cpu time spent up to now is 198.0 secs Computing kpt #: 82 total cpu time spent up to now is 200.3 secs Computing kpt #: 83 total cpu time spent up to now is 202.5 secs Computing kpt #: 84 total cpu time spent up to now is 204.8 secs Computing kpt #: 85 total cpu time spent up to now is 207.1 secs Computing kpt #: 86 total cpu time spent up to now is 209.3 secs Computing kpt #: 87 total cpu time spent up to now is 211.5 secs Computing kpt #: 88 total cpu time spent up to now is 213.8 secs Computing kpt #: 89 total cpu time spent up to now is 215.9 secs Computing kpt #: 90 total cpu time spent up to now is 218.2 secs Computing kpt #: 91 total cpu time spent up to now is 220.4 secs Computing kpt #: 92 total cpu time spent up to now is 222.7 secs Computing kpt #: 93 total cpu time spent up to now is 224.9 secs Computing kpt #: 94 total cpu time spent up to now is 227.2 secs Computing kpt #: 95 total cpu time spent up to now is 229.4 secs Computing kpt #: 96 total cpu time spent up to now is 231.6 secs Computing kpt #: 97 total cpu time spent up to now is 233.8 secs Computing kpt #: 98 total cpu time spent up to now is 236.1 secs Computing kpt #: 99 total cpu time spent up to now is 238.3 secs Computing kpt #: 100 total cpu time spent up to now is 240.5 secs Computing kpt #: 101 total cpu time spent up to now is 242.7 secs Computing kpt #: 102 total cpu time spent up to now is 245.0 secs Computing kpt #: 103 total cpu time spent up to now is 247.2 secs Computing kpt #: 104 total cpu time spent up to now is 249.5 secs Computing kpt #: 105 total cpu time spent up to now is 251.7 secs Computing kpt #: 106 total cpu time spent up to now is 253.9 secs Computing kpt #: 107 total cpu time spent up to now is 256.1 secs Computing kpt #: 108 total cpu time spent up to now is 258.4 secs Computing kpt #: 109 total cpu time spent up to now is 260.6 secs Computing kpt #: 110 total cpu time spent up to now is 262.8 secs Computing kpt #: 111 total cpu time spent up to now is 265.0 secs Computing kpt #: 112 total cpu time spent up to now is 267.3 secs Computing kpt #: 113 total cpu time spent up to now is 269.5 secs Computing kpt #: 114 total cpu time spent up to now is 271.7 secs Computing kpt #: 115 total cpu time spent up to now is 274.0 secs Computing kpt #: 116 total cpu time spent up to now is 276.3 secs Computing kpt #: 117 total cpu time spent up to now is 278.6 secs Computing kpt #: 118 total cpu time spent up to now is 280.9 secs Computing kpt #: 119 total cpu time spent up to now is 283.2 secs Computing kpt #: 120 total cpu time spent up to now is 285.5 secs Computing kpt #: 121 total cpu time spent up to now is 287.8 secs Computing kpt #: 122 total cpu time spent up to now is 290.2 secs Computing kpt #: 123 total cpu time spent up to now is 292.5 secs Computing kpt #: 124 total cpu time spent up to now is 294.9 secs Computing kpt #: 125 total cpu time spent up to now is 297.2 secs Computing kpt #: 126 total cpu time spent up to now is 299.6 secs Computing kpt #: 127 total cpu time spent up to now is 302.0 secs Computing kpt #: 128 total cpu time spent up to now is 304.4 secs Computing kpt #: 129 total cpu time spent up to now is 306.8 secs Computing kpt #: 130 total cpu time spent up to now is 309.2 secs Computing kpt #: 131 total cpu time spent up to now is 311.6 secs Computing kpt #: 132 total cpu time spent up to now is 314.0 secs Computing kpt #: 133 total cpu time spent up to now is 316.4 secs Computing kpt #: 134 total cpu time spent up to now is 318.8 secs Computing kpt #: 135 total cpu time spent up to now is 321.2 secs Computing kpt #: 136 total cpu time spent up to now is 323.6 secs Computing kpt #: 137 total cpu time spent up to now is 326.0 secs Computing kpt #: 138 total cpu time spent up to now is 328.4 secs Computing kpt #: 139 total cpu time spent up to now is 330.8 secs Computing kpt #: 140 total cpu time spent up to now is 333.2 secs Computing kpt #: 141 total cpu time spent up to now is 335.7 secs Computing kpt #: 142 total cpu time spent up to now is 338.1 secs Computing kpt #: 143 total cpu time spent up to now is 340.5 secs Computing kpt #: 144 total cpu time spent up to now is 342.9 secs Computing kpt #: 145 total cpu time spent up to now is 345.3 secs Computing kpt #: 146 total cpu time spent up to now is 347.8 secs Computing kpt #: 147 total cpu time spent up to now is 350.2 secs Computing kpt #: 148 total cpu time spent up to now is 352.6 secs Computing kpt #: 149 total cpu time spent up to now is 355.0 secs Computing kpt #: 150 total cpu time spent up to now is 357.5 secs Computing kpt #: 151 total cpu time spent up to now is 359.9 secs Computing kpt #: 152 total cpu time spent up to now is 362.3 secs Computing kpt #: 153 total cpu time spent up to now is 364.7 secs Computing kpt #: 154 total cpu time spent up to now is 367.2 secs Computing kpt #: 155 total cpu time spent up to now is 369.7 secs Computing kpt #: 156 total cpu time spent up to now is 372.2 secs Computing kpt #: 157 total cpu time spent up to now is 374.7 secs Computing kpt #: 158 total cpu time spent up to now is 377.2 secs Computing kpt #: 159 total cpu time spent up to now is 379.7 secs Computing kpt #: 160 total cpu time spent up to now is 382.2 secs Computing kpt #: 161 total cpu time spent up to now is 384.7 secs Computing kpt #: 162 total cpu time spent up to now is 387.2 secs Computing kpt #: 163 total cpu time spent up to now is 389.7 secs Computing kpt #: 164 total cpu time spent up to now is 392.2 secs Computing kpt #: 165 total cpu time spent up to now is 394.7 secs Computing kpt #: 166 total cpu time spent up to now is 397.2 secs Computing kpt #: 167 total cpu time spent up to now is 399.8 secs Computing kpt #: 168 total cpu time spent up to now is 402.2 secs Computing kpt #: 169 total cpu time spent up to now is 404.7 secs Computing kpt #: 170 total cpu time spent up to now is 407.2 secs Computing kpt #: 171 total cpu time spent up to now is 409.8 secs Computing kpt #: 172 total cpu time spent up to now is 412.2 secs Computing kpt #: 173 total cpu time spent up to now is 414.7 secs Computing kpt #: 174 total cpu time spent up to now is 417.2 secs Computing kpt #: 175 total cpu time spent up to now is 419.7 secs Computing kpt #: 176 total cpu time spent up to now is 422.2 secs Computing kpt #: 177 total cpu time spent up to now is 424.6 secs Computing kpt #: 178 total cpu time spent up to now is 427.1 secs Computing kpt #: 179 total cpu time spent up to now is 429.5 secs Computing kpt #: 180 total cpu time spent up to now is 432.0 secs Computing kpt #: 181 total cpu time spent up to now is 434.4 secs Computing kpt #: 182 total cpu time spent up to now is 436.8 secs Computing kpt #: 183 total cpu time spent up to now is 439.3 secs Computing kpt #: 184 total cpu time spent up to now is 441.8 secs Computing kpt #: 185 total cpu time spent up to now is 444.2 secs Computing kpt #: 186 total cpu time spent up to now is 446.6 secs Computing kpt #: 187 total cpu time spent up to now is 449.0 secs Computing kpt #: 188 total cpu time spent up to now is 451.5 secs Computing kpt #: 189 total cpu time spent up to now is 453.9 secs Computing kpt #: 190 total cpu time spent up to now is 456.3 secs Computing kpt #: 191 total cpu time spent up to now is 458.7 secs Computing kpt #: 192 total cpu time spent up to now is 461.1 secs Computing kpt #: 193 total cpu time spent up to now is 463.5 secs Computing kpt #: 194 total cpu time spent up to now is 465.9 secs Computing kpt #: 195 total cpu time spent up to now is 468.3 secs Computing kpt #: 196 total cpu time spent up to now is 470.7 secs Computing kpt #: 197 total cpu time spent up to now is 473.0 secs Computing kpt #: 198 total cpu time spent up to now is 475.3 secs Computing kpt #: 199 total cpu time spent up to now is 477.6 secs Computing kpt #: 200 total cpu time spent up to now is 479.8 secs Computing kpt #: 201 total cpu time spent up to now is 482.1 secs Computing kpt #: 202 total cpu time spent up to now is 484.4 secs Computing kpt #: 203 total cpu time spent up to now is 486.8 secs Computing kpt #: 204 total cpu time spent up to now is 489.2 secs Computing kpt #: 205 total cpu time spent up to now is 491.6 secs Computing kpt #: 206 total cpu time spent up to now is 494.1 secs Computing kpt #: 207 total cpu time spent up to now is 496.5 secs Computing kpt #: 208 total cpu time spent up to now is 498.9 secs Computing kpt #: 209 total cpu time spent up to now is 501.3 secs Computing kpt #: 210 total cpu time spent up to now is 503.8 secs Computing kpt #: 211 total cpu time spent up to now is 506.3 secs Computing kpt #: 212 total cpu time spent up to now is 508.7 secs Computing kpt #: 213 total cpu time spent up to now is 511.1 secs Computing kpt #: 214 total cpu time spent up to now is 513.5 secs Computing kpt #: 215 total cpu time spent up to now is 515.9 secs Computing kpt #: 216 total cpu time spent up to now is 518.3 secs Computing kpt #: 217 total cpu time spent up to now is 520.8 secs Computing kpt #: 218 total cpu time spent up to now is 523.2 secs Computing kpt #: 219 total cpu time spent up to now is 525.7 secs Computing kpt #: 220 total cpu time spent up to now is 528.1 secs Computing kpt #: 221 total cpu time spent up to now is 530.5 secs Computing kpt #: 222 total cpu time spent up to now is 533.0 secs ethr = 1.43E-11, avg # of iterations = 17.3 total cpu time spent up to now is 533.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8251 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5006 -37.5006 -10.3808 -10.3808 -9.4969 -9.4969 -9.3344 -9.3344 -9.3334 -9.3334 -9.3180 -9.3180 -9.3152 -9.3152 0.0149 0.0149 0.4570 0.4570 0.7856 0.7856 0.8730 0.8730 0.9446 0.9446 1.0879 1.0879 1.4334 1.4334 1.8025 1.8025 2.0243 2.0243 2.1200 2.1200 2.2101 2.2101 2.3355 2.3355 2.4486 2.4486 3.7163 3.7163 3.7578 3.7578 3.7780 3.7780 4.3515 4.3515 4.3897 4.3897 5.3295 5.3295 5.3342 5.3342 5.3373 5.3373 5.4382 5.4382 5.6134 5.6134 5.6730 5.6730 6.9520 6.9520 6.9838 6.9838 6.9867 6.9867 7.0876 7.0876 k = 0.0161-0.0123-0.0083 ( 8255 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5006 -37.5006 -10.3802 -10.3802 -9.4967 -9.4967 -9.3352 -9.3352 -9.3343 -9.3343 -9.3176 -9.3176 -9.3149 -9.3149 0.0157 0.0157 0.4529 0.4529 0.7882 0.7882 0.8721 0.8721 0.9465 0.9465 1.0856 1.0856 1.4384 1.4384 1.8040 1.8040 2.0236 2.0236 2.1189 2.1189 2.2123 2.2123 2.3362 2.3362 2.4497 2.4497 3.7146 3.7146 3.7508 3.7508 3.7822 3.7822 4.3498 4.3498 4.3859 4.3859 5.3193 5.3193 5.3367 5.3367 5.3469 5.3469 5.4391 5.4391 5.6132 5.6132 5.6728 5.6728 6.9483 6.9483 6.9832 6.9832 6.9890 6.9890 7.0878 7.0878 k = 0.0323-0.0246-0.0166 ( 8262 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5006 -37.5006 -10.3783 -10.3783 -9.4962 -9.4962 -9.3378 -9.3378 -9.3364 -9.3364 -9.3169 -9.3169 -9.3141 -9.3141 0.0182 0.0182 0.4411 0.4411 0.7946 0.7946 0.8695 0.8695 0.9522 0.9522 1.0795 1.0795 1.4528 1.4528 1.8083 1.8083 2.0216 2.0216 2.1161 2.1161 2.2186 2.2186 2.3383 2.3383 2.4530 2.4530 3.7092 3.7092 3.7368 3.7368 3.7882 3.7882 4.3441 4.3441 4.3754 4.3754 5.3078 5.3078 5.3396 5.3396 5.3613 5.3613 5.4417 5.4417 5.6126 5.6126 5.6722 5.6722 6.9396 6.9396 6.9807 6.9807 6.9945 6.9945 7.0885 7.0885 k = 0.0484-0.0370-0.0248 ( 8251 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5005 -37.5005 -10.3752 -10.3752 -9.4953 -9.4953 -9.3422 -9.3422 -9.3391 -9.3391 -9.3164 -9.3164 -9.3128 -9.3128 0.0222 0.0222 0.4236 0.4236 0.8021 0.8021 0.8655 0.8655 0.9613 0.9613 1.0725 1.0725 1.4749 1.4749 1.8155 1.8155 2.0183 2.0183 2.1121 2.1121 2.2280 2.2280 2.3417 2.3417 2.4589 2.4589 3.6985 3.6985 3.7215 3.7215 3.7919 3.7919 4.3315 4.3315 4.3619 4.3619 5.2975 5.2975 5.3443 5.3443 5.3758 5.3758 5.4463 5.4463 5.6116 5.6116 5.6714 5.6714 6.9284 6.9284 6.9764 6.9764 7.0003 7.0003 7.0899 7.0899 k = 0.0645-0.0493-0.0331 ( 8251 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5591 -38.5591 -38.5542 -38.5542 -37.5526 -37.5526 -37.5434 -37.5434 -37.5015 -37.5015 -37.5005 -37.5005 -10.3709 -10.3709 -9.4941 -9.4941 -9.3480 -9.3480 -9.3422 -9.3422 -9.3165 -9.3165 -9.3111 -9.3111 0.0278 0.0278 0.4022 0.4022 0.8078 0.8078 0.8604 0.8604 0.9713 0.9713 1.0696 1.0696 1.5029 1.5029 1.8256 1.8256 2.0138 2.0138 2.1076 2.1076 2.2391 2.2391 2.3467 2.3467 2.4675 2.4675 3.6806 3.6806 3.7073 3.7073 3.7925 3.7925 4.3088 4.3088 4.3498 4.3498 5.2883 5.2883 5.3505 5.3505 5.3896 5.3896 5.4532 5.4532 5.6103 5.6103 5.6703 5.6703 6.9159 6.9159 6.9701 6.9701 7.0055 7.0055 7.0922 7.0922 k = 0.0806-0.0616-0.0414 ( 8257 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5542 -38.5542 -37.5525 -37.5525 -37.5434 -37.5434 -37.5015 -37.5015 -37.5005 -37.5005 -10.3654 -10.3654 -9.4925 -9.4925 -9.3551 -9.3551 -9.3456 -9.3456 -9.3171 -9.3171 -9.3094 -9.3094 0.0350 0.0350 0.3787 0.3787 0.8100 0.8100 0.8547 0.8547 0.9763 0.9763 1.0777 1.0777 1.5348 1.5348 1.8384 1.8384 2.0085 2.0085 2.1029 2.1029 2.2504 2.2504 2.3538 2.3538 2.4790 2.4790 3.6562 3.6562 3.6935 3.6935 3.7897 3.7897 4.2775 4.2775 4.3390 4.3390 5.2802 5.2802 5.3580 5.3580 5.4018 5.4018 5.4627 5.4627 5.6086 5.6086 5.6691 5.6691 6.9029 6.9029 6.9619 6.9619 7.0097 7.0097 7.0953 7.0953 k = 0.0968-0.0739-0.0497 ( 8265 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5542 -38.5542 -37.5525 -37.5525 -37.5435 -37.5435 -37.5015 -37.5015 -37.5006 -37.5006 -10.3586 -10.3586 -9.4906 -9.4906 -9.3633 -9.3633 -9.3492 -9.3492 -9.3182 -9.3182 -9.3078 -9.3078 0.0436 0.0436 0.3542 0.3542 0.8084 0.8084 0.8487 0.8487 0.9731 0.9731 1.1003 1.1003 1.5690 1.5690 1.8538 1.8538 2.0028 2.0028 2.0986 2.0986 2.2602 2.2602 2.3639 2.3639 2.4936 2.4936 3.6268 3.6268 3.6782 3.6782 3.7837 3.7837 4.2412 4.2412 4.3280 4.3280 5.2729 5.2729 5.3666 5.3666 5.4119 5.4119 5.4747 5.4747 5.6068 5.6068 5.6679 5.6679 6.8894 6.8894 6.9521 6.9521 7.0132 7.0132 7.0991 7.0991 k = 0.1129-0.0863-0.0580 ( 8267 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5543 -38.5543 -37.5524 -37.5524 -37.5436 -37.5436 -37.5015 -37.5015 -37.5006 -37.5006 -10.3507 -10.3507 -9.4884 -9.4884 -9.3727 -9.3727 -9.3530 -9.3530 -9.3198 -9.3198 -9.3064 -9.3064 0.0536 0.0536 0.3296 0.3296 0.8036 0.8036 0.8429 0.8429 0.9644 0.9644 1.1338 1.1338 1.6042 1.6042 1.8709 1.8709 1.9974 1.9974 2.0951 2.0951 2.2669 2.2669 2.3781 2.3781 2.5113 2.5113 3.5929 3.5929 3.6605 3.6605 3.7746 3.7746 4.2022 4.2022 4.3161 4.3161 5.2662 5.2662 5.3759 5.3759 5.4198 5.4198 5.4886 5.4886 5.6049 5.6049 5.6669 5.6669 6.8759 6.8759 6.9409 6.9409 7.0161 7.0161 7.1031 7.1031 k = 0.1290-0.0986-0.0662 ( 8265 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5543 -38.5543 -37.5523 -37.5523 -37.5436 -37.5436 -37.5015 -37.5015 -37.5006 -37.5006 -10.3416 -10.3416 -9.4858 -9.4858 -9.3832 -9.3832 -9.3568 -9.3568 -9.3218 -9.3218 -9.3053 -9.3053 0.0648 0.0648 0.3057 0.3057 0.7965 0.7965 0.8373 0.8373 0.9539 0.9539 1.1738 1.1738 1.6392 1.6392 1.8878 1.8878 1.9939 1.9939 2.0932 2.0932 2.2698 2.2698 2.3969 2.3969 2.5318 2.5318 3.5540 3.5540 3.6402 3.6402 3.7630 3.7630 4.1626 4.1626 4.3032 4.3032 5.2601 5.2601 5.3854 5.3854 5.4262 5.4262 5.5034 5.5034 5.6032 5.6032 5.6660 5.6660 6.8624 6.8624 6.9290 6.9290 7.0187 7.0187 7.1071 7.1071 k = 0.1452-0.1109-0.0745 ( 8263 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5544 -38.5544 -37.5523 -37.5523 -37.5437 -37.5437 -37.5015 -37.5015 -37.5006 -37.5006 -10.3313 -10.3313 -9.4830 -9.4830 -9.3949 -9.3949 -9.3606 -9.3606 -9.3243 -9.3243 -9.3044 -9.3044 0.0770 0.0770 0.2829 0.2829 0.7878 0.7878 0.8325 0.8325 0.9435 0.9435 1.2175 1.2175 1.6731 1.6731 1.9005 1.9005 1.9946 1.9946 2.0946 2.0946 2.2689 2.2689 2.4197 2.4197 2.5549 2.5549 3.5096 3.5096 3.6173 3.6173 3.7494 3.7494 4.1240 4.1240 4.2890 4.2890 5.2544 5.2544 5.3943 5.3943 5.4318 5.4318 5.5181 5.5181 5.6021 5.6021 5.6655 5.6655 6.8492 6.8492 6.9167 6.9167 7.0210 7.0210 7.1108 7.1108 k = 0.1613-0.1232-0.0828 ( 8274 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5589 -38.5589 -38.5544 -38.5544 -37.5522 -37.5522 -37.5438 -37.5438 -37.5015 -37.5015 -37.5006 -37.5006 -10.3199 -10.3199 -9.4798 -9.4798 -9.4077 -9.4077 -9.3645 -9.3645 -9.3270 -9.3270 -9.3039 -9.3039 0.0896 0.0896 0.2620 0.2620 0.7779 0.7779 0.8286 0.8286 0.9343 0.9343 1.2634 1.2634 1.7052 1.7052 1.9052 1.9052 2.0005 2.0005 2.1024 2.1024 2.2652 2.2652 2.4458 2.4458 2.5802 2.5802 3.4591 3.4591 3.5920 3.5920 3.7346 3.7346 4.0875 4.0875 4.2738 4.2738 5.2489 5.2489 5.4013 5.4013 5.4377 5.4377 5.5317 5.5317 5.6023 5.6023 5.6655 5.6655 6.8362 6.8362 6.9046 6.9046 7.0232 7.0232 7.1139 7.1139 k = 0.1774-0.1355-0.0911 ( 8270 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5589 -38.5589 -38.5545 -38.5545 -37.5521 -37.5521 -37.5439 -37.5439 -37.5015 -37.5015 -37.5006 -37.5006 -10.3073 -10.3073 -9.4763 -9.4763 -9.4215 -9.4215 -9.3683 -9.3683 -9.3301 -9.3301 -9.3036 -9.3036 0.1017 0.1017 0.2439 0.2439 0.7670 0.7670 0.8264 0.8264 0.9268 0.9268 1.3103 1.3103 1.7351 1.7351 1.9019 1.9019 2.0072 2.0072 2.1204 2.1204 2.2595 2.2595 2.4742 2.4742 2.6074 2.6074 3.4023 3.4023 3.5648 3.5648 3.7190 3.7190 4.0539 4.0539 4.2574 4.2574 5.2435 5.2435 5.4051 5.4051 5.4450 5.4450 5.5432 5.5432 5.6043 5.6043 5.6661 5.6661 6.8236 6.8236 6.8932 6.8932 7.0253 7.0253 7.1163 7.1163 k = 0.1935-0.1479-0.0994 ( 8276 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5588 -38.5588 -38.5545 -38.5545 -37.5520 -37.5520 -37.5441 -37.5441 -37.5014 -37.5014 -37.5006 -37.5006 -10.2937 -10.2937 -9.4726 -9.4726 -9.4365 -9.4365 -9.3721 -9.3721 -9.3334 -9.3334 -9.3037 -9.3037 0.1116 0.1116 0.2303 0.2303 0.7552 0.7552 0.8263 0.8263 0.9212 0.9212 1.3573 1.3573 1.7621 1.7621 1.8939 1.8939 2.0098 2.0098 2.1496 2.1496 2.2533 2.2533 2.5045 2.5045 2.6361 2.6361 3.3392 3.3392 3.5362 3.5362 3.7032 3.7032 4.0235 4.0235 4.2400 4.2400 5.2381 5.2381 5.4051 5.4051 5.4541 5.4541 5.5521 5.5521 5.6086 5.6086 5.6675 5.6675 6.8115 6.8115 6.8830 6.8830 7.0274 7.0274 7.1179 7.1179 k = 0.2097-0.1602-0.1077 ( 8278 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5587 -38.5587 -38.5546 -38.5546 -37.5518 -37.5518 -37.5442 -37.5442 -37.5014 -37.5014 -37.5006 -37.5006 -10.2791 -10.2791 -9.4687 -9.4687 -9.4524 -9.4524 -9.3757 -9.3757 -9.3370 -9.3370 -9.3042 -9.3042 0.1166 0.1166 0.2242 0.2242 0.7426 0.7426 0.8287 0.8287 0.9178 0.9178 1.4038 1.4038 1.7851 1.7851 1.8848 1.8848 2.0075 2.0075 2.1842 2.1842 2.2506 2.2506 2.5358 2.5358 2.6658 2.6658 3.2705 3.2705 3.5068 3.5068 3.6874 3.6874 3.9964 3.9964 4.2215 4.2215 5.2326 5.2326 5.4015 5.4015 5.4644 5.4644 5.5582 5.5582 5.6149 5.6149 5.6700 5.6700 6.8000 6.8000 6.8744 6.8744 7.0295 7.0295 7.1185 7.1185 k = 0.2258-0.1725-0.1159 ( 8283 PWs) bands (ev): -66.5285 -66.5285 -66.5278 -66.5278 -38.5587 -38.5587 -38.5547 -38.5547 -37.5517 -37.5517 -37.5443 -37.5443 -37.5014 -37.5014 -37.5006 -37.5006 -10.2634 -10.2634 -9.4697 -9.4697 -9.4642 -9.4642 -9.3793 -9.3793 -9.3407 -9.3407 -9.3049 -9.3049 0.1144 0.1144 0.2275 0.2275 0.7294 0.7294 0.8338 0.8338 0.9166 0.9166 1.4492 1.4492 1.8004 1.8004 1.8797 1.8797 2.0016 2.0016 2.2057 2.2057 2.2669 2.2669 2.5678 2.5678 2.6963 2.6963 3.1971 3.1971 3.4770 3.4770 3.6720 3.6720 3.9722 3.9722 4.2020 4.2020 5.2270 5.2270 5.3951 5.3951 5.4754 5.4754 5.5623 5.5623 5.6221 5.6221 5.6740 5.6740 6.7889 6.7889 6.8677 6.8677 7.0315 7.0315 7.1183 7.1183 k = 0.2419-0.1848-0.1242 ( 8285 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5586 -38.5586 -38.5548 -38.5548 -37.5516 -37.5516 -37.5445 -37.5445 -37.5014 -37.5014 -37.5006 -37.5006 -10.2468 -10.2468 -9.4875 -9.4875 -9.4598 -9.4598 -9.3827 -9.3827 -9.3445 -9.3445 -9.3061 -9.3061 0.1057 0.1057 0.2396 0.2396 0.7158 0.7158 0.8417 0.8417 0.9179 0.9179 1.4930 1.4930 1.8028 1.8028 1.8849 1.8849 1.9931 1.9931 2.2046 2.2046 2.3098 2.3098 2.5999 2.5999 2.7271 2.7271 3.1203 3.1203 3.4471 3.4471 3.6572 3.6572 3.9507 3.9507 4.1816 4.1816 5.2213 5.2213 5.3862 5.3862 5.4864 5.4864 5.5653 5.5653 5.6288 5.6288 5.6797 5.6797 6.7783 6.7783 6.8632 6.8632 7.0334 7.0334 7.1172 7.1172 k = 0.2581-0.1972-0.1325 ( 8285 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5585 -38.5585 -38.5548 -38.5548 -37.5515 -37.5515 -37.5446 -37.5446 -37.5014 -37.5014 -37.5006 -37.5006 -10.2292 -10.2292 -9.5064 -9.5064 -9.4552 -9.4552 -9.3860 -9.3860 -9.3483 -9.3483 -9.3075 -9.3075 0.0933 0.0933 0.2578 0.2578 0.7020 0.7020 0.8522 0.8522 0.9216 0.9216 1.5345 1.5345 1.7930 1.7930 1.9001 1.9001 1.9827 1.9827 2.1965 2.1965 2.3623 2.3623 2.6316 2.6316 2.7574 2.7574 3.0418 3.0418 3.4176 3.4176 3.6429 3.6429 3.9317 3.9317 4.1604 4.1604 5.2154 5.2154 5.3753 5.3753 5.4970 5.4970 5.5678 5.5678 5.6342 5.6342 5.6872 5.6872 6.7683 6.7683 6.8609 6.8609 7.0351 7.0351 7.1153 7.1153 k = 0.2742-0.2095-0.1408 ( 8287 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5585 -38.5585 -38.5549 -38.5549 -37.5513 -37.5513 -37.5448 -37.5448 -37.5014 -37.5014 -37.5007 -37.5007 -10.2107 -10.2107 -9.5262 -9.5262 -9.4503 -9.4503 -9.3891 -9.3891 -9.3522 -9.3522 -9.3093 -9.3093 0.0791 0.0791 0.2797 0.2797 0.6883 0.6883 0.8649 0.8649 0.9282 0.9282 1.5732 1.5732 1.7768 1.7768 1.9192 1.9192 1.9715 1.9715 2.1871 2.1871 2.4177 2.4177 2.6621 2.6621 2.7851 2.7851 2.9649 2.9649 3.3887 3.3887 3.6295 3.6295 3.9145 3.9145 4.1386 4.1386 5.2093 5.2093 5.3628 5.3628 5.5070 5.5070 5.5702 5.5702 5.6384 5.6384 5.6961 5.6961 6.7588 6.7588 6.8611 6.8611 7.0365 7.0365 7.1127 7.1127 k = 0.2903-0.2218-0.1491 ( 8279 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5584 -38.5584 -38.5550 -38.5550 -37.5512 -37.5512 -37.5449 -37.5449 -37.5013 -37.5013 -37.5007 -37.5007 -10.1914 -10.1914 -9.5468 -9.5468 -9.4452 -9.4452 -9.3919 -9.3919 -9.3561 -9.3561 -9.3115 -9.3115 0.0645 0.0645 0.3041 0.3041 0.6750 0.6750 0.8792 0.8792 0.9380 0.9380 1.6081 1.6081 1.7583 1.7583 1.9355 1.9355 1.9636 1.9636 2.1781 2.1781 2.4734 2.4734 2.6902 2.6902 2.8002 2.8002 2.9013 2.9013 3.3608 3.3608 3.6169 3.6169 3.8989 3.8989 4.1166 4.1166 5.2032 5.2032 5.3491 5.3491 5.5161 5.5161 5.5728 5.5728 5.6414 5.6414 5.7058 5.7058 6.7500 6.7500 6.8634 6.8634 7.0376 7.0376 7.1095 7.1095 k = 0.3065-0.2341-0.1573 ( 8273 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5583 -38.5583 -38.5551 -38.5551 -37.5510 -37.5510 -37.5451 -37.5451 -37.5013 -37.5013 -37.5007 -37.5007 -10.1712 -10.1712 -9.5682 -9.5682 -9.4401 -9.4401 -9.3946 -9.3946 -9.3599 -9.3599 -9.3139 -9.3139 0.0500 0.0500 0.3301 0.3301 0.6621 0.6621 0.8944 0.8944 0.9515 0.9515 1.6371 1.6371 1.7400 1.7400 1.9343 1.9343 1.9725 1.9725 2.1702 2.1702 2.5273 2.5273 2.7093 2.7093 2.7736 2.7736 2.8879 2.8879 3.3346 3.3346 3.6053 3.6053 3.8843 3.8843 4.0947 4.0947 5.1970 5.1970 5.3343 5.3343 5.5241 5.5241 5.5757 5.5757 5.6436 5.6436 5.7158 5.7158 6.7418 6.7418 6.8679 6.8679 7.0383 7.0383 7.1058 7.1058 k = 0.3226-0.2464-0.1656 ( 8277 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5582 -38.5582 -38.5552 -38.5552 -37.5509 -37.5509 -37.5453 -37.5453 -37.5013 -37.5013 -37.5007 -37.5007 -10.1504 -10.1504 -9.5903 -9.5903 -9.4347 -9.4347 -9.3971 -9.3971 -9.3636 -9.3636 -9.3167 -9.3167 0.0361 0.0361 0.3571 0.3571 0.6499 0.6499 0.9098 0.9098 0.9690 0.9690 1.6558 1.6558 1.7266 1.7266 1.9232 1.9232 1.9909 1.9909 2.1641 2.1641 2.5747 2.5747 2.6800 2.6800 2.7624 2.7624 2.9106 2.9106 3.3107 3.3107 3.5946 3.5946 3.8702 3.8702 4.0733 4.0733 5.1909 5.1909 5.3187 5.3187 5.5307 5.5307 5.5792 5.5792 5.6453 5.6453 5.7258 5.7258 6.7343 6.7343 6.8743 6.8743 7.0385 7.0385 7.1019 7.1019 k = 0.3387-0.2588-0.1739 ( 8277 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5581 -38.5581 -38.5553 -38.5553 -37.5507 -37.5507 -37.5454 -37.5454 -37.5013 -37.5013 -37.5007 -37.5007 -10.1288 -10.1288 -9.6130 -9.6130 -9.4294 -9.4294 -9.3993 -9.3993 -9.3672 -9.3672 -9.3198 -9.3198 0.0230 0.0230 0.3846 0.3846 0.6384 0.6384 0.9253 0.9253 0.9902 0.9902 1.6565 1.6565 1.7247 1.7247 1.9125 1.9125 2.0087 2.0087 2.1609 2.1609 2.5790 2.5790 2.6509 2.6509 2.7820 2.7820 2.9412 2.9412 3.2896 3.2896 3.5848 3.5848 3.8559 3.8559 4.0529 4.0529 5.1850 5.1850 5.3028 5.3028 5.5361 5.5361 5.5832 5.5832 5.6465 5.6465 5.7354 5.7354 6.7275 6.7275 6.8822 6.8822 7.0382 7.0382 7.0978 7.0978 k = 0.3548-0.2711-0.1822 ( 8287 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5580 -38.5580 -38.5554 -38.5554 -37.5506 -37.5506 -37.5456 -37.5456 -37.5012 -37.5012 -37.5007 -37.5007 -10.1067 -10.1067 -9.6362 -9.6362 -9.4240 -9.4240 -9.4012 -9.4012 -9.3706 -9.3706 -9.3231 -9.3231 0.0107 0.0107 0.4120 0.4120 0.6279 0.6279 0.9411 0.9411 1.0143 1.0143 1.6424 1.6424 1.7302 1.7302 1.9055 1.9055 2.0231 2.0231 2.1613 2.1613 2.5141 2.5141 2.6800 2.6800 2.8051 2.8051 2.9741 2.9741 3.2722 3.2722 3.5760 3.5760 3.8410 3.8410 4.0342 4.0342 5.1794 5.1794 5.2867 5.2867 5.5402 5.5402 5.5876 5.5876 5.6474 5.6474 5.7445 5.7445 6.7215 6.7215 6.8912 6.8912 7.0374 7.0374 7.0936 7.0936 k = 0.3710-0.2834-0.1905 ( 8288 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5579 -38.5579 -38.5554 -38.5554 -37.5504 -37.5504 -37.5457 -37.5457 -37.5012 -37.5012 -37.5007 -37.5007 -10.0841 -10.0841 -9.6598 -9.6598 -9.4186 -9.4186 -9.4027 -9.4027 -9.3738 -9.3738 -9.3267 -9.3267 -0.0005 -0.0005 0.4387 0.4387 0.6185 0.6185 0.9574 0.9574 1.0402 1.0402 1.6231 1.6231 1.7330 1.7330 1.9041 1.9041 2.0326 2.0326 2.1661 2.1661 2.4416 2.4416 2.7088 2.7088 2.8301 2.8301 3.0081 3.0081 3.2589 3.2589 3.5679 3.5679 3.8250 3.8250 4.0177 4.0177 5.1744 5.1744 5.2706 5.2706 5.5432 5.5432 5.5923 5.5923 5.6479 5.6479 5.7529 5.7529 6.7162 6.7162 6.9010 6.9010 7.0362 7.0362 7.0895 7.0895 k = 0.3871-0.2957-0.1987 ( 8290 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5579 -38.5579 -38.5555 -38.5555 -37.5503 -37.5503 -37.5459 -37.5459 -37.5012 -37.5012 -37.5008 -37.5008 -10.0611 -10.0611 -9.6837 -9.6837 -9.4137 -9.4137 -9.4037 -9.4037 -9.3767 -9.3767 -9.3306 -9.3306 -0.0105 -0.0105 0.4642 0.4642 0.6103 0.6103 0.9745 0.9745 1.0665 1.0665 1.6034 1.6034 1.7294 1.7294 1.9085 1.9085 2.0363 2.0363 2.1750 2.1750 2.3721 2.3721 2.7277 2.7277 2.8568 2.8568 3.0424 3.0424 3.2501 3.2501 3.5606 3.5606 3.8078 3.8078 4.0036 4.0036 5.1700 5.1700 5.2549 5.2549 5.5453 5.5453 5.5971 5.5971 5.6483 5.6483 5.7605 5.7605 6.7117 6.7117 6.9112 6.9112 7.0347 7.0347 7.0855 7.0855 k = 0.4032-0.3081-0.2070 ( 8300 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5578 -38.5578 -38.5556 -38.5556 -37.5501 -37.5501 -37.5460 -37.5460 -37.5012 -37.5012 -37.5008 -37.5008 -10.0379 -10.0379 -9.7078 -9.7078 -9.4101 -9.4101 -9.4031 -9.4031 -9.3793 -9.3793 -9.3346 -9.3346 -0.0193 -0.0193 0.4875 0.4875 0.6035 0.6035 0.9925 0.9925 1.0918 1.0918 1.5855 1.5855 1.7201 1.7201 1.9171 1.9171 2.0345 2.0345 2.1856 2.1856 2.3096 2.3096 2.7370 2.7370 2.8837 2.8837 3.0763 3.0763 3.2454 3.2454 3.5540 3.5540 3.7895 3.7895 3.9921 3.9921 5.1664 5.1664 5.2399 5.2399 5.5469 5.5469 5.6016 5.6016 5.6484 5.6484 5.7673 5.7673 6.7079 6.7079 6.9211 6.9211 7.0334 7.0334 7.0814 7.0814 k = 0.4194-0.3204-0.2153 ( 8302 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5500 -37.5500 -37.5462 -37.5462 -37.5012 -37.5012 -37.5008 -37.5008 -10.0147 -10.0147 -9.7317 -9.7317 -9.4091 -9.4091 -9.3998 -9.3998 -9.3815 -9.3815 -9.3387 -9.3387 -0.0269 -0.0269 0.5080 0.5080 0.5985 0.5985 1.0112 1.0112 1.1143 1.1143 1.5714 1.5714 1.7070 1.7070 1.9276 1.9276 2.0279 2.0279 2.1911 2.1911 2.2615 2.2615 2.7389 2.7389 2.9087 2.9087 3.1091 3.1091 3.2441 3.2441 3.5483 3.5483 3.7707 3.7707 3.9831 3.9831 5.1639 5.1639 5.2257 5.2257 5.5479 5.5479 5.6058 5.6058 5.6483 5.6483 5.7731 5.7731 6.7049 6.7049 6.9304 6.9304 7.0325 7.0325 7.0774 7.0774 k = 0.4355-0.3327-0.2236 ( 8304 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5499 -37.5499 -37.5463 -37.5463 -37.5012 -37.5012 -37.5008 -37.5008 -9.9918 -9.9918 -9.7552 -9.7552 -9.4093 -9.4093 -9.3953 -9.3953 -9.3834 -9.3834 -9.3428 -9.3428 -0.0332 -0.0332 0.5247 0.5247 0.5953 0.5953 1.0303 1.0303 1.1320 1.1320 1.5628 1.5628 1.6915 1.6915 1.9376 1.9376 2.0177 2.0177 2.1754 2.1754 2.2444 2.2444 2.7361 2.7361 2.9300 2.9300 3.1398 3.1398 3.2447 3.2447 3.5435 3.5435 3.7523 3.7523 3.9764 3.9764 5.1627 5.1627 5.2127 5.2127 5.5486 5.5486 5.6095 5.6095 5.6481 5.6481 5.7779 5.7779 6.7025 6.7025 6.9384 6.9384 7.0323 7.0323 7.0732 7.0732 k = 0.4516-0.3450-0.2319 ( 8299 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5498 -37.5498 -37.5464 -37.5464 -37.5012 -37.5012 -37.5008 -37.5008 -9.9699 -9.9699 -9.7776 -9.7776 -9.4097 -9.4097 -9.3910 -9.3910 -9.3846 -9.3846 -9.3468 -9.3468 -0.0381 -0.0381 0.5369 0.5369 0.5944 0.5944 1.0490 1.0490 1.1437 1.1437 1.5609 1.5609 1.6749 1.6749 1.9449 1.9449 2.0060 2.0060 2.1475 2.1475 2.2496 2.2496 2.7312 2.7312 2.9468 2.9468 3.1676 3.1676 3.2456 3.2456 3.5399 3.5399 3.7356 3.7356 3.9715 3.9715 5.1627 5.1627 5.2010 5.2010 5.5492 5.5492 5.6126 5.6126 5.6478 5.6478 5.7817 5.7817 6.7006 6.7006 6.9449 6.9449 7.0331 7.0331 7.0691 7.0691 k = 0.4677-0.3573-0.2401 ( 8291 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9502 -9.9502 -9.7977 -9.7977 -9.4101 -9.4101 -9.3883 -9.3883 -9.3844 -9.3844 -9.3504 -9.3504 -0.0416 -0.0416 0.5444 0.5444 0.5953 0.5953 1.0659 1.0659 1.1489 1.1489 1.5652 1.5652 1.6582 1.6582 1.9468 1.9468 1.9973 1.9973 2.1254 2.1254 2.2579 2.2579 2.7260 2.7260 2.9588 2.9588 3.1913 3.1913 3.2449 3.2449 3.5375 3.5375 3.7220 3.7220 3.9683 3.9683 5.1642 5.1642 5.1910 5.1910 5.5495 5.5495 5.6149 5.6149 5.6475 5.6475 5.7845 5.7845 6.6994 6.6994 6.9495 6.9495 7.0346 7.0346 7.0653 7.0653 k = 0.4839-0.3697-0.2484 ( 8293 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5559 -38.5559 -37.5497 -37.5497 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9352 -9.9352 -9.8129 -9.8129 -9.4103 -9.4103 -9.3879 -9.3879 -9.3826 -9.3826 -9.3530 -9.3530 -0.0437 -0.0437 0.5482 0.5482 0.5967 0.5967 1.0787 1.0787 1.1495 1.1495 1.5731 1.5731 1.6437 1.6437 1.9442 1.9442 1.9939 1.9939 2.1123 2.1123 2.2640 2.2640 2.7222 2.7222 2.9659 2.9659 3.2094 3.2094 3.2418 3.2418 3.5362 3.5362 3.7131 3.7131 3.9664 3.9664 5.1669 5.1669 5.1831 5.1831 5.5497 5.5497 5.6163 5.6163 5.6473 5.6473 5.7862 5.7862 6.6987 6.6987 6.9523 6.9523 7.0363 7.0363 7.0623 7.0623 k = 0.5000-0.3820-0.2567 ( 8292 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9292 -9.9292 -9.8189 -9.8189 -9.4104 -9.4104 -9.3880 -9.3880 -9.3816 -9.3816 -9.3540 -9.3540 -0.0444 -0.0444 0.5493 0.5493 0.5974 0.5974 1.0836 1.0836 1.1490 1.1490 1.5775 1.5775 1.6372 1.6372 1.9424 1.9424 1.9935 1.9935 2.1080 2.1080 2.2661 2.2661 2.7208 2.7208 2.9683 2.9683 3.2175 3.2175 3.2388 3.2388 3.5358 3.5358 3.7099 3.7099 3.9658 3.9658 5.1688 5.1688 5.1794 5.1794 5.5498 5.5498 5.6168 5.6168 5.6472 5.6472 5.7867 5.7867 6.6984 6.6984 6.9531 6.9531 7.0371 7.0371 7.0612 7.0612 k = 0.5000-0.3820-0.2567 ( 8292 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9292 -9.9292 -9.8189 -9.8189 -9.4104 -9.4104 -9.3880 -9.3880 -9.3816 -9.3816 -9.3540 -9.3540 -0.0444 -0.0444 0.5493 0.5493 0.5974 0.5974 1.0836 1.0836 1.1490 1.1490 1.5775 1.5775 1.6372 1.6372 1.9424 1.9424 1.9935 1.9935 2.1080 2.1080 2.2661 2.2661 2.7208 2.7208 2.9683 2.9683 3.2175 3.2175 3.2388 3.2388 3.5358 3.5358 3.7099 3.7099 3.9658 3.9658 5.1688 5.1688 5.1794 5.1794 5.5498 5.5498 5.6168 5.6168 5.6472 5.6472 5.7867 5.7867 6.6984 6.6984 6.9531 6.9531 7.0371 7.0371 7.0612 7.0612 k = 0.5000-0.3696-0.2751 ( 8294 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9287 -9.9287 -9.8186 -9.8186 -9.4125 -9.4125 -9.3871 -9.3871 -9.3814 -9.3814 -9.3539 -9.3539 -0.0425 -0.0425 0.5493 0.5493 0.5979 0.5979 1.0821 1.0821 1.1491 1.1491 1.5757 1.5757 1.6370 1.6370 1.9402 1.9402 1.9922 1.9922 2.1056 2.1056 2.2726 2.2726 2.7235 2.7235 2.9689 2.9689 3.2127 3.2127 3.2424 3.2424 3.5352 3.5352 3.7099 3.7099 3.9644 3.9644 5.1684 5.1684 5.1811 5.1811 5.5491 5.5491 5.6143 5.6143 5.6491 5.6491 5.7867 5.7867 6.6995 6.6995 6.9534 6.9534 7.0368 7.0368 7.0612 7.0612 k = 0.5000-0.3573-0.2935 ( 8298 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5466 -37.5466 -37.5011 -37.5011 -37.5008 -37.5008 -9.9273 -9.9273 -9.8176 -9.8176 -9.4181 -9.4181 -9.3855 -9.3855 -9.3806 -9.3806 -9.3537 -9.3537 -0.0366 -0.0366 0.5494 0.5494 0.5995 0.5995 1.0774 1.0774 1.1493 1.1493 1.5703 1.5703 1.6362 1.6362 1.9334 1.9334 1.9895 1.9895 2.0995 2.0995 2.2905 2.2905 2.7311 2.7311 2.9708 2.9708 3.2025 3.2025 3.2491 3.2491 3.5335 3.5335 3.7099 3.7099 3.9602 3.9602 5.1679 5.1679 5.1851 5.1851 5.5473 5.5473 5.6081 5.6081 5.6535 5.6535 5.7868 5.7868 6.7028 6.7028 6.9542 6.9542 7.0361 7.0361 7.0615 7.0615 k = 0.5000-0.3449-0.3119 ( 8290 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5466 -37.5466 -37.5011 -37.5011 -37.5008 -37.5008 -9.9248 -9.9248 -9.8159 -9.8159 -9.4259 -9.4259 -9.3842 -9.3842 -9.3792 -9.3792 -9.3533 -9.3533 -0.0270 -0.0270 0.5493 0.5493 0.6022 0.6022 1.0699 1.0699 1.1496 1.1496 1.5622 1.5622 1.6343 1.6343 1.9217 1.9217 1.9871 1.9871 2.0917 2.0917 2.3168 2.3168 2.7426 2.7426 2.9743 2.9743 3.1903 3.1903 3.2558 3.2558 3.5307 3.5307 3.7097 3.7097 3.9533 3.9533 5.1681 5.1681 5.1908 5.1908 5.5442 5.5442 5.5999 5.5999 5.6589 5.6589 5.7868 5.7868 6.7080 6.7080 6.9556 6.9556 7.0349 7.0349 7.0620 7.0620 k = 0.5000-0.3326-0.3302 ( 8290 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5466 -37.5466 -37.5011 -37.5011 -37.5008 -37.5008 -9.9214 -9.9214 -9.8136 -9.8136 -9.4354 -9.4354 -9.3834 -9.3834 -9.3777 -9.3777 -9.3527 -9.3527 -0.0136 -0.0136 0.5488 0.5488 0.6063 0.6063 1.0595 1.0595 1.1499 1.1499 1.5519 1.5519 1.6307 1.6307 1.9061 1.9061 1.9856 1.9856 2.0845 2.0845 2.3483 2.3483 2.7561 2.7561 2.9795 2.9795 3.1772 3.1772 3.2618 3.2618 3.5268 3.5268 3.7093 3.7093 3.9439 3.9439 5.1693 5.1693 5.1976 5.1976 5.5396 5.5396 5.5907 5.5907 5.6646 5.6646 5.7869 5.7869 6.7149 6.7149 6.9576 6.9576 7.0329 7.0329 7.0629 7.0629 k = 0.5000-0.3202-0.3486 ( 8298 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5495 -37.5495 -37.5467 -37.5467 -37.5011 -37.5011 -37.5008 -37.5008 -9.9171 -9.9171 -9.8107 -9.8107 -9.4462 -9.4462 -9.3831 -9.3831 -9.3764 -9.3764 -9.3520 -9.3520 0.0035 0.0035 0.5477 0.5477 0.6118 0.6118 1.0467 1.0467 1.1502 1.1502 1.5401 1.5401 1.6252 1.6252 1.8878 1.8878 1.9848 1.9848 2.0793 2.0793 2.3830 2.3830 2.7699 2.7699 2.9866 2.9866 3.1642 3.1642 3.2672 3.2672 3.5220 3.5220 3.7085 3.7085 3.9321 3.9321 5.1716 5.1716 5.2053 5.2053 5.5334 5.5334 5.5812 5.5812 5.6702 5.6702 5.7869 5.7869 6.7232 6.7232 6.9604 6.9604 7.0303 7.0303 7.0642 7.0642 k = 0.5000-0.3078-0.3670 ( 8298 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5574 -38.5574 -38.5560 -38.5560 -37.5494 -37.5494 -37.5468 -37.5468 -37.5011 -37.5011 -37.5008 -37.5008 -9.9118 -9.9118 -9.8071 -9.8071 -9.4582 -9.4582 -9.3833 -9.3833 -9.3753 -9.3753 -9.3511 -9.3511 0.0240 0.0240 0.5459 0.5459 0.6186 0.6186 1.0317 1.0317 1.1504 1.1504 1.5274 1.5274 1.6178 1.6178 1.8684 1.8684 1.9841 1.9841 2.0770 2.0770 2.4193 2.4193 2.7821 2.7821 2.9952 2.9952 3.1522 3.1522 3.2720 3.2720 3.5164 3.5164 3.7072 3.7072 3.9183 3.9183 5.1750 5.1750 5.2137 5.2137 5.5252 5.5252 5.5717 5.5717 5.6758 5.6758 5.7869 5.7869 6.7324 6.7324 6.9640 6.9640 7.0270 7.0270 7.0659 7.0659 k = 0.5000-0.2955-0.3854 ( 8292 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5574 -38.5574 -38.5560 -38.5560 -37.5494 -37.5494 -37.5468 -37.5468 -37.5011 -37.5011 -37.5008 -37.5008 -9.9056 -9.9056 -9.8030 -9.8030 -9.4713 -9.4713 -9.3843 -9.3843 -9.3742 -9.3742 -9.3501 -9.3501 0.0478 0.0478 0.5431 0.5431 0.6269 0.6269 1.0149 1.0149 1.1504 1.1504 1.5142 1.5142 1.6087 1.6087 1.8487 1.8487 1.9837 1.9837 2.0778 2.0778 2.4558 2.4558 2.7916 2.7916 3.0040 3.0040 3.1431 3.1431 3.2765 3.2765 3.5101 3.5101 3.7050 3.7050 3.9027 3.9027 5.1793 5.1793 5.2226 5.2226 5.5150 5.5150 5.5626 5.5626 5.6814 5.6814 5.7869 5.7869 6.7421 6.7421 6.9683 6.9683 7.0233 7.0233 7.0679 7.0679 k = 0.5000-0.2831-0.4038 ( 8294 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5573 -38.5573 -38.5561 -38.5561 -37.5493 -37.5493 -37.5469 -37.5469 -37.5011 -37.5011 -37.5008 -37.5008 -9.8984 -9.8984 -9.7983 -9.7983 -9.4853 -9.4853 -9.3862 -9.3862 -9.3729 -9.3729 -9.3489 -9.3489 0.0746 0.0746 0.5393 0.5393 0.6364 0.6364 0.9969 0.9969 1.1500 1.1500 1.5010 1.5010 1.5982 1.5982 1.8296 1.8296 1.9838 1.9838 2.0812 2.0812 2.4916 2.4916 2.7977 2.7977 3.0103 3.0103 3.1393 3.1393 3.2806 3.2806 3.5033 3.5033 3.7020 3.7020 3.8858 3.8858 5.1846 5.1846 5.2318 5.2318 5.5028 5.5028 5.5540 5.5540 5.6869 5.6869 5.7869 5.7869 6.7518 6.7518 6.9732 6.9732 7.0194 7.0194 7.0702 7.0702 k = 0.5000-0.2708-0.4222 ( 8294 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5573 -38.5573 -38.5561 -38.5561 -37.5492 -37.5492 -37.5470 -37.5470 -37.5011 -37.5011 -37.5008 -37.5008 -9.8904 -9.8904 -9.7932 -9.7932 -9.5003 -9.5003 -9.3891 -9.3891 -9.3714 -9.3714 -9.3476 -9.3476 0.1042 0.1042 0.5343 0.5343 0.6470 0.6470 0.9782 0.9782 1.1492 1.1492 1.4878 1.4878 1.5869 1.5869 1.8116 1.8116 1.9848 1.9848 2.0866 2.0866 2.5256 2.5256 2.8006 2.8006 3.0114 3.0114 3.1428 3.1428 3.2843 3.2843 3.4964 3.4964 3.6980 3.6980 3.8679 3.8679 5.1906 5.1906 5.2413 5.2413 5.4890 5.4890 5.5459 5.5459 5.6926 5.6926 5.7868 5.7868 6.7611 6.7611 6.9779 6.9779 7.0161 7.0161 7.0726 7.0726 k = 0.5000-0.2584-0.4406 ( 8292 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5572 -38.5572 -38.5562 -38.5562 -37.5491 -37.5491 -37.5471 -37.5471 -37.5011 -37.5011 -37.5008 -37.5008 -9.8815 -9.8815 -9.7876 -9.7876 -9.5160 -9.5160 -9.3930 -9.3930 -9.3696 -9.3696 -9.3461 -9.3461 0.1361 0.1361 0.5282 0.5282 0.6583 0.6583 0.9595 0.9595 1.1479 1.1479 1.4749 1.4749 1.5756 1.5756 1.7953 1.7953 1.9867 1.9867 2.0932 2.0932 2.5569 2.5569 2.8009 2.8009 3.0065 3.0065 3.1535 3.1535 3.2876 3.2876 3.4896 3.4896 3.6928 3.6928 3.8496 3.8496 5.1972 5.1972 5.2507 5.2507 5.4740 5.4740 5.5382 5.5382 5.6983 5.6983 5.7868 5.7868 6.7696 6.7696 6.9810 6.9810 7.0146 7.0146 7.0752 7.0752 k = 0.5000-0.2461-0.4589 ( 8286 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5572 -38.5572 -38.5562 -38.5562 -37.5490 -37.5490 -37.5472 -37.5472 -37.5011 -37.5011 -37.5008 -37.5008 -9.8718 -9.8718 -9.7817 -9.7817 -9.5323 -9.5323 -9.3978 -9.3978 -9.3676 -9.3676 -9.3445 -9.3445 0.1698 0.1698 0.5210 0.5210 0.6700 0.6700 0.9414 0.9414 1.1461 1.1461 1.4622 1.4622 1.5650 1.5650 1.7812 1.7812 1.9896 1.9896 2.1004 2.1004 2.5843 2.5843 2.7994 2.7994 2.9975 2.9975 3.1687 3.1687 3.2903 3.2903 3.4832 3.4832 3.6866 3.6866 3.8313 3.8313 5.2042 5.2042 5.2601 5.2601 5.4583 5.4583 5.5310 5.5310 5.7040 5.7040 5.7869 5.7869 6.7771 6.7771 6.9804 6.9804 7.0167 7.0167 7.0780 7.0780 k = 0.5000-0.2337-0.4773 ( 8298 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5571 -38.5571 -38.5563 -38.5563 -37.5489 -37.5489 -37.5473 -37.5473 -37.5011 -37.5011 -37.5008 -37.5008 -9.8613 -9.8613 -9.7757 -9.7757 -9.5491 -9.5491 -9.4034 -9.4034 -9.3654 -9.3654 -9.3428 -9.3428 0.2048 0.2048 0.5127 0.5127 0.6818 0.6818 0.9249 0.9249 1.1436 1.1436 1.4497 1.4497 1.5560 1.5560 1.7694 1.7694 1.9931 1.9931 2.1077 2.1077 2.6065 2.6065 2.7973 2.7973 2.9865 2.9865 3.1852 3.1852 3.2920 3.2920 3.4775 3.4775 3.6794 3.6794 3.8134 3.8134 5.2116 5.2116 5.2690 5.2690 5.4422 5.4422 5.5241 5.5241 5.7097 5.7097 5.7870 5.7870 6.7834 6.7834 6.9759 6.9759 7.0220 7.0220 7.0811 7.0811 k = 0.5000-0.2214-0.4957 ( 8298 PWs) bands (ev): -66.5283 -66.5283 -66.5282 -66.5282 -38.5570 -38.5570 -38.5564 -38.5564 -37.5487 -37.5487 -37.5475 -37.5475 -37.5011 -37.5011 -37.5008 -37.5008 -9.8500 -9.8500 -9.7696 -9.7696 -9.5661 -9.5661 -9.4098 -9.4098 -9.3631 -9.3631 -9.3409 -9.3409 0.2402 0.2402 0.5038 0.5038 0.6929 0.6929 0.9109 0.9109 1.1405 1.1405 1.4373 1.4373 1.5493 1.5493 1.7601 1.7601 1.9971 1.9971 2.1150 2.1150 2.6220 2.6220 2.7957 2.7957 2.9751 2.9751 3.2005 3.2005 3.2926 3.2926 3.4729 3.4729 3.6714 3.6714 3.7964 3.7964 5.2191 5.2191 5.2774 5.2774 5.4263 5.4263 5.5180 5.5180 5.7153 5.7153 5.7874 5.7874 6.7886 6.7886 6.9687 6.9687 7.0288 7.0288 7.0846 7.0846 k = 0.5000-0.2090-0.5141 ( 8294 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5570 -38.5570 -38.5564 -38.5564 -37.5486 -37.5486 -37.5476 -37.5476 -37.5011 -37.5011 -37.5009 -37.5009 -9.8380 -9.8380 -9.7638 -9.7638 -9.5830 -9.5830 -9.4170 -9.4170 -9.3606 -9.3606 -9.3390 -9.3390 0.2748 0.2748 0.4948 0.4948 0.7029 0.7029 0.9003 0.9003 1.1366 1.1366 1.4253 1.4253 1.5452 1.5452 1.7536 1.7536 2.0014 2.0014 2.1219 2.1219 2.6297 2.6297 2.7957 2.7957 2.9643 2.9643 3.2126 3.2126 3.2925 3.2925 3.4695 3.4695 3.6631 3.6631 3.7807 3.7807 5.2267 5.2267 5.2850 5.2850 5.4111 5.4111 5.5129 5.5129 5.7207 5.7207 5.7880 5.7880 6.7927 6.7927 6.9596 6.9596 7.0354 7.0354 7.0887 7.0887 k = 0.5000-0.1966-0.5325 ( 8294 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5569 -38.5569 -38.5565 -38.5565 -37.5484 -37.5484 -37.5478 -37.5478 -37.5011 -37.5011 -37.5009 -37.5009 -9.8253 -9.8253 -9.7589 -9.7589 -9.5992 -9.5992 -9.4248 -9.4248 -9.3579 -9.3579 -9.3369 -9.3369 0.3066 0.3066 0.4869 0.4869 0.7112 0.7112 0.8941 0.8941 1.1322 1.1322 1.4139 1.4139 1.5440 1.5440 1.7499 1.7499 2.0057 2.0057 2.1286 2.1286 2.6291 2.6291 2.7972 2.7972 2.9546 2.9546 3.2197 3.2197 3.2921 3.2921 3.4670 3.4670 3.6547 3.6547 3.7664 3.7664 5.2341 5.2341 5.2914 5.2914 5.3971 5.3971 5.5089 5.5089 5.7256 5.7256 5.7888 5.7888 6.7957 6.7957 6.9490 6.9490 7.0410 7.0410 7.0934 7.0934 k = 0.5000-0.1843-0.5509 ( 8292 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5568 -38.5568 -38.5566 -38.5566 -37.5483 -37.5483 -37.5479 -37.5479 -37.5011 -37.5011 -37.5009 -37.5009 -9.8119 -9.8119 -9.7553 -9.7553 -9.6140 -9.6140 -9.4333 -9.4333 -9.3552 -9.3552 -9.3348 -9.3348 0.3329 0.3329 0.4823 0.4823 0.7177 0.7177 0.8928 0.8928 1.1270 1.1270 1.4034 1.4034 1.5457 1.5457 1.7490 1.7490 2.0096 2.0096 2.1350 2.1350 2.6212 2.6212 2.7991 2.7991 2.9462 2.9462 3.2208 3.2208 3.2921 3.2921 3.4654 3.4654 3.6467 3.6467 3.7536 3.7536 5.2413 5.2413 5.2964 5.2964 5.3849 5.3849 5.5065 5.5065 5.7300 5.7300 5.7901 5.7901 6.7978 6.7978 6.9373 6.9373 7.0449 7.0449 7.0987 7.0987 k = 0.5000-0.1719-0.5693 ( 8288 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5567 -38.5567 -38.5567 -38.5567 -37.5482 -37.5482 -37.5480 -37.5480 -37.5011 -37.5011 -37.5009 -37.5009 -9.7980 -9.7980 -9.7542 -9.7542 -9.6263 -9.6263 -9.4423 -9.4423 -9.3523 -9.3523 -9.3325 -9.3325 0.3498 0.3498 0.4838 0.4838 0.7230 0.7230 0.8965 0.8965 1.1214 1.1214 1.3943 1.3943 1.5499 1.5499 1.7510 1.7510 2.0131 2.0131 2.1414 2.1414 2.6075 2.6075 2.7993 2.7993 2.9393 2.9393 3.2159 3.2159 3.2927 3.2927 3.4644 3.4644 3.6392 3.6392 3.7424 3.7424 5.2479 5.2479 5.2999 5.2999 5.3750 5.3750 5.5059 5.5059 5.7336 5.7336 5.7917 5.7917 6.7989 6.7989 6.9244 6.9244 7.0472 7.0472 7.1040 7.1040 k = 0.5000-0.1596-0.5876 ( 8290 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5568 -38.5568 -38.5566 -38.5566 -37.5483 -37.5483 -37.5479 -37.5479 -37.5011 -37.5011 -37.5009 -37.5009 -9.7837 -9.7837 -9.7566 -9.7566 -9.6350 -9.6350 -9.4518 -9.4518 -9.3494 -9.3494 -9.3303 -9.3303 0.3551 0.3551 0.4925 0.4925 0.7283 0.7283 0.9047 0.9047 1.1152 1.1152 1.3869 1.3869 1.5564 1.5564 1.7562 1.7562 2.0158 2.0158 2.1482 2.1482 2.5897 2.5897 2.7959 2.7959 2.9338 2.9338 3.2057 3.2057 3.2935 3.2935 3.4640 3.4640 3.6320 3.6320 3.7327 3.7327 5.2536 5.2536 5.3023 5.3023 5.3677 5.3677 5.5073 5.5073 5.7364 5.7364 5.7936 5.7936 6.7989 6.7989 6.9108 6.9108 7.0478 7.0478 7.1090 7.1090 k = 0.5000-0.1472-0.6060 ( 8274 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5569 -38.5569 -38.5565 -38.5565 -37.5485 -37.5485 -37.5477 -37.5477 -37.5011 -37.5011 -37.5008 -37.5008 -9.7709 -9.7709 -9.7614 -9.7614 -9.6391 -9.6391 -9.4617 -9.4617 -9.3464 -9.3464 -9.3279 -9.3279 0.3507 0.3507 0.5055 0.5055 0.7352 0.7352 0.9166 0.9166 1.1088 1.1088 1.3811 1.3811 1.5646 1.5646 1.7647 1.7647 2.0175 2.0175 2.1559 2.1559 2.5691 2.5691 2.7875 2.7875 2.9294 2.9294 3.1911 3.1911 3.2943 3.2943 3.4644 3.4644 3.6251 3.6251 3.7242 3.7242 5.2581 5.2581 5.3039 5.3039 5.3633 5.3633 5.5107 5.5107 5.7382 5.7382 5.7960 5.7960 6.7978 6.7978 6.8967 6.8967 7.0470 7.0470 7.1134 7.1134 k = 0.5000-0.1349-0.6244 ( 8274 PWs) bands (ev): -66.5282 -66.5282 -66.5281 -66.5281 -38.5570 -38.5570 -38.5564 -38.5564 -37.5486 -37.5486 -37.5476 -37.5476 -37.5011 -37.5011 -37.5008 -37.5008 -9.7769 -9.7769 -9.7514 -9.7514 -9.6386 -9.6386 -9.4720 -9.4720 -9.3434 -9.3434 -9.3256 -9.3256 0.3403 0.3403 0.5182 0.5182 0.7449 0.7449 0.9313 0.9313 1.1023 1.1023 1.3770 1.3770 1.5742 1.5742 1.7765 1.7765 2.0179 2.0179 2.1651 2.1651 2.5464 2.5464 2.7733 2.7733 2.9255 2.9255 3.1724 3.1724 3.2954 3.2954 3.4658 3.4658 3.6180 3.6180 3.7167 3.7167 5.2614 5.2614 5.3052 5.3052 5.3619 5.3619 5.5158 5.5158 5.7390 5.7390 5.7985 5.7985 6.7952 6.7952 6.8828 6.8828 7.0449 7.0449 7.1169 7.1169 k = 0.5000-0.1225-0.6428 ( 8272 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5571 -38.5571 -38.5563 -38.5563 -37.5488 -37.5488 -37.5474 -37.5474 -37.5011 -37.5011 -37.5008 -37.5008 -9.7917 -9.7917 -9.7358 -9.7358 -9.6344 -9.6344 -9.4826 -9.4826 -9.3404 -9.3404 -9.3232 -9.3232 0.3268 0.3268 0.5278 0.5278 0.7577 0.7577 0.9482 0.9482 1.0962 1.0962 1.3743 1.3743 1.5845 1.5845 1.7917 1.7917 2.0170 2.0170 2.1767 2.1767 2.5222 2.5222 2.7538 2.7538 2.9211 2.9211 3.1500 3.1500 3.2973 3.2973 3.4683 3.4683 3.6104 3.6104 3.7101 3.7101 5.2637 5.2637 5.3061 5.3061 5.3635 5.3635 5.5226 5.5226 5.7389 5.7389 5.8010 5.8010 6.7905 6.7905 6.8698 6.8698 7.0414 7.0414 7.1195 7.1195 k = 0.5000-0.1102-0.6612 ( 8276 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5572 -38.5572 -38.5562 -38.5562 -37.5490 -37.5490 -37.5472 -37.5472 -37.5011 -37.5011 -37.5008 -37.5008 -9.8092 -9.8092 -9.7195 -9.7195 -9.6276 -9.6276 -9.4935 -9.4935 -9.3373 -9.3373 -9.3207 -9.3207 0.3119 0.3119 0.5335 0.5335 0.7730 0.7730 0.9664 0.9664 1.0913 1.0913 1.3725 1.3725 1.5952 1.5952 1.8100 1.8100 2.0145 2.0145 2.1914 2.1914 2.4968 2.4968 2.7298 2.7298 2.9149 2.9149 3.1240 3.1240 3.3005 3.3005 3.4720 3.4720 3.6019 3.6019 3.7042 3.7042 5.2657 5.2657 5.3064 5.3064 5.3683 5.3683 5.5304 5.5304 5.7379 5.7379 5.8035 5.8035 6.7831 6.7831 6.8587 6.8587 7.0367 7.0367 7.1210 7.1210 k = 0.5000-0.0978-0.6796 ( 8270 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5573 -38.5573 -38.5561 -38.5561 -37.5492 -37.5492 -37.5470 -37.5470 -37.5011 -37.5011 -37.5008 -37.5008 -9.8284 -9.8284 -9.7028 -9.7028 -9.6189 -9.6189 -9.5046 -9.5046 -9.3343 -9.3343 -9.3183 -9.3183 0.2966 0.2966 0.5357 0.5357 0.7896 0.7896 0.9850 0.9850 1.0886 1.0886 1.3713 1.3713 1.6059 1.6059 1.8308 1.8308 2.0106 2.0106 2.2102 2.2102 2.4702 2.4702 2.7027 2.7027 2.9058 2.9058 3.0951 3.0951 3.3055 3.3055 3.4765 3.4765 3.5922 3.5922 3.6992 3.6992 5.2680 5.2680 5.3060 5.3060 5.3760 5.3760 5.5391 5.5391 5.7360 5.7360 5.8057 5.8057 6.7728 6.7728 6.8500 6.8500 7.0307 7.0307 7.1216 7.1216 k = 0.7742 0.0378-0.3473 ( 8270 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5573 -38.5573 -38.5561 -38.5561 -37.5492 -37.5492 -37.5470 -37.5470 -37.5011 -37.5011 -37.5008 -37.5008 -9.8284 -9.8284 -9.7028 -9.7028 -9.6189 -9.6189 -9.5046 -9.5046 -9.3343 -9.3343 -9.3183 -9.3183 0.2966 0.2966 0.5357 0.5357 0.7896 0.7896 0.9850 0.9850 1.0886 1.0886 1.3713 1.3713 1.6059 1.6059 1.8308 1.8308 2.0106 2.0106 2.2102 2.2102 2.4702 2.4702 2.7027 2.7027 2.9058 2.9058 3.0951 3.0951 3.3055 3.3055 3.4765 3.4765 3.5922 3.5922 3.6992 3.6992 5.2680 5.2680 5.3060 5.3060 5.3760 5.3760 5.5391 5.5391 5.7360 5.7360 5.8057 5.8057 6.7728 6.7728 6.8500 6.8500 7.0307 7.0307 7.1216 7.1216 k = 0.7644 0.0452-0.3289 ( 8280 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5574 -38.5574 -38.5560 -38.5560 -37.5494 -37.5494 -37.5468 -37.5468 -37.5011 -37.5011 -37.5008 -37.5008 -9.8485 -9.8485 -9.6858 -9.6858 -9.6089 -9.6089 -9.5158 -9.5158 -9.3313 -9.3313 -9.3159 -9.3159 0.2815 0.2815 0.5355 0.5355 0.8060 0.8060 1.0016 1.0016 1.0904 1.0904 1.3700 1.3700 1.6162 1.6162 1.8530 1.8530 2.0053 2.0053 2.2335 2.2335 2.4421 2.4421 2.6740 2.6740 2.8927 2.8927 3.0641 3.0641 3.3120 3.3120 3.4812 3.4812 3.5815 3.5815 3.6954 3.6954 5.2712 5.2712 5.3049 5.3049 5.3861 5.3861 5.5482 5.5482 5.7334 5.7334 5.8076 5.8076 6.7600 6.7600 6.8439 6.8439 7.0236 7.0236 7.1215 7.1215 k = 0.7546 0.0527-0.3106 ( 8284 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5466 -37.5466 -37.5011 -37.5011 -37.5008 -37.5008 -9.8693 -9.8693 -9.6687 -9.6687 -9.5981 -9.5981 -9.5271 -9.5271 -9.3284 -9.3284 -9.3135 -9.3135 0.2672 0.2672 0.5339 0.5339 0.8214 0.8214 1.0134 1.0134 1.0996 1.0996 1.3685 1.3685 1.6261 1.6261 1.8754 1.8754 1.9993 1.9993 2.2621 2.2621 2.4121 2.4121 2.6453 2.6453 2.8747 2.8747 3.0321 3.0321 3.3198 3.3198 3.4851 3.4851 3.5703 3.5703 3.6931 3.6931 5.2753 5.2753 5.3037 5.3037 5.3978 5.3978 5.5574 5.5574 5.7300 5.7300 5.8090 5.8090 6.7456 6.7456 6.8397 6.8397 7.0155 7.0155 7.1206 7.1206 k = 0.7448 0.0602-0.2923 ( 8282 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5464 -37.5464 -37.5012 -37.5012 -37.5008 -37.5008 -9.8903 -9.8903 -9.6514 -9.6514 -9.5867 -9.5867 -9.5384 -9.5384 -9.3256 -9.3256 -9.3112 -9.3112 0.2538 0.2538 0.5316 0.5316 0.8353 0.8353 1.0189 1.0189 1.1173 1.1173 1.3665 1.3665 1.6353 1.6353 1.8963 1.8963 1.9933 1.9933 2.2955 2.2955 2.3801 2.3801 2.6181 2.6181 2.8510 2.8510 3.0004 3.0004 3.3282 3.3282 3.4867 3.4867 3.5598 3.5598 3.6930 3.6930 5.2803 5.2803 5.3027 5.3027 5.4109 5.4109 5.5665 5.5665 5.7260 5.7260 5.8099 5.8099 6.7306 6.7306 6.8368 6.8368 7.0065 7.0065 7.1192 7.1192 k = 0.7350 0.0677-0.2739 ( 8292 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5499 -37.5499 -37.5462 -37.5462 -37.5012 -37.5012 -37.5008 -37.5008 -9.9114 -9.9114 -9.6340 -9.6340 -9.5750 -9.5750 -9.5495 -9.5495 -9.3228 -9.3228 -9.3089 -9.3089 0.2416 0.2416 0.5293 0.5293 0.8477 0.8477 1.0198 1.0198 1.1414 1.1414 1.3640 1.3640 1.6434 1.6434 1.9131 1.9131 1.9893 1.9893 2.3274 2.3274 2.3514 2.3514 2.5939 2.5939 2.8218 2.8218 2.9698 2.9698 3.3363 3.3363 3.4841 3.4841 3.5520 3.5520 3.6956 3.6956 5.2855 5.2855 5.3027 5.3027 5.4248 5.4248 5.5751 5.5751 5.7213 5.7213 5.8102 5.8102 6.7158 6.7158 6.8349 6.8349 6.9968 6.9968 7.1173 7.1173 k = 0.7252 0.0752-0.2556 ( 8286 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5578 -38.5578 -38.5556 -38.5556 -37.5501 -37.5501 -37.5460 -37.5460 -37.5012 -37.5012 -37.5007 -37.5007 -9.9324 -9.9324 -9.6165 -9.6165 -9.5652 -9.5652 -9.5583 -9.5583 -9.3201 -9.3201 -9.3067 -9.3067 0.2309 0.2309 0.5275 0.5275 0.8587 0.8587 1.0183 1.0183 1.1687 1.1687 1.3614 1.3614 1.6501 1.6501 1.9227 1.9227 1.9904 1.9904 2.3033 2.3033 2.3780 2.3780 2.5747 2.5747 2.7883 2.7883 2.9408 2.9408 3.3428 3.3428 3.4771 3.4771 3.5478 3.5478 3.7015 3.7015 5.2895 5.2895 5.3049 5.3049 5.4393 5.4393 5.5832 5.5832 5.7162 5.7162 5.8099 5.8099 6.7021 6.7021 6.8334 6.8334 6.9866 6.9866 7.1150 7.1150 k = 0.7154 0.0827-0.2372 ( 8282 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5579 -38.5579 -38.5555 -38.5555 -37.5503 -37.5503 -37.5458 -37.5458 -37.5012 -37.5012 -37.5007 -37.5007 -9.9531 -9.9531 -9.5991 -9.5991 -9.5729 -9.5729 -9.5493 -9.5493 -9.3176 -9.3176 -9.3046 -9.3046 0.2217 0.2217 0.5265 0.5265 0.8685 0.8685 1.0160 1.0160 1.1966 1.1966 1.3596 1.3596 1.6548 1.6548 1.9238 1.9238 1.9981 1.9981 2.2640 2.2640 2.4136 2.4136 2.5634 2.5634 2.7537 2.7537 2.9129 2.9129 3.3458 3.3458 3.4677 3.4677 3.5466 3.5466 3.7110 3.7110 5.2910 5.2910 5.3105 5.3105 5.4541 5.4541 5.5903 5.5903 5.7106 5.7106 5.8089 5.8089 6.6900 6.6900 6.8324 6.8324 6.9762 6.9762 7.1124 7.1124 k = 0.7056 0.0901-0.2189 ( 8276 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5580 -38.5580 -38.5554 -38.5554 -37.5505 -37.5505 -37.5456 -37.5456 -37.5012 -37.5012 -37.5007 -37.5007 -9.9736 -9.9736 -9.5840 -9.5840 -9.5815 -9.5815 -9.5369 -9.5369 -9.3152 -9.3152 -9.3027 -9.3027 0.2142 0.2142 0.5265 0.5265 0.8774 0.8774 1.0136 1.0136 1.2224 1.2224 1.3603 1.3603 1.6567 1.6567 1.9192 1.9192 2.0101 2.0101 2.2229 2.2229 2.4350 2.4350 2.5643 2.5643 2.7241 2.7241 2.8859 2.8859 3.3438 3.3438 3.4593 3.4593 3.5470 3.5470 3.7241 3.7241 5.2910 5.2910 5.3181 5.3181 5.4688 5.4688 5.5963 5.5963 5.7049 5.7049 5.8071 5.8071 6.6800 6.6800 6.8315 6.8315 6.9658 6.9658 7.1096 7.1096 k = 0.6958 0.0976-0.2006 ( 8278 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5581 -38.5581 -38.5553 -38.5553 -37.5507 -37.5507 -37.5455 -37.5455 -37.5013 -37.5013 -37.5007 -37.5007 -9.9935 -9.9935 -9.5945 -9.5945 -9.5646 -9.5646 -9.5244 -9.5244 -9.3129 -9.3129 -9.3008 -9.3008 0.2084 0.2084 0.5279 0.5279 0.8858 0.8858 1.0114 1.0114 1.2425 1.2425 1.3666 1.3666 1.6549 1.6549 1.9125 1.9125 2.0232 2.0232 2.1816 2.1816 2.4348 2.4348 2.5704 2.5704 2.7124 2.7124 2.8595 2.8595 3.3360 3.3360 3.4540 3.4540 3.5483 3.5483 3.7408 3.7408 5.2903 5.2903 5.3266 5.3266 5.4834 5.4834 5.6008 5.6008 5.6992 5.6992 5.8044 5.8044 6.6725 6.6725 6.8308 6.8308 6.9558 6.9558 7.1066 7.1066 k = 0.6861 0.1051-0.1822 ( 8284 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5582 -38.5582 -38.5552 -38.5552 -37.5508 -37.5508 -37.5453 -37.5453 -37.5013 -37.5013 -37.5007 -37.5007 -10.0130 -10.0130 -9.6050 -9.6050 -9.5476 -9.5476 -9.5118 -9.5118 -9.3108 -9.3108 -9.2991 -9.2991 0.2044 0.2044 0.5306 0.5306 0.8938 0.8938 1.0096 1.0096 1.2539 1.2539 1.3812 1.3812 1.6487 1.6487 1.9057 1.9057 2.0358 2.0358 2.1417 2.1417 2.4177 2.4177 2.5626 2.5626 2.7295 2.7295 2.8354 2.8354 3.3239 3.3239 3.4519 3.4519 3.5504 3.5504 3.7607 3.7607 5.2894 5.2894 5.3352 5.3352 5.4975 5.4975 5.6036 5.6036 5.6941 5.6941 5.8008 5.8008 6.6677 6.6677 6.8301 6.8301 6.9463 6.9463 7.1035 7.1035 k = 0.6763 0.1126-0.1639 ( 8286 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5583 -38.5583 -38.5551 -38.5551 -37.5510 -37.5510 -37.5451 -37.5451 -37.5013 -37.5013 -37.5007 -37.5007 -10.0319 -10.0319 -9.6153 -9.6153 -9.5310 -9.5310 -9.4992 -9.4992 -9.3089 -9.3089 -9.2976 -9.2976 0.2023 0.2023 0.5350 0.5350 0.9016 0.9016 1.0082 1.0082 1.2563 1.2563 1.4041 1.4041 1.6375 1.6375 1.8997 1.8997 2.0456 2.0456 2.1058 2.1058 2.3897 2.3897 2.5427 2.5427 2.7556 2.7556 2.8238 2.8238 3.3105 3.3105 3.4519 3.4519 3.5534 3.5534 3.7833 3.7833 5.2883 5.2883 5.3435 5.3435 5.5108 5.5108 5.6042 5.6042 5.6900 5.6900 5.7961 5.7961 6.6659 6.6659 6.8293 6.8293 6.9377 6.9377 7.1004 7.1004 k = 0.6665 0.1201-0.1456 ( 8302 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5584 -38.5584 -38.5550 -38.5550 -37.5512 -37.5512 -37.5449 -37.5449 -37.5013 -37.5013 -37.5007 -37.5007 -10.0501 -10.0501 -9.6252 -9.6252 -9.5146 -9.5146 -9.4868 -9.4868 -9.3071 -9.3071 -9.2963 -9.2963 0.2020 0.2020 0.5409 0.5409 0.9093 0.9093 1.0073 1.0073 1.2525 1.2525 1.4322 1.4322 1.6213 1.6213 1.8946 1.8946 2.0455 2.0455 2.0819 2.0819 2.3540 2.3540 2.5206 2.5206 2.7504 2.7504 2.8488 2.8488 3.2998 3.2998 3.4532 3.4532 3.5574 3.5574 3.8083 3.8083 5.2870 5.2870 5.3511 5.3511 5.5230 5.5230 5.6025 5.6025 5.6872 5.6872 5.7901 5.7901 6.6669 6.6669 6.8284 6.8284 6.9303 6.9303 7.0974 7.0974 k = 0.6567 0.1275-0.1272 ( 8310 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5585 -38.5585 -38.5549 -38.5549 -37.5513 -37.5513 -37.5448 -37.5448 -37.5014 -37.5014 -37.5007 -37.5007 -10.0675 -10.0675 -9.6348 -9.6348 -9.4987 -9.4987 -9.4745 -9.4745 -9.3056 -9.3056 -9.2952 -9.2952 0.2036 0.2036 0.5485 0.5485 0.9169 0.9169 1.0069 1.0069 1.2450 1.2450 1.4617 1.4617 1.6014 1.6014 1.8893 1.8893 2.0262 2.0262 2.0799 2.0799 2.3141 2.3141 2.4999 2.4999 2.7255 2.7255 2.8886 2.8886 3.2963 3.2963 3.4551 3.4551 3.5623 3.5623 3.8353 3.8353 5.2857 5.2857 5.3579 5.3579 5.5332 5.5332 5.5994 5.5994 5.6858 5.6858 5.7830 5.7830 6.6708 6.6708 6.8272 6.8272 6.9245 6.9245 7.0946 7.0946 k = 0.6469 0.1350-0.1089 ( 8312 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5585 -38.5585 -38.5548 -38.5548 -37.5515 -37.5515 -37.5446 -37.5446 -37.5014 -37.5014 -37.5006 -37.5006 -10.0842 -10.0842 -9.6440 -9.6440 -9.4832 -9.4832 -9.4625 -9.4625 -9.3043 -9.3043 -9.2944 -9.2944 0.2070 0.2070 0.5579 0.5579 0.9247 0.9247 1.0068 1.0068 1.2356 1.2356 1.4867 1.4867 1.5825 1.5825 1.8823 1.8823 2.0041 2.0041 2.0836 2.0836 2.2738 2.2738 2.4805 2.4805 2.6960 2.6960 2.9214 2.9214 3.3045 3.3045 3.4579 3.4579 3.5682 3.5682 3.8640 3.8640 5.2843 5.2843 5.3636 5.3636 5.5399 5.5399 5.5964 5.5964 5.6857 5.6857 5.7747 5.7747 6.6773 6.6773 6.8256 6.8256 6.9206 6.9206 7.0921 7.0921 k = 0.6371 0.1425-0.0906 ( 8322 PWs) bands (ev): -66.5286 -66.5286 -66.5279 -66.5279 -38.5586 -38.5586 -38.5548 -38.5548 -37.5516 -37.5516 -37.5444 -37.5444 -37.5014 -37.5014 -37.5006 -37.5006 -10.1000 -10.1000 -9.6527 -9.6527 -9.4681 -9.4681 -9.4506 -9.4506 -9.3032 -9.3032 -9.2938 -9.2938 0.2122 0.2122 0.5689 0.5689 0.9324 0.9324 1.0069 1.0069 1.2251 1.2251 1.4930 1.4930 1.5790 1.5790 1.8719 1.8719 1.9871 1.9871 2.0842 2.0842 2.2376 2.2376 2.4617 2.4617 2.6647 2.6647 2.9398 2.9398 3.3268 3.3268 3.4619 3.4619 3.5754 3.5754 3.8942 3.8942 5.2828 5.2828 5.3682 5.3682 5.5408 5.5408 5.5961 5.5961 5.6862 5.6862 5.7652 5.7652 6.6858 6.6858 6.8234 6.8234 6.9191 6.9191 7.0900 7.0900 k = 0.6273 0.1500-0.0722 ( 8332 PWs) bands (ev): -66.5286 -66.5286 -66.5279 -66.5279 -38.5587 -38.5587 -38.5547 -38.5547 -37.5518 -37.5518 -37.5443 -37.5443 -37.5014 -37.5014 -37.5006 -37.5006 -10.1149 -10.1149 -9.6610 -9.6610 -9.4537 -9.4537 -9.4391 -9.4391 -9.3024 -9.3024 -9.2935 -9.2935 0.2190 0.2190 0.5817 0.5817 0.9400 0.9400 1.0071 1.0071 1.2144 1.2144 1.4726 1.4726 1.5988 1.5988 1.8572 1.8572 1.9758 1.9758 2.0780 2.0780 2.2104 2.2104 2.4428 2.4428 2.6325 2.6325 2.9434 2.9434 3.3604 3.3604 3.4680 3.4680 3.5847 3.5847 3.9256 3.9256 5.2813 5.2813 5.3715 5.3715 5.5350 5.5350 5.5996 5.5996 5.6870 5.6870 5.7550 5.7550 6.6958 6.6958 6.8207 6.8207 6.9202 6.9202 7.0884 7.0884 k = 0.6175 0.1575-0.0539 ( 8338 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5588 -38.5588 -38.5546 -38.5546 -37.5519 -37.5519 -37.5442 -37.5442 -37.5015 -37.5015 -37.5006 -37.5006 -10.1289 -10.1289 -9.6688 -9.6688 -9.4398 -9.4398 -9.4279 -9.4279 -9.3018 -9.3018 -9.2936 -9.2936 0.2275 0.2275 0.5960 0.5960 0.9474 0.9474 1.0071 1.0071 1.2038 1.2038 1.4399 1.4399 1.6282 1.6282 1.8389 1.8389 1.9683 1.9683 2.0642 2.0642 2.1952 2.1952 2.4236 2.4236 2.5999 2.5999 2.9356 2.9356 3.3976 3.3976 3.4780 3.4780 3.5978 3.5978 3.9581 3.9581 5.2800 5.2800 5.3735 5.3735 5.5241 5.5241 5.6056 5.6056 5.6873 5.6873 5.7446 5.7446 6.7066 6.7066 6.8173 6.8173 6.9241 6.9241 7.0875 7.0875 k = 0.6077 0.1649-0.0355 ( 8334 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5589 -38.5589 -38.5545 -38.5545 -37.5520 -37.5520 -37.5440 -37.5440 -37.5015 -37.5015 -37.5006 -37.5006 -10.1420 -10.1420 -9.6761 -9.6761 -9.4266 -9.4266 -9.4170 -9.4170 -9.3016 -9.3016 -9.2939 -9.2939 0.2374 0.2374 0.6120 0.6120 0.9545 0.9545 1.0069 1.0069 1.1936 1.1936 1.4029 1.4029 1.6582 1.6582 1.8187 1.8187 1.9618 1.9618 2.0476 2.0476 2.1899 2.1899 2.4037 2.4037 2.5670 2.5670 2.9206 2.9206 3.4281 3.4281 3.4940 3.4940 3.6177 3.6177 3.9914 3.9914 5.2789 5.2789 5.3742 5.3742 5.5101 5.5101 5.6123 5.6123 5.6861 5.6861 5.7352 5.7352 6.7174 6.7174 6.8136 6.8136 6.9307 6.9307 7.0874 7.0874 k = 0.5979 0.1724-0.0172 ( 8328 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5589 -38.5589 -38.5545 -38.5545 -37.5521 -37.5521 -37.5439 -37.5439 -37.5015 -37.5015 -37.5006 -37.5006 -10.1540 -10.1540 -9.6828 -9.6828 -9.4140 -9.4140 -9.4066 -9.4066 -9.3016 -9.3016 -9.2946 -9.2946 0.2485 0.2485 0.6293 0.6293 0.9610 0.9610 1.0060 1.0060 1.1844 1.1844 1.3650 1.3650 1.6826 1.6826 1.8013 1.8013 1.9537 1.9537 2.0345 2.0345 2.1903 2.1903 2.3831 2.3831 2.5342 2.5342 2.9016 2.9016 3.4471 3.4471 3.5135 3.5135 3.6477 3.6477 4.0255 4.0255 5.2782 5.2782 5.3736 5.3736 5.4943 5.4943 5.6184 5.6184 5.6824 5.6824 5.7282 5.7282 6.7276 6.7276 6.8096 6.8096 6.9398 6.9398 7.0882 7.0882 k = 0.5881 0.1799 0.0011 ( 8324 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5544 -38.5544 -37.5522 -37.5522 -37.5438 -37.5438 -37.5015 -37.5015 -37.5006 -37.5006 -10.1649 -10.1649 -9.6890 -9.6890 -9.4021 -9.4021 -9.3965 -9.3965 -9.3020 -9.3020 -9.2957 -9.2957 0.2607 0.2607 0.6479 0.6479 0.9665 0.9665 1.0042 1.0042 1.1763 1.1763 1.3278 1.3278 1.6909 1.6909 1.7966 1.7966 1.9442 1.9442 2.0275 2.0275 2.1931 2.1931 2.3622 2.3622 2.5017 2.5017 2.8807 2.8807 3.4588 3.4588 3.5298 3.5298 3.6873 3.6873 4.0602 4.0602 5.2781 5.2781 5.3717 5.3717 5.4773 5.4773 5.6228 5.6228 5.6762 5.6762 5.7245 5.7245 6.7367 6.7367 6.8056 6.8056 6.9506 6.9506 7.0901 7.0901 k = 0.5783 0.1874 0.0195 ( 8328 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5544 -38.5544 -37.5523 -37.5523 -37.5437 -37.5437 -37.5015 -37.5015 -37.5006 -37.5006 -10.1748 -10.1748 -9.6946 -9.6946 -9.3909 -9.3909 -9.3869 -9.3869 -9.3027 -9.3027 -9.2972 -9.2972 0.2736 0.2736 0.6675 0.6675 0.9706 0.9706 1.0014 1.0014 1.1696 1.1696 1.2926 1.2926 1.6767 1.6767 1.8111 1.8111 1.9354 1.9354 2.0257 2.0257 2.1967 2.1967 2.3411 2.3411 2.4697 2.4697 2.8596 2.8596 3.4673 3.4673 3.5410 3.5410 3.7317 3.7317 4.0953 4.0953 5.2786 5.2786 5.3685 5.3685 5.4596 5.4596 5.6241 5.6241 5.6695 5.6695 5.7234 5.7234 6.7445 6.7445 6.8018 6.8018 6.9624 6.9624 7.0934 7.0934 k = 0.5685 0.1949 0.0378 ( 8322 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5543 -38.5543 -37.5524 -37.5524 -37.5436 -37.5436 -37.5015 -37.5015 -37.5006 -37.5006 -10.1836 -10.1836 -9.6995 -9.6995 -9.3806 -9.3806 -9.3777 -9.3777 -9.3038 -9.3038 -9.2990 -9.2990 0.2870 0.2870 0.6878 0.6878 0.9729 0.9729 0.9974 0.9974 1.1645 1.1645 1.2606 1.2606 1.6498 1.6498 1.8354 1.8354 1.9299 1.9299 2.0269 2.0269 2.1999 2.1999 2.3204 2.3204 2.4385 2.4385 2.8392 2.8392 3.4742 3.4742 3.5488 3.5488 3.7760 3.7760 4.1304 4.1304 5.2801 5.2801 5.3642 5.3642 5.4416 5.4416 5.6210 5.6210 5.6651 5.6651 5.7240 5.7240 6.7508 6.7508 6.7982 6.7982 6.9743 6.9743 7.0980 7.0980 k = 0.5588 0.2023 0.0561 ( 8320 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5543 -38.5543 -37.5525 -37.5525 -37.5435 -37.5435 -37.5016 -37.5016 -37.5006 -37.5006 -10.1913 -10.1913 -9.7038 -9.7038 -9.3709 -9.3709 -9.3690 -9.3690 -9.3053 -9.3053 -9.3013 -9.3013 0.3002 0.3002 0.7085 0.7085 0.9727 0.9727 0.9924 0.9924 1.1608 1.1608 1.2330 1.2330 1.6189 1.6189 1.8596 1.8596 1.9305 1.9305 2.0298 2.0298 2.2020 2.2020 2.3006 2.3006 2.4084 2.4084 2.8203 2.8203 3.4801 3.4801 3.5544 3.5544 3.8170 3.8170 4.1647 4.1647 5.2826 5.2826 5.3588 5.3588 5.4236 5.4236 5.6139 5.6139 5.6638 5.6638 5.7254 5.7254 6.7556 6.7556 6.7952 6.7952 6.9852 6.9852 7.1039 7.1039 k = 0.5490 0.2098 0.0745 ( 8322 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5542 -38.5542 -37.5525 -37.5525 -37.5435 -37.5435 -37.5016 -37.5016 -37.5006 -37.5006 -10.1978 -10.1978 -9.7075 -9.7075 -9.3621 -9.3621 -9.3609 -9.3609 -9.3072 -9.3072 -9.3039 -9.3039 0.3130 0.3130 0.7290 0.7290 0.9696 0.9696 0.9868 0.9868 1.1585 1.1585 1.2106 1.2106 1.5882 1.5882 1.8764 1.8764 1.9411 1.9411 2.0336 2.0336 2.2022 2.2022 2.2827 2.2827 2.3802 2.3802 2.8035 2.8035 3.4851 3.4851 3.5588 3.5588 3.8527 3.8527 4.1974 4.1974 5.2863 5.2863 5.3527 5.3527 5.4058 5.4058 5.6049 5.6049 5.6645 5.6645 5.7270 5.7270 6.7591 6.7591 6.7927 6.7927 6.9946 6.9946 7.1108 7.1108 k = 0.5392 0.2173 0.0928 ( 8316 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5434 -37.5434 -37.5016 -37.5016 -37.5005 -37.5005 -10.2031 -10.2031 -9.7106 -9.7106 -9.3541 -9.3541 -9.3533 -9.3533 -9.3096 -9.3096 -9.3069 -9.3069 0.3247 0.3247 0.7486 0.7486 0.9639 0.9639 0.9808 0.9808 1.1570 1.1570 1.1939 1.1939 1.5601 1.5601 1.8843 1.8843 1.9613 1.9613 2.0380 2.0380 2.1992 2.1992 2.2678 2.2678 2.3545 2.3545 2.7892 2.7892 3.4891 3.4891 3.5623 3.5623 3.8823 3.8823 4.2272 4.2272 5.2914 5.2914 5.3464 5.3464 5.3886 5.3886 5.5961 5.5961 5.6658 5.6658 5.7287 5.7287 6.7615 6.7615 6.7909 6.7909 7.0021 7.0021 7.1181 7.1181 k = 0.5294 0.2248 0.1111 ( 8318 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.2073 -10.2073 -9.7129 -9.7129 -9.3470 -9.3470 -9.3463 -9.3463 -9.3124 -9.3124 -9.3102 -9.3102 0.3347 0.3347 0.7664 0.7664 0.9567 0.9567 0.9749 0.9749 1.1556 1.1556 1.1831 1.1831 1.5363 1.5363 1.8873 1.8873 1.9844 1.9844 2.0432 2.0432 2.1924 2.1924 2.2569 2.2569 2.3326 2.3326 2.7777 2.7777 3.4922 3.4922 3.5650 3.5650 3.9054 3.9054 4.2524 4.2524 5.2980 5.2980 5.3404 5.3404 5.3722 5.3722 5.5885 5.5885 5.6671 5.6671 5.7301 5.7301 6.7629 6.7629 6.7897 6.7897 7.0076 7.0076 7.1250 7.1250 k = 0.5196 0.2323 0.1295 ( 8312 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2103 -10.2103 -9.7146 -9.7146 -9.3407 -9.3407 -9.3403 -9.3403 -9.3156 -9.3156 -9.3136 -9.3136 0.3424 0.3424 0.7811 0.7811 0.9496 0.9496 0.9696 0.9696 1.1539 1.1539 1.1775 1.1775 1.5181 1.5181 1.8887 1.8887 2.0044 2.0044 2.0499 2.0499 2.1823 2.1823 2.2501 2.2501 2.3158 2.3158 2.7693 2.7693 3.4944 3.4944 3.5670 3.5670 3.9218 3.9218 4.2718 4.2718 5.3060 5.3060 5.3353 5.3353 5.3570 5.3570 5.5828 5.5828 5.6682 5.6682 5.7312 5.7312 6.7637 6.7637 6.7890 6.7890 7.0113 7.0113 7.1307 7.1307 k = 0.5098 0.2398 0.1478 ( 8302 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.2121 -10.2121 -9.7156 -9.7156 -9.3361 -9.3361 -9.3355 -9.3355 -9.3188 -9.3188 -9.3164 -9.3164 0.3472 0.3472 0.7911 0.7911 0.9442 0.9442 0.9658 0.9658 1.1523 1.1523 1.1753 1.1753 1.5067 1.5067 1.8893 1.8893 2.0166 2.0166 2.0578 2.0578 2.1724 2.1724 2.2465 2.2465 2.3054 2.3054 2.7642 2.7642 3.4957 3.4957 3.5682 3.5682 3.9316 3.9316 4.2840 4.2840 5.3153 5.3153 5.3311 5.3311 5.3441 5.3441 5.5793 5.5793 5.6689 5.6689 5.7319 5.7319 6.7641 6.7641 6.7886 6.7886 7.0135 7.0135 7.1344 7.1344 k = 0.5000 0.2472 0.1661 ( 8288 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2127 -10.2127 -9.7160 -9.7160 -9.3342 -9.3342 -9.3332 -9.3332 -9.3204 -9.3204 -9.3177 -9.3177 0.3489 0.3489 0.7946 0.7946 0.9422 0.9422 0.9645 0.9645 1.1517 1.1517 1.1747 1.1747 1.5028 1.5028 1.8895 1.8895 2.0203 2.0203 2.0617 2.0617 2.1680 2.1680 2.2454 2.2454 2.3018 2.3018 2.7625 2.7625 3.4962 3.4962 3.5686 3.5686 3.9349 3.9349 4.2882 4.2882 5.3247 5.3247 5.3253 5.3253 5.3380 5.3380 5.5781 5.5781 5.6692 5.6692 5.7322 5.7322 6.7642 6.7642 6.7885 6.7885 7.0142 7.0142 7.1356 7.1356 k = 0.5000 0.2472 0.1661 ( 8288 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2127 -10.2127 -9.7160 -9.7160 -9.3342 -9.3342 -9.3332 -9.3332 -9.3204 -9.3204 -9.3177 -9.3177 0.3489 0.3489 0.7946 0.7946 0.9422 0.9422 0.9645 0.9645 1.1517 1.1517 1.1747 1.1747 1.5028 1.5028 1.8895 1.8895 2.0203 2.0203 2.0617 2.0617 2.1680 2.1680 2.2454 2.2454 2.3018 2.3018 2.7625 2.7625 3.4962 3.4962 3.5686 3.5686 3.9349 3.9349 4.2882 4.2882 5.3247 5.3247 5.3253 5.3253 5.3380 5.3380 5.5781 5.5781 5.6692 5.6692 5.7322 5.7322 6.7642 6.7642 6.7885 6.7885 7.0142 7.0142 7.1356 7.1356 k = 0.4808 0.2377 0.1598 ( 8276 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2136 -10.2136 -9.7149 -9.7149 -9.3342 -9.3342 -9.3332 -9.3332 -9.3204 -9.3204 -9.3177 -9.3177 0.3492 0.3492 0.7910 0.7910 0.9341 0.9341 0.9720 0.9720 1.1408 1.1408 1.1850 1.1850 1.5009 1.5009 1.8882 1.8882 2.0189 2.0189 2.0612 2.0612 2.1699 2.1699 2.2461 2.2461 2.3065 2.3065 2.7650 2.7650 3.4971 3.4971 3.5694 3.5694 3.9355 3.9355 4.2885 4.2885 5.3247 5.3247 5.3252 5.3252 5.3380 5.3380 5.5779 5.5779 5.6691 5.6691 5.7321 5.7321 6.7647 6.7647 6.7889 6.7889 7.0146 7.0146 7.1357 7.1357 k = 0.4615 0.2282 0.1534 ( 8282 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2162 -10.2162 -9.7118 -9.7118 -9.3342 -9.3342 -9.3332 -9.3332 -9.3204 -9.3204 -9.3177 -9.3177 0.3500 0.3500 0.7800 0.7800 0.9198 0.9198 0.9845 0.9845 1.1228 1.1228 1.2010 1.2010 1.4956 1.4956 1.8844 1.8844 2.0150 2.0150 2.0597 2.0597 2.1749 2.1749 2.2480 2.2480 2.3203 2.3203 2.7728 2.7728 3.5000 3.5000 3.5717 3.5717 3.9372 3.9372 4.2896 4.2896 5.3248 5.3248 5.3249 5.3249 5.3377 5.3377 5.5772 5.5772 5.6690 5.6690 5.7320 5.7320 6.7663 6.7663 6.7899 6.7899 7.0156 7.0156 7.1359 7.1359 k = 0.4423 0.2187 0.1470 ( 8294 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2204 -10.2204 -9.7067 -9.7067 -9.3342 -9.3342 -9.3333 -9.3333 -9.3204 -9.3204 -9.3176 -9.3176 0.3514 0.3514 0.7620 0.7620 0.9043 0.9043 0.9969 0.9969 1.1037 1.1037 1.2168 1.2168 1.4881 1.4881 1.8786 1.8786 2.0094 2.0094 2.0575 2.0575 2.1813 2.1813 2.2509 2.2509 2.3418 2.3418 2.7865 2.7865 3.5047 3.5047 3.5755 3.5755 3.9401 3.9401 4.2915 4.2915 5.3246 5.3246 5.3248 5.3248 5.3373 5.3373 5.5758 5.5758 5.6687 5.6687 5.7316 5.7316 6.7689 6.7689 6.7915 6.7915 7.0174 7.0174 7.1362 7.1362 k = 0.4231 0.2092 0.1406 ( 8297 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2260 -10.2260 -9.6998 -9.6998 -9.3342 -9.3342 -9.3333 -9.3333 -9.3203 -9.3203 -9.3175 -9.3175 0.3533 0.3533 0.7373 0.7373 0.8887 0.8887 1.0081 1.0081 1.0844 1.0844 1.2314 1.2314 1.4797 1.4797 1.8710 1.8710 2.0027 2.0027 2.0548 2.0548 2.1877 2.1877 2.2547 2.2547 2.3683 2.3683 2.8072 2.8072 3.5112 3.5112 3.5807 3.5807 3.9442 3.9442 4.2940 4.2940 5.3241 5.3241 5.3249 5.3249 5.3368 5.3368 5.5740 5.5740 5.6683 5.6683 5.7311 5.7311 6.7724 6.7724 6.7938 6.7938 7.0198 7.0198 7.1366 7.1366 k = 0.4038 0.1997 0.1342 ( 8270 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2329 -10.2329 -9.6913 -9.6913 -9.3342 -9.3342 -9.3333 -9.3333 -9.3202 -9.3202 -9.3175 -9.3175 0.3557 0.3557 0.7066 0.7066 0.8732 0.8732 1.0178 1.0178 1.0655 1.0655 1.2442 1.2442 1.4718 1.4718 1.8621 1.8621 1.9958 1.9958 2.0521 2.0521 2.1937 2.1937 2.2592 2.2592 2.3963 2.3963 2.8361 2.8361 3.5192 3.5192 3.5873 3.5873 3.9494 3.9494 4.2972 4.2972 5.3235 5.3235 5.3251 5.3251 5.3363 5.3363 5.5718 5.5718 5.6677 5.6677 5.7305 5.7305 6.7770 6.7770 6.7968 6.7968 7.0228 7.0228 7.1371 7.1371 k = 0.3846 0.1902 0.1278 ( 8276 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2409 -10.2409 -9.6814 -9.6814 -9.3342 -9.3342 -9.3333 -9.3333 -9.3201 -9.3201 -9.3174 -9.3174 0.3586 0.3586 0.6708 0.6708 0.8583 0.8583 1.0257 1.0257 1.0472 1.0472 1.2548 1.2548 1.4652 1.4652 1.8519 1.8519 1.9890 1.9890 2.0497 2.0497 2.1992 2.1992 2.2641 2.2641 2.4227 2.4227 2.8741 2.8741 3.5286 3.5286 3.5950 3.5950 3.9559 3.9559 4.3010 4.3010 5.3229 5.3229 5.3253 5.3253 5.3357 5.3357 5.5690 5.5690 5.6668 5.6668 5.7295 5.7295 6.7824 6.7824 6.8003 6.8003 7.0262 7.0262 7.1376 7.1376 k = 0.3654 0.1807 0.1214 ( 8270 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5005 -37.5005 -10.2498 -10.2498 -9.6705 -9.6705 -9.3343 -9.3343 -9.3333 -9.3333 -9.3200 -9.3200 -9.3172 -9.3172 0.3619 0.3619 0.6307 0.6307 0.8440 0.8440 1.0299 1.0299 1.0314 1.0314 1.2630 1.2630 1.4605 1.4605 1.8407 1.8407 1.9831 1.9831 2.0479 2.0479 2.2042 2.2042 2.2692 2.2692 2.4450 2.4450 2.9214 2.9214 3.5392 3.5392 3.6038 3.6038 3.9635 3.9635 4.3053 4.3053 5.3223 5.3223 5.3255 5.3255 5.3351 5.3351 5.5656 5.5656 5.6657 5.6657 5.7283 5.7283 6.7886 6.7886 6.8045 6.8045 7.0299 7.0299 7.1381 7.1381 k = 0.3462 0.1712 0.1150 ( 8282 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5005 -37.5005 -10.2592 -10.2592 -9.6586 -9.6586 -9.3343 -9.3343 -9.3333 -9.3333 -9.3198 -9.3198 -9.3171 -9.3171 0.3654 0.3654 0.5876 0.5876 0.8305 0.8305 1.0136 1.0136 1.0349 1.0349 1.2683 1.2683 1.4578 1.4578 1.8288 1.8288 1.9784 1.9784 2.0471 2.0471 2.2089 2.2089 2.2744 2.2744 2.4623 2.4623 2.9773 2.9773 3.5508 3.5508 3.6134 3.6134 3.9725 3.9725 4.3102 4.3102 5.3217 5.3217 5.3257 5.3257 5.3345 5.3345 5.5616 5.5616 5.6643 5.6643 5.7268 5.7268 6.7956 6.7956 6.8094 6.8094 7.0339 7.0339 7.1384 7.1384 k = 0.3269 0.1617 0.1086 ( 8288 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.2691 -10.2691 -9.6461 -9.6461 -9.3343 -9.3343 -9.3334 -9.3334 -9.3197 -9.3197 -9.3170 -9.3170 0.3689 0.3689 0.5427 0.5427 0.8180 0.8180 0.9986 0.9986 1.0361 1.0361 1.2707 1.2707 1.4572 1.4572 1.8163 1.8163 1.9751 1.9751 2.0473 2.0473 2.2133 2.2133 2.2795 2.2795 2.4745 2.4745 3.0402 3.0402 3.5632 3.5632 3.6237 3.6237 3.9829 3.9829 4.3155 4.3155 5.3213 5.3213 5.3260 5.3260 5.3340 5.3340 5.5571 5.5571 5.6626 5.6626 5.7249 5.7249 6.8033 6.8033 6.8148 6.8148 7.0379 7.0379 7.1387 7.1387 k = 0.3077 0.1521 0.1022 ( 8288 PWs) bands (ev): -66.5287 -66.5287 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.2792 -10.2792 -9.6332 -9.6332 -9.3343 -9.3343 -9.3334 -9.3334 -9.3196 -9.3196 -9.3168 -9.3168 0.3718 0.3718 0.4975 0.4975 0.8066 0.8066 0.9849 0.9849 1.0349 1.0349 1.2698 1.2698 1.4582 1.4582 1.8038 1.8038 1.9735 1.9735 2.0487 2.0487 2.2174 2.2174 2.2846 2.2846 2.4821 2.4821 3.1081 3.1081 3.5761 3.5761 3.6346 3.6346 3.9947 3.9947 4.3211 4.3211 5.3210 5.3210 5.3262 5.3262 5.3337 5.3337 5.5519 5.5519 5.6605 5.6605 5.7227 5.7227 6.8117 6.8117 6.8208 6.8208 7.0418 7.0418 7.1387 7.1387 k = 0.2885 0.1426 0.0959 ( 8303 PWs) bands (ev): -66.5287 -66.5287 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.2894 -10.2894 -9.6201 -9.6201 -9.3343 -9.3343 -9.3334 -9.3334 -9.3194 -9.3194 -9.3167 -9.3167 0.3722 0.3722 0.4548 0.4548 0.7963 0.7963 0.9727 0.9727 1.0314 1.0314 1.2659 1.2659 1.4604 1.4604 1.7916 1.7916 1.9734 1.9734 2.0513 2.0513 2.2213 2.2213 2.2895 2.2895 2.4861 2.4861 3.1791 3.1791 3.5893 3.5893 3.6458 3.6458 4.0082 4.0082 4.3269 4.3269 5.3209 5.3209 5.3264 5.3264 5.3334 5.3334 5.5460 5.5460 5.6581 5.6581 5.7201 5.7201 6.8206 6.8206 6.8275 6.8275 7.0454 7.0454 7.1384 7.1384 k = 0.2692 0.1331 0.0895 ( 8315 PWs) bands (ev): -66.5287 -66.5287 -66.5278 -66.5278 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.2995 -10.2995 -9.6069 -9.6069 -9.3344 -9.3344 -9.3334 -9.3334 -9.3193 -9.3193 -9.3165 -9.3165 0.3630 0.3630 0.4225 0.4225 0.7874 0.7874 0.9621 0.9621 1.0256 1.0256 1.2590 1.2590 1.4634 1.4634 1.7802 1.7802 1.9749 1.9749 2.0550 2.0550 2.2249 2.2249 2.2942 2.2942 2.4870 2.4870 3.2513 3.2513 3.6026 3.6026 3.6572 3.6572 4.0236 4.0236 4.3330 4.3330 5.3209 5.3209 5.3267 5.3267 5.3334 5.3334 5.5396 5.5396 5.6553 5.6553 5.7171 5.7171 6.8299 6.8299 6.8348 6.8348 7.0485 7.0485 7.1377 7.1377 k = 0.2500 0.1236 0.0831 ( 8309 PWs) bands (ev): -66.5287 -66.5287 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.3094 -10.3094 -9.5940 -9.5940 -9.3344 -9.3344 -9.3334 -9.3334 -9.3191 -9.3191 -9.3164 -9.3164 0.3344 0.3344 0.4108 0.4108 0.7798 0.7798 0.9529 0.9529 1.0179 1.0179 1.2495 1.2495 1.4664 1.4664 1.7704 1.7704 1.9776 1.9776 2.0598 2.0598 2.2282 2.2282 2.2988 2.2988 2.4857 2.4857 3.3229 3.3229 3.6158 3.6158 3.6685 3.6685 4.0410 4.0410 4.3391 4.3391 5.3213 5.3213 5.3270 5.3270 5.3335 5.3335 5.5325 5.5325 5.6522 5.6522 5.7137 5.7137 6.8398 6.8398 6.8427 6.8427 7.0511 7.0511 7.1366 7.1366 k = 0.2308 0.1141 0.0767 ( 8291 PWs) bands (ev): -66.5287 -66.5287 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.3190 -10.3190 -9.5813 -9.5813 -9.3344 -9.3344 -9.3334 -9.3334 -9.3190 -9.3190 -9.3162 -9.3162 0.2957 0.2957 0.4111 0.4111 0.7736 0.7736 0.9453 0.9453 1.0083 1.0083 1.2378 1.2378 1.4688 1.4688 1.7626 1.7626 1.9813 1.9813 2.0653 2.0653 2.2310 2.2310 2.3032 2.3032 2.4826 2.4826 3.3923 3.3923 3.6288 3.6288 3.6798 3.6798 4.0609 4.0609 4.3452 4.3452 5.3218 5.3218 5.3273 5.3273 5.3338 5.3338 5.5248 5.5248 5.6488 5.6488 5.7101 5.7101 6.8500 6.8500 6.8512 6.8512 7.0528 7.0528 7.1349 7.1349 k = 0.2115 0.1046 0.0703 ( 8297 PWs) bands (ev): -66.5287 -66.5287 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.3281 -10.3281 -9.5692 -9.5692 -9.3344 -9.3344 -9.3334 -9.3334 -9.3188 -9.3188 -9.3161 -9.3161 0.2556 0.2556 0.4150 0.4150 0.7688 0.7688 0.9393 0.9393 0.9972 0.9972 1.2242 1.2242 1.4701 1.4701 1.7574 1.7574 1.9856 1.9856 2.0715 2.0715 2.2331 2.2331 2.3074 2.3074 2.4785 2.4785 3.4580 3.4580 3.6413 3.6413 3.6907 3.6907 4.0833 4.0833 4.3513 4.3513 5.3226 5.3226 5.3275 5.3275 5.3343 5.3343 5.5165 5.5165 5.6452 5.6452 5.7062 5.7062 6.8603 6.8603 6.8605 6.8605 7.0535 7.0535 7.1325 7.1325 k = 0.1923 0.0951 0.0639 ( 8282 PWs) bands (ev): -66.5287 -66.5287 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5006 -37.5006 -10.3367 -10.3367 -9.5576 -9.5576 -9.3344 -9.3344 -9.3334 -9.3334 -9.3187 -9.3187 -9.3159 -9.3159 0.2169 0.2169 0.4201 0.4201 0.7655 0.7655 0.9349 0.9349 0.9848 0.9848 1.2093 1.2093 1.4698 1.4698 1.7551 1.7551 1.9904 1.9904 2.0780 2.0780 2.2345 2.2345 2.3114 2.3114 2.4737 2.4737 3.5186 3.5186 3.6533 3.6533 3.7012 3.7012 4.1086 4.1086 4.3571 4.3571 5.3236 5.3236 5.3278 5.3278 5.3348 5.3348 5.5076 5.5076 5.6413 5.6413 5.7021 5.7021 6.8700 6.8700 6.8712 6.8712 7.0532 7.0532 7.1296 7.1296 k = 0.1731 0.0856 0.0575 ( 8279 PWs) bands (ev): -66.5287 -66.5287 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5006 -37.5006 -10.3447 -10.3447 -9.5468 -9.5468 -9.3344 -9.3344 -9.3335 -9.3335 -9.3186 -9.3186 -9.3158 -9.3158 0.1805 0.1805 0.4255 0.4255 0.7636 0.7636 0.9320 0.9320 0.9714 0.9714 1.1934 1.1934 1.4679 1.4679 1.7557 1.7557 1.9953 1.9953 2.0846 2.0846 2.2349 2.2349 2.3153 2.3153 2.4687 2.4687 3.5731 3.5731 3.6646 3.6646 3.7111 3.7111 4.1367 4.1367 4.3627 4.3627 5.3248 5.3248 5.3280 5.3280 5.3355 5.3355 5.4983 5.4983 5.6373 5.6373 5.6979 5.6979 6.8802 6.8802 6.8820 6.8820 7.0517 7.0517 7.1259 7.1259 k = 0.1538 0.0761 0.0511 ( 8249 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.3520 -10.3520 -9.5369 -9.5369 -9.3344 -9.3344 -9.3335 -9.3335 -9.3185 -9.3185 -9.3157 -9.3157 0.1472 0.1472 0.4311 0.4311 0.7631 0.7631 0.9305 0.9305 0.9574 0.9574 1.1771 1.1771 1.4645 1.4645 1.7589 1.7589 2.0002 2.0002 2.0911 2.0911 2.2341 2.2341 2.3190 2.3190 2.4639 2.4639 3.6207 3.6207 3.6752 3.6752 3.7203 3.7203 4.1673 4.1673 4.3679 4.3679 5.3262 5.3262 5.3283 5.3283 5.3363 5.3363 5.4890 5.4890 5.6333 5.6333 5.6937 5.6937 6.8909 6.8909 6.8929 6.8929 7.0490 7.0490 7.1217 7.1217 k = 0.1346 0.0666 0.0447 ( 8255 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.3585 -10.3585 -9.5278 -9.5278 -9.3344 -9.3344 -9.3335 -9.3335 -9.3184 -9.3184 -9.3156 -9.3156 0.1170 0.1170 0.4364 0.4364 0.7639 0.7639 0.9304 0.9304 0.9431 0.9431 1.1608 1.1608 1.4600 1.4600 1.7642 1.7642 2.0050 2.0050 2.0973 2.0973 2.2322 2.2322 2.3224 2.3224 2.4596 2.4596 3.6607 3.6607 3.6852 3.6852 3.7287 3.7287 4.1995 4.1995 4.3727 4.3727 5.3276 5.3276 5.3285 5.3285 5.3369 5.3369 5.4794 5.4794 5.6294 5.6294 5.6895 5.6895 6.9021 6.9021 6.9036 6.9036 7.0449 7.0449 7.1168 7.1168 k = 0.1154 0.0571 0.0383 ( 8255 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.3643 -10.3643 -9.5198 -9.5198 -9.3344 -9.3344 -9.3335 -9.3335 -9.3183 -9.3183 -9.3155 -9.3155 0.0905 0.0905 0.4414 0.4414 0.7660 0.7660 0.9289 0.9289 0.9315 0.9315 1.1448 1.1448 1.4547 1.4547 1.7711 1.7711 2.0094 2.0094 2.1030 2.1030 2.2292 2.2292 2.3256 2.3256 2.4561 2.4561 3.6887 3.6887 3.6991 3.6991 3.7361 3.7361 4.2322 4.2322 4.3771 4.3771 5.3287 5.3287 5.3290 5.3290 5.3374 5.3374 5.4701 5.4701 5.6256 5.6256 5.6856 5.6856 6.9136 6.9136 6.9140 6.9140 7.0396 7.0396 7.1115 7.1115 k = 0.0962 0.0475 0.0320 ( 8254 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.3693 -10.3693 -9.5129 -9.5129 -9.3344 -9.3344 -9.3335 -9.3335 -9.3182 -9.3182 -9.3154 -9.3154 0.0677 0.0677 0.4459 0.4459 0.7691 0.7691 0.9151 0.9151 0.9336 0.9336 1.1298 1.1298 1.4492 1.4492 1.7786 1.7786 2.0135 2.0135 2.1080 2.1080 2.2254 2.2254 2.3284 2.3284 2.4533 2.4533 3.6987 3.6987 3.7232 3.7232 3.7426 3.7426 4.2638 4.2638 4.3808 4.3808 5.3289 5.3289 5.3304 5.3304 5.3377 5.3377 5.4614 5.4614 5.6222 5.6222 5.6821 5.6821 6.9238 6.9238 6.9255 6.9255 7.0330 7.0330 7.1060 7.1060 k = 0.0769 0.0380 0.0256 ( 8230 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5005 -37.5005 -10.3734 -10.3734 -9.5072 -9.5072 -9.3344 -9.3344 -9.3334 -9.3334 -9.3181 -9.3181 -9.3153 -9.3153 0.0489 0.0489 0.4497 0.4497 0.7730 0.7730 0.9022 0.9022 0.9363 0.9363 1.1162 1.1162 1.4441 1.4441 1.7861 1.7861 2.0171 2.0171 2.1122 2.1122 2.2211 2.2211 2.3309 2.3309 2.4513 2.4513 3.7051 3.7051 3.7437 3.7437 3.7480 3.7480 4.2927 4.2927 4.3840 4.3840 5.3291 5.3291 5.3317 5.3317 5.3378 5.3378 5.4537 5.4537 5.6192 5.6192 5.6790 5.6790 6.9329 6.9329 6.9375 6.9375 7.0253 7.0253 7.1005 7.1005 k = 0.0577 0.0285 0.0192 ( 8254 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5005 -37.5005 -10.3766 -10.3766 -9.5027 -9.5027 -9.3344 -9.3344 -9.3334 -9.3334 -9.3181 -9.3181 -9.3153 -9.3153 0.0341 0.0341 0.4529 0.4529 0.7774 0.7774 0.8907 0.8907 0.9392 0.9392 1.1046 1.1046 1.4396 1.4396 1.7927 1.7927 2.0201 2.0201 2.1156 2.1156 2.2169 2.2169 2.3329 2.3329 2.4500 2.4500 3.7100 3.7100 3.7523 3.7523 3.7591 3.7591 4.3172 4.3172 4.3864 4.3864 5.3293 5.3293 5.3327 5.3327 5.3377 5.3377 5.4471 5.4471 5.6168 5.6168 5.6764 5.6764 6.9406 6.9406 6.9496 6.9496 7.0165 7.0165 7.0954 7.0954 k = 0.0385 0.0190 0.0128 ( 8251 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5005 -37.5005 -10.3789 -10.3789 -9.4995 -9.4995 -9.3344 -9.3344 -9.3334 -9.3334 -9.3180 -9.3180 -9.3152 -9.3152 0.0235 0.0235 0.4552 0.4552 0.7815 0.7815 0.8814 0.8814 0.9420 0.9420 1.0956 1.0956 1.4362 1.4362 1.7980 1.7980 2.0224 2.0224 2.1180 2.1180 2.2134 2.2134 2.3343 2.3343 2.4492 2.4492 3.7135 3.7135 3.7553 3.7553 3.7697 3.7697 4.3359 4.3359 4.3882 4.3882 5.3294 5.3294 5.3335 5.3335 5.3375 5.3375 5.4423 5.4423 5.6149 5.6149 5.6745 5.6745 6.9467 6.9467 6.9617 6.9617 7.0069 7.0069 7.0913 7.0913 k = 0.0192 0.0095 0.0064 ( 8245 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5005 -37.5005 -10.3803 -10.3803 -9.4975 -9.4975 -9.3344 -9.3344 -9.3334 -9.3334 -9.3180 -9.3180 -9.3152 -9.3152 0.0171 0.0171 0.4566 0.4566 0.7845 0.7845 0.8752 0.8752 0.9439 0.9439 1.0899 1.0899 1.4341 1.4341 1.8014 1.8014 2.0238 2.0238 2.1195 2.1195 2.2110 2.2110 2.3352 2.3352 2.4487 2.4487 3.7156 3.7156 3.7572 3.7572 3.7759 3.7759 4.3475 4.3475 4.3893 4.3893 5.3294 5.3294 5.3340 5.3340 5.3374 5.3374 5.4393 5.4393 5.6138 5.6138 5.6734 5.6734 6.9506 6.9506 6.9736 6.9736 6.9965 6.9965 7.0885 7.0885 k = 0.0000 0.0000 0.0000 ( 8251 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5006 -37.5006 -10.3808 -10.3808 -9.4969 -9.4969 -9.3344 -9.3344 -9.3334 -9.3334 -9.3180 -9.3180 -9.3152 -9.3152 0.0149 0.0149 0.4570 0.4570 0.7856 0.7856 0.8730 0.8730 0.9446 0.9446 1.0879 1.0879 1.4334 1.4334 1.8025 1.8025 2.0243 2.0243 2.1200 2.1200 2.2101 2.2101 2.3355 2.3355 2.4486 2.4486 3.7163 3.7163 3.7578 3.7578 3.7780 3.7780 4.3515 4.3515 4.3897 4.3897 5.3295 5.3295 5.3342 5.3342 5.3373 5.3373 5.4382 5.4382 5.6134 5.6134 5.6730 5.6730 6.9520 6.9520 6.9838 6.9838 6.9867 6.9867 7.0876 7.0876 k = 0.0000 0.0000 0.0000 ( 8251 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5006 -37.5006 -10.3808 -10.3808 -9.4969 -9.4969 -9.3344 -9.3344 -9.3334 -9.3334 -9.3180 -9.3180 -9.3152 -9.3152 0.0149 0.0149 0.4570 0.4570 0.7856 0.7856 0.8730 0.8730 0.9446 0.9446 1.0879 1.0879 1.4334 1.4334 1.8025 1.8025 2.0243 2.0243 2.1200 2.1200 2.2101 2.2101 2.3355 2.3355 2.4486 2.4486 3.7163 3.7163 3.7578 3.7578 3.7780 3.7780 4.3515 4.3515 4.3897 4.3897 5.3295 5.3295 5.3342 5.3342 5.3373 5.3373 5.4382 5.4382 5.6134 5.6134 5.6730 5.6730 6.9520 6.9520 6.9838 6.9838 6.9867 6.9867 7.0876 7.0876 k = 0.0098-0.0075-0.0184 ( 8255 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5006 -37.5006 -10.3802 -10.3802 -9.4966 -9.4966 -9.3352 -9.3352 -9.3345 -9.3345 -9.3176 -9.3176 -9.3149 -9.3149 0.0156 0.0156 0.4525 0.4525 0.7886 0.7886 0.8718 0.8718 0.9468 0.9468 1.0851 1.0851 1.4389 1.4389 1.8042 1.8042 2.0236 2.0236 2.1189 2.1189 2.2125 2.2125 2.3363 2.3363 2.4498 2.4498 3.7145 3.7145 3.7502 3.7502 3.7827 3.7827 4.3500 4.3500 4.3855 4.3855 5.3186 5.3186 5.3369 5.3369 5.3477 5.3477 5.4391 5.4391 5.6132 5.6132 5.6727 5.6727 6.9481 6.9481 6.9854 6.9854 6.9870 6.9870 7.0877 7.0877 k = 0.0196-0.0150-0.0367 ( 8251 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5015 -37.5015 -37.5005 -37.5005 -10.3782 -10.3782 -9.4959 -9.4959 -9.3378 -9.3378 -9.3371 -9.3371 -9.3167 -9.3167 -9.3141 -9.3141 0.0178 0.0178 0.4397 0.4397 0.7958 0.7958 0.8685 0.8685 0.9533 0.9533 1.0780 1.0780 1.4545 1.4545 1.8093 1.8093 2.0214 2.0214 2.1159 2.1159 2.2193 2.2193 2.3387 2.3387 2.4534 2.4534 3.7085 3.7085 3.7358 3.7358 3.7892 3.7892 4.3446 4.3446 4.3741 4.3741 5.3067 5.3067 5.3400 5.3400 5.3629 5.3629 5.4418 5.4418 5.6124 5.6124 5.6720 5.6720 6.9391 6.9391 6.9817 6.9817 6.9939 6.9939 7.0882 7.0882 k = 0.0294-0.0225-0.0551 ( 8249 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5591 -38.5591 -38.5542 -38.5542 -37.5526 -37.5526 -37.5434 -37.5434 -37.5015 -37.5015 -37.5005 -37.5005 -10.3750 -10.3750 -9.4946 -9.4946 -9.3418 -9.3418 -9.3408 -9.3408 -9.3158 -9.3158 -9.3131 -9.3131 0.0214 0.0214 0.4207 0.4207 0.8041 0.8041 0.8633 0.8633 0.9639 0.9639 1.0696 1.0696 1.4785 1.4785 1.8178 1.8178 2.0180 2.0180 2.1117 2.1117 2.2293 2.2293 2.3427 2.3427 2.4597 2.4597 3.6961 3.6961 3.7208 3.7208 3.7931 3.7931 4.3315 4.3315 4.3602 4.3602 5.2963 5.2963 5.3444 5.3444 5.3787 5.3787 5.4465 5.4465 5.6112 5.6112 5.6708 5.6708 6.9279 6.9279 6.9757 6.9757 7.0014 7.0014 7.0890 7.0890 k = 0.0392-0.0300-0.0735 ( 8243 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5591 -38.5591 -38.5542 -38.5542 -37.5526 -37.5526 -37.5434 -37.5434 -37.5015 -37.5015 -37.5005 -37.5005 -10.3705 -10.3705 -9.4929 -9.4929 -9.3468 -9.3468 -9.3455 -9.3455 -9.3153 -9.3153 -9.3120 -9.3120 0.0263 0.0263 0.3979 0.3979 0.8097 0.8097 0.8569 0.8569 0.9751 0.9751 1.0663 1.0663 1.5084 1.5084 1.8295 1.8295 2.0134 2.0134 2.1071 2.1071 2.2414 2.2414 2.3485 2.3485 2.4687 2.4687 3.6754 3.6754 3.7079 3.7079 3.7933 3.7933 4.3069 4.3069 4.3493 4.3493 5.2875 5.2875 5.3493 5.3493 5.3944 5.3944 5.4537 5.4537 5.6096 5.6096 5.6693 5.6693 6.9156 6.9156 6.9678 6.9678 7.0086 7.0086 7.0902 7.0902 k = 0.0490-0.0375-0.0918 ( 8243 PWs) bands (ev): -66.5286 -66.5286 -66.5277 -66.5277 -38.5591 -38.5591 -38.5542 -38.5542 -37.5525 -37.5525 -37.5434 -37.5434 -37.5015 -37.5015 -37.5005 -37.5005 -10.3647 -10.3647 -9.4906 -9.4906 -9.3528 -9.3528 -9.3510 -9.3510 -9.3152 -9.3152 -9.3110 -9.3110 0.0327 0.0327 0.3730 0.3730 0.8106 0.8106 0.8503 0.8503 0.9794 0.9794 1.0767 1.0767 1.5422 1.5422 1.8444 1.8444 2.0082 2.0082 2.1023 2.1023 2.2542 2.2542 2.3565 2.3565 2.4806 2.4806 3.6477 3.6477 3.6956 3.6956 3.7898 3.7898 4.2737 4.2737 4.3400 4.3400 5.2805 5.2805 5.3540 5.3540 5.4095 5.4095 5.4634 5.4634 5.6076 5.6076 5.6674 5.6674 6.9024 6.9024 6.9585 6.9585 7.0149 7.0149 7.0919 7.0919 k = 0.0589-0.0450-0.1102 ( 8259 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5543 -38.5543 -37.5525 -37.5525 -37.5435 -37.5435 -37.5015 -37.5015 -37.5006 -37.5006 -10.3576 -10.3576 -9.4879 -9.4879 -9.3596 -9.3596 -9.3572 -9.3572 -9.3156 -9.3156 -9.3103 -9.3103 0.0403 0.0403 0.3475 0.3475 0.8062 0.8062 0.8443 0.8443 0.9738 0.9738 1.1040 1.1040 1.5782 1.5782 1.8618 1.8618 2.0030 2.0030 2.0979 2.0979 2.2660 2.2660 2.3675 2.3675 2.4955 2.4955 3.6141 3.6141 3.6824 3.6824 3.7824 3.7824 4.2360 4.2360 4.3304 4.3304 5.2751 5.2751 5.3577 5.3577 5.4238 5.4238 5.4755 5.4755 5.6053 5.6053 5.6652 5.6652 6.8887 6.8887 6.9483 6.9483 7.0199 7.0199 7.0940 7.0940 k = 0.0687-0.0525-0.1286 ( 8257 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5543 -38.5543 -37.5524 -37.5524 -37.5436 -37.5436 -37.5015 -37.5015 -37.5006 -37.5006 -10.3494 -10.3494 -9.4847 -9.4847 -9.3672 -9.3672 -9.3639 -9.3639 -9.3162 -9.3162 -9.3100 -9.3100 0.0493 0.0493 0.3222 0.3222 0.7975 0.7975 0.8391 0.8391 0.9627 0.9627 1.1425 1.1425 1.6149 1.6149 1.8800 1.8800 1.9999 1.9999 2.0941 2.0941 2.2757 2.2757 2.3821 2.3821 2.5132 2.5132 3.5745 3.5745 3.6679 3.6679 3.7714 3.7714 4.1961 4.1961 4.3199 4.3199 5.2713 5.2713 5.3602 5.3602 5.4370 5.4370 5.4895 5.4895 5.6030 5.6030 5.6629 5.6629 6.8746 6.8746 6.9377 6.9377 7.0238 7.0238 7.0967 7.0967 k = 0.0785-0.0599-0.1469 ( 8269 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5543 -38.5543 -37.5523 -37.5523 -37.5437 -37.5437 -37.5015 -37.5015 -37.5006 -37.5006 -10.3398 -10.3398 -9.4811 -9.4811 -9.3757 -9.3757 -9.3712 -9.3712 -9.3173 -9.3173 -9.3100 -9.3100 0.0595 0.0595 0.2979 0.2979 0.7862 0.7862 0.8342 0.8342 0.9500 0.9500 1.1874 1.1874 1.6513 1.6513 1.8952 1.8952 2.0022 2.0022 2.0914 2.0914 2.2826 2.2826 2.4006 2.4006 2.5334 2.5334 3.5284 3.5284 3.6520 3.6520 3.7575 3.7575 4.1560 4.1560 4.3083 4.3083 5.2691 5.2691 5.3614 5.3614 5.4490 5.4490 5.5045 5.5045 5.6010 5.6010 5.6606 5.6606 6.8603 6.8603 6.9273 6.9273 7.0263 7.0263 7.0999 7.0999 k = 0.0883-0.0674-0.1653 ( 8265 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5544 -38.5544 -37.5522 -37.5522 -37.5438 -37.5438 -37.5015 -37.5015 -37.5006 -37.5006 -10.3291 -10.3291 -9.4771 -9.4771 -9.3850 -9.3850 -9.3790 -9.3790 -9.3187 -9.3187 -9.3104 -9.3104 0.0708 0.0708 0.2750 0.2750 0.7736 0.7736 0.8297 0.8297 0.9373 0.9373 1.2361 1.2361 1.6866 1.6866 1.9023 1.9023 2.0142 2.0142 2.0909 2.0909 2.2869 2.2869 2.4223 2.4223 2.5560 2.5560 3.4751 3.4751 3.6351 3.6351 3.7413 3.7413 4.1170 4.1170 4.2955 4.2955 5.2682 5.2682 5.3614 5.3614 5.4596 5.4596 5.5197 5.5197 5.5995 5.5995 5.6585 5.6585 6.8460 6.8460 6.9175 6.9175 7.0275 7.0275 7.1033 7.1033 k = 0.0981-0.0749-0.1837 ( 8265 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5589 -38.5589 -38.5545 -38.5545 -37.5521 -37.5521 -37.5439 -37.5439 -37.5015 -37.5015 -37.5006 -37.5006 -10.3172 -10.3172 -9.4726 -9.4726 -9.3950 -9.3950 -9.3873 -9.3873 -9.3204 -9.3204 -9.3111 -9.3111 0.0833 0.0833 0.2538 0.2538 0.7605 0.7605 0.8256 0.8256 0.9254 0.9254 1.2868 1.2868 1.7204 1.7204 1.8996 1.8996 2.0342 2.0342 2.0956 2.0956 2.2893 2.2893 2.4465 2.4465 2.5804 2.5804 3.4146 3.4146 3.6172 3.6172 3.7239 3.7239 4.0799 4.0799 4.2813 4.2813 5.2684 5.2684 5.3603 5.3603 5.4682 5.4682 5.5343 5.5343 5.5992 5.5992 5.6567 5.6567 6.8321 6.8321 6.9086 6.9086 7.0276 7.0276 7.1070 7.1070 k = 0.1079-0.0824-0.2020 ( 8267 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5588 -38.5588 -38.5545 -38.5545 -37.5520 -37.5520 -37.5440 -37.5440 -37.5015 -37.5015 -37.5006 -37.5006 -10.3042 -10.3042 -9.4678 -9.4678 -9.4058 -9.4058 -9.3960 -9.3960 -9.3225 -9.3225 -9.3122 -9.3122 0.0967 0.0967 0.2346 0.2346 0.7477 0.7477 0.8220 0.8220 0.9145 0.9145 1.3384 1.3384 1.7524 1.7524 1.8904 1.8904 2.0514 2.0514 2.1129 2.1129 2.2909 2.2909 2.4719 2.4719 2.6062 2.6062 3.3472 3.3472 3.5986 3.5986 3.7060 3.7060 4.0449 4.0449 4.2657 4.2657 5.2696 5.2696 5.3581 5.3581 5.4745 5.4745 5.5475 5.5475 5.6007 5.6007 5.6554 5.6554 6.8191 6.8191 6.9008 6.9008 7.0267 7.0267 7.1106 7.1106 k = 0.1177-0.0899-0.2204 ( 8267 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5588 -38.5588 -38.5546 -38.5546 -37.5519 -37.5519 -37.5441 -37.5441 -37.5014 -37.5014 -37.5006 -37.5006 -10.2900 -10.2900 -9.4626 -9.4626 -9.4173 -9.4173 -9.4051 -9.4051 -9.3248 -9.3248 -9.3136 -9.3136 0.1109 0.1109 0.2177 0.2177 0.7354 0.7354 0.8193 0.8193 0.9050 0.9050 1.3899 1.3899 1.7812 1.7812 1.8788 1.8788 2.0594 2.0594 2.1449 2.1449 2.2930 2.2930 2.4978 2.4978 2.6328 2.6328 3.2741 3.2741 3.5796 3.5796 3.6882 3.6882 4.0120 4.0120 4.2486 4.2486 5.2716 5.2716 5.3550 5.3550 5.4782 5.4782 5.5583 5.5583 5.6045 5.6045 5.6552 5.6552 6.8072 6.8072 6.8945 6.8945 7.0248 7.0248 7.1141 7.1141 k = 0.1275-0.0974-0.2388 ( 8265 PWs) bands (ev): -66.5285 -66.5285 -66.5278 -66.5278 -38.5587 -38.5587 -38.5547 -38.5547 -37.5518 -37.5518 -37.5443 -37.5443 -37.5014 -37.5014 -37.5006 -37.5006 -10.2747 -10.2747 -9.4572 -9.4572 -9.4295 -9.4295 -9.4146 -9.4146 -9.3274 -9.3274 -9.3153 -9.3153 0.1257 0.1257 0.2033 0.2033 0.7240 0.7240 0.8177 0.8177 0.8970 0.8970 1.4403 1.4403 1.8023 1.8023 1.8713 1.8713 2.0632 2.0632 2.1822 2.1822 2.2987 2.2987 2.5234 2.5234 2.6595 2.6595 3.1969 3.1969 3.5603 3.5603 3.6712 3.6712 3.9811 3.9811 4.2298 4.2298 5.2741 5.2741 5.3509 5.3509 5.4792 5.4792 5.5661 5.5661 5.6108 5.6108 5.6563 5.6563 6.7969 6.7969 6.8895 6.8895 7.0221 7.0221 7.1173 7.1173 k = 0.1373-0.1049-0.2571 ( 8269 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5586 -38.5586 -38.5547 -38.5547 -37.5516 -37.5516 -37.5444 -37.5444 -37.5014 -37.5014 -37.5006 -37.5006 -10.2584 -10.2584 -9.4515 -9.4515 -9.4423 -9.4423 -9.4243 -9.4243 -9.3303 -9.3303 -9.3173 -9.3173 0.1403 0.1403 0.1922 0.1922 0.7137 0.7137 0.8171 0.8171 0.8908 0.8908 1.4888 1.4888 1.8049 1.8049 1.8792 1.8792 2.0670 2.0670 2.2138 2.2138 2.3138 2.3138 2.5477 2.5477 2.6849 2.6849 3.1182 3.1182 3.5408 3.5408 3.6551 3.6551 3.9519 3.9519 4.2093 4.2093 5.2770 5.2770 5.3460 5.3460 5.4779 5.4779 5.5709 5.5709 5.6188 5.6188 5.6592 5.6592 6.7885 6.7885 6.8861 6.8861 7.0187 7.0187 7.1201 7.1201 k = 0.1471-0.1124-0.2755 ( 8271 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5585 -38.5585 -38.5548 -38.5548 -37.5515 -37.5515 -37.5446 -37.5446 -37.5014 -37.5014 -37.5006 -37.5006 -10.2411 -10.2411 -9.4558 -9.4558 -9.4462 -9.4462 -9.4338 -9.4338 -9.3334 -9.3334 -9.3196 -9.3196 0.1525 0.1525 0.1866 0.1866 0.7045 0.7045 0.8177 0.8177 0.8865 0.8865 1.5343 1.5343 1.7908 1.7908 1.9007 1.9007 2.0733 2.0733 2.2314 2.2314 2.3442 2.3442 2.5696 2.5696 2.7066 2.7066 3.0421 3.0421 3.5211 3.5211 3.6402 3.6402 3.9244 3.9244 4.1871 4.1871 5.2800 5.2800 5.3404 5.3404 5.4747 5.4747 5.5732 5.5732 5.6277 5.6277 5.6642 5.6642 6.7823 6.7823 6.8842 6.8842 7.0146 7.0146 7.1225 7.1225 k = 0.1569-0.1199-0.2939 ( 8273 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5584 -38.5584 -38.5549 -38.5549 -37.5513 -37.5513 -37.5448 -37.5448 -37.5013 -37.5013 -37.5006 -37.5006 -10.2228 -10.2228 -9.4697 -9.4697 -9.4476 -9.4476 -9.4365 -9.4365 -9.3367 -9.3367 -9.3221 -9.3221 0.1574 0.1574 0.1914 0.1914 0.6967 0.6967 0.8192 0.8192 0.8846 0.8846 1.5761 1.5761 1.7699 1.7699 1.9248 1.9248 2.0843 2.0843 2.2374 2.2374 2.3859 2.3859 2.5868 2.5868 2.7204 2.7204 2.9763 2.9763 3.5014 3.5014 3.6268 3.6268 3.8984 3.8984 4.1632 4.1632 5.2829 5.2829 5.3340 5.3340 5.4701 5.4701 5.5733 5.5733 5.6366 5.6366 5.6709 5.6709 6.7784 6.7784 6.8838 6.8838 7.0100 7.0100 7.1243 7.1243 k = 0.1667-0.1274-0.3122 ( 8271 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5584 -38.5584 -38.5550 -38.5550 -37.5512 -37.5512 -37.5449 -37.5449 -37.5013 -37.5013 -37.5007 -37.5007 -10.2036 -10.2036 -9.4840 -9.4840 -9.4574 -9.4574 -9.4310 -9.4310 -9.3401 -9.3401 -9.3248 -9.3248 0.1561 0.1561 0.2053 0.2053 0.6903 0.6903 0.8214 0.8214 0.8856 0.8856 1.6129 1.6129 1.7469 1.7469 1.9457 1.9457 2.1024 2.1024 2.2379 2.2379 2.4307 2.4307 2.5931 2.5931 2.7216 2.7216 2.9334 2.9334 3.4814 3.4814 3.6147 3.6147 3.8739 3.8739 4.1376 4.1376 5.2854 5.2854 5.3273 5.3273 5.4645 5.4645 5.5718 5.5718 5.6453 5.6453 5.6790 5.6790 6.7768 6.7768 6.8848 6.8848 7.0049 7.0049 7.1257 7.1257 k = 0.1766-0.1349-0.3306 ( 8291 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5583 -38.5583 -38.5551 -38.5551 -37.5510 -37.5510 -37.5451 -37.5451 -37.5013 -37.5013 -37.5007 -37.5007 -10.1835 -10.1835 -9.4989 -9.4989 -9.4683 -9.4683 -9.4245 -9.4245 -9.3438 -9.3438 -9.3278 -9.3278 0.1543 0.1543 0.2226 0.2226 0.6851 0.6851 0.8241 0.8241 0.8898 0.8898 1.6413 1.6413 1.7259 1.7259 1.9609 1.9609 2.1281 2.1281 2.2369 2.2369 2.4715 2.4715 2.5760 2.5760 2.7190 2.7190 2.9209 2.9209 3.4612 3.4612 3.6041 3.6041 3.8510 3.8510 4.1106 4.1106 5.2870 5.2870 5.3207 5.3207 5.4583 5.4583 5.5689 5.5689 5.6538 5.6538 5.6878 5.6878 6.7777 6.7777 6.8871 6.8871 6.9994 6.9994 7.1265 7.1265 k = 0.1864-0.1424-0.3490 ( 8293 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5582 -38.5582 -38.5552 -38.5552 -37.5508 -37.5508 -37.5453 -37.5453 -37.5013 -37.5013 -37.5007 -37.5007 -10.1625 -10.1625 -9.5140 -9.5140 -9.4795 -9.4795 -9.4177 -9.4177 -9.3475 -9.3475 -9.3309 -9.3309 0.1538 0.1538 0.2413 0.2413 0.6813 0.6813 0.8270 0.8270 0.8976 0.8976 1.6510 1.6510 1.7180 1.7180 1.9707 1.9707 2.1584 2.1584 2.2374 2.2374 2.4849 2.4849 2.5494 2.5494 2.7296 2.7296 2.9305 2.9305 3.4408 3.4408 3.5948 3.5948 3.8296 3.8296 4.0822 4.0822 5.2865 5.2865 5.3153 5.3153 5.4518 5.4518 5.5652 5.5652 5.6620 5.6620 5.6969 5.6969 6.7809 6.7809 6.8905 6.8905 6.9939 6.9939 7.1267 7.1267 k = 0.1962-0.1499-0.3673 ( 8297 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5581 -38.5581 -38.5553 -38.5553 -37.5507 -37.5507 -37.5455 -37.5455 -37.5013 -37.5013 -37.5007 -37.5007 -10.1409 -10.1409 -9.5295 -9.5295 -9.4909 -9.4909 -9.4108 -9.4108 -9.3514 -9.3514 -9.3342 -9.3342 0.1553 0.1553 0.2608 0.2608 0.6789 0.6789 0.8300 0.8300 0.9090 0.9090 1.6346 1.6346 1.7304 1.7304 1.9766 1.9766 2.1838 2.1838 2.2460 2.2460 2.4306 2.4306 2.5664 2.5664 2.7527 2.7527 2.9507 2.9507 3.4202 3.4202 3.5867 3.5867 3.8099 3.8099 4.0528 4.0528 5.2829 5.2829 5.3124 5.3124 5.4452 5.4452 5.5607 5.5607 5.6700 5.6700 5.7059 5.7059 6.7862 6.7862 6.8947 6.8947 6.9885 6.9885 7.1264 7.1264 k = 0.2060-0.1574-0.3857 ( 8293 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5580 -38.5580 -38.5554 -38.5554 -37.5505 -37.5505 -37.5457 -37.5457 -37.5012 -37.5012 -37.5007 -37.5007 -10.1184 -10.1184 -9.5452 -9.5452 -9.5024 -9.5024 -9.4039 -9.4039 -9.3553 -9.3553 -9.3375 -9.3375 0.1589 0.1589 0.2808 0.2808 0.6777 0.6777 0.8334 0.8334 0.9238 0.9238 1.6066 1.6066 1.7493 1.7493 1.9803 1.9803 2.1929 2.1929 2.2652 2.2652 2.3619 2.3619 2.5916 2.5916 2.7829 2.7829 2.9757 2.9757 3.3996 3.3996 3.5795 3.5795 3.7917 3.7917 4.0227 4.0227 5.2762 5.2762 5.3122 5.3122 5.4385 5.4385 5.5558 5.5558 5.6777 5.6777 5.7147 5.7147 6.7933 6.7933 6.8991 6.8991 6.9837 6.9837 7.1256 7.1256 k = 0.2158-0.1649-0.4041 ( 8297 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5579 -38.5579 -38.5555 -38.5555 -37.5503 -37.5503 -37.5459 -37.5459 -37.5012 -37.5012 -37.5007 -37.5007 -10.0954 -10.0954 -9.5611 -9.5611 -9.5140 -9.5140 -9.3972 -9.3972 -9.3591 -9.3591 -9.3410 -9.3410 0.1645 0.1645 0.3011 0.3011 0.6777 0.6777 0.8373 0.8373 0.9418 0.9418 1.5744 1.5744 1.7672 1.7672 1.9829 1.9829 2.1871 2.1871 2.2457 2.2457 2.3430 2.3430 2.6135 2.6135 2.8162 2.8162 3.0029 3.0029 3.3791 3.3791 3.5730 3.5730 3.7751 3.7751 3.9922 3.9922 5.2678 5.2678 5.3135 5.3135 5.4318 5.4318 5.5506 5.5506 5.6850 5.6850 5.7232 5.7232 6.8018 6.8018 6.9032 6.9032 6.9802 6.9802 7.1242 7.1242 k = 0.2256-0.1723-0.4224 ( 8305 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5578 -38.5578 -38.5556 -38.5556 -37.5501 -37.5501 -37.5461 -37.5461 -37.5012 -37.5012 -37.5008 -37.5008 -10.0718 -10.0718 -9.5772 -9.5772 -9.5257 -9.5257 -9.3910 -9.3910 -9.3627 -9.3627 -9.3445 -9.3445 0.1722 0.1722 0.3217 0.3217 0.6788 0.6788 0.8418 0.8418 0.9626 0.9626 1.5400 1.5400 1.7824 1.7824 1.9848 1.9848 2.1484 2.1484 2.2057 2.2057 2.3772 2.3772 2.6324 2.6324 2.8493 2.8493 3.0314 3.0314 3.3590 3.3590 3.5668 3.5668 3.7599 3.7599 3.9617 3.9617 5.2587 5.2587 5.3154 5.3154 5.4252 5.4252 5.5453 5.5453 5.6918 5.6918 5.7313 5.7313 6.8112 6.8112 6.9062 6.9062 6.9787 6.9787 7.1224 7.1224 k = 0.2354-0.1798-0.4408 ( 8315 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5499 -37.5499 -37.5463 -37.5463 -37.5012 -37.5012 -37.5008 -37.5008 -10.0477 -10.0477 -9.5933 -9.5933 -9.5373 -9.5373 -9.3857 -9.3857 -9.3656 -9.3656 -9.3478 -9.3478 0.1819 0.1819 0.3423 0.3423 0.6808 0.6808 0.8472 0.8472 0.9859 0.9859 1.5040 1.5040 1.7942 1.7942 1.9852 1.9852 2.0767 2.0767 2.1935 2.1935 2.4180 2.4180 2.6498 2.6498 2.8795 2.8795 3.0606 3.0606 3.3398 3.3398 3.5606 3.5606 3.7459 3.7459 3.9315 3.9315 5.2497 5.2497 5.3175 5.3175 5.4187 5.4187 5.5399 5.5399 5.6981 5.6981 5.7390 5.7390 6.8209 6.8209 6.9076 6.9076 6.9800 6.9800 7.1201 7.1201 k = 0.2452-0.1873-0.4592 ( 8309 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5012 -37.5012 -37.5008 -37.5008 -10.0231 -10.0231 -9.6094 -9.6094 -9.5489 -9.5489 -9.3829 -9.3829 -9.3668 -9.3668 -9.3507 -9.3507 0.1935 0.1935 0.3628 0.3628 0.6837 0.6837 0.8535 0.8535 1.0111 1.0111 1.4669 1.4669 1.8019 1.8019 1.9718 1.9718 2.0166 2.0166 2.1860 2.1860 2.4571 2.4571 2.6676 2.6676 2.9047 2.9047 3.0903 3.0903 3.3220 3.3220 3.5544 3.5544 3.7331 3.7331 3.9020 3.9020 5.2413 5.2413 5.3195 5.3195 5.4125 5.4125 5.5346 5.5346 5.7039 5.7039 5.7465 5.7465 6.8298 6.8298 6.9078 6.9078 6.9839 6.9839 7.1175 7.1175 k = 0.2550-0.1948-0.4775 ( 8307 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5495 -37.5495 -37.5466 -37.5466 -37.5011 -37.5011 -37.5008 -37.5008 -9.9983 -9.9983 -9.6255 -9.6255 -9.5603 -9.5603 -9.3834 -9.3834 -9.3662 -9.3662 -9.3522 -9.3522 0.2068 0.2068 0.3832 0.3832 0.6872 0.6872 0.8607 0.8607 1.0377 1.0377 1.4295 1.4295 1.8034 1.8034 1.9164 1.9164 2.0051 2.0051 2.1792 2.1792 2.4915 2.4915 2.6870 2.6870 2.9239 2.9239 3.1196 3.1196 3.3061 3.3061 3.5479 3.5479 3.7213 3.7213 3.8736 3.8736 5.2340 5.2340 5.3212 5.3212 5.4064 5.4064 5.5295 5.5295 5.7090 5.7090 5.7535 5.7535 6.8366 6.8366 6.9083 6.9083 6.9899 6.9899 7.1147 7.1147 k = 0.2648-0.2023-0.4959 ( 8301 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5574 -38.5574 -38.5560 -38.5560 -37.5494 -37.5494 -37.5468 -37.5468 -37.5011 -37.5011 -37.5008 -37.5008 -9.9731 -9.9731 -9.6414 -9.6414 -9.5716 -9.5716 -9.3862 -9.3862 -9.3664 -9.3664 -9.3508 -9.3508 0.2217 0.2217 0.4032 0.4032 0.6910 0.6910 0.8689 0.8689 1.0647 1.0647 1.3927 1.3927 1.7892 1.7892 1.8656 1.8656 2.0070 2.0070 2.1726 2.1726 2.5200 2.5200 2.7085 2.7085 2.9367 2.9367 3.1475 3.1475 3.2927 3.2927 3.5412 3.5412 3.7104 3.7104 3.8465 3.8465 5.2280 5.2280 5.3224 5.3224 5.4007 5.4007 5.5247 5.5247 5.7134 5.7134 5.7602 5.7602 6.8397 6.8397 6.9107 6.9107 6.9972 6.9972 7.1118 7.1118 k = 0.2746-0.2098-0.5143 ( 8303 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5573 -38.5573 -38.5561 -38.5561 -37.5492 -37.5492 -37.5470 -37.5470 -37.5011 -37.5011 -37.5008 -37.5008 -9.9479 -9.9479 -9.6572 -9.6572 -9.5825 -9.5825 -9.3899 -9.3899 -9.3687 -9.3687 -9.3468 -9.3468 0.2380 0.2380 0.4226 0.4226 0.6948 0.6948 0.8780 0.8780 1.0905 1.0905 1.3586 1.3586 1.7462 1.7462 1.8453 1.8453 2.0107 2.0107 2.1660 2.1660 2.5425 2.5425 2.7312 2.7312 2.9435 2.9435 3.1728 3.1728 3.2823 3.2823 3.5342 3.5342 3.7006 3.7006 3.8209 3.8209 5.2238 5.2238 5.3229 5.3229 5.3955 5.3955 5.5203 5.5203 5.7171 5.7171 5.7667 5.7667 6.8385 6.8385 6.9159 6.9159 7.0047 7.0047 7.1090 7.1090 k = 0.2844-0.2173-0.5326 ( 8301 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5572 -38.5572 -38.5562 -38.5562 -37.5490 -37.5490 -37.5472 -37.5472 -37.5011 -37.5011 -37.5008 -37.5008 -9.9226 -9.9226 -9.6727 -9.6727 -9.5931 -9.5931 -9.3939 -9.3939 -9.3719 -9.3719 -9.3417 -9.3417 0.2554 0.2554 0.4410 0.4410 0.6983 0.6983 0.8878 0.8878 1.1122 1.1122 1.3307 1.3307 1.6917 1.6917 1.8404 1.8404 2.0146 2.0146 2.1595 2.1595 2.5598 2.5598 2.7532 2.7532 2.9451 2.9451 3.1942 3.1942 3.2756 3.2756 3.5270 3.5270 3.6918 3.6918 3.7971 3.7971 5.2214 5.2214 5.3225 5.3225 5.3908 5.3908 5.5164 5.5164 5.7202 5.7202 5.7727 5.7727 6.8336 6.8336 6.9235 6.9235 7.0118 7.0118 7.1063 7.1063 k = 0.2943-0.2248-0.5510 ( 8299 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5571 -38.5571 -38.5563 -38.5563 -37.5488 -37.5488 -37.5474 -37.5474 -37.5011 -37.5011 -37.5008 -37.5008 -9.8974 -9.8974 -9.6880 -9.6880 -9.6033 -9.6033 -9.3980 -9.3980 -9.3754 -9.3754 -9.3364 -9.3364 0.2736 0.2736 0.4579 0.4579 0.7012 0.7012 0.8983 0.8983 1.1250 1.1250 1.3148 1.3148 1.6386 1.6386 1.8391 1.8391 2.0183 2.0183 2.1531 2.1531 2.5731 2.5731 2.7722 2.7722 2.9427 2.9427 3.2105 3.2105 3.2728 3.2728 3.5194 3.5194 3.6845 3.6845 3.7752 3.7752 5.2211 5.2211 5.3210 5.3210 5.3869 5.3869 5.5131 5.5131 5.7226 5.7226 5.7785 5.7785 6.8261 6.8261 6.9322 6.9322 7.0178 7.0178 7.1042 7.1042 k = 0.3041-0.2323-0.5694 ( 8297 PWs) bands (ev): -66.5283 -66.5283 -66.5282 -66.5282 -38.5570 -38.5570 -38.5564 -38.5564 -37.5486 -37.5486 -37.5476 -37.5476 -37.5011 -37.5011 -37.5009 -37.5009 -9.8725 -9.8725 -9.7029 -9.7029 -9.6129 -9.6129 -9.4022 -9.4022 -9.3792 -9.3792 -9.3312 -9.3312 0.2921 0.2921 0.4727 0.4727 0.7032 0.7032 0.9093 0.9093 1.1251 1.1251 1.3160 1.3160 1.5901 1.5901 1.8387 1.8387 2.0215 2.0215 2.1467 2.1467 2.5831 2.5831 2.7862 2.7862 2.9376 2.9376 3.2210 3.2210 3.2736 3.2736 3.5116 3.5116 3.6786 3.6786 3.7556 3.7556 5.2228 5.2228 5.3186 5.3186 5.3835 5.3835 5.5103 5.5103 5.7243 5.7243 5.7839 5.7839 6.8172 6.8172 6.9411 6.9411 7.0221 7.0221 7.1026 7.1026 k = 0.3139-0.2398-0.5877 ( 8295 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5569 -38.5569 -38.5565 -38.5565 -37.5485 -37.5485 -37.5477 -37.5477 -37.5011 -37.5011 -37.5009 -37.5009 -9.8481 -9.8481 -9.7174 -9.7174 -9.6218 -9.6218 -9.4063 -9.4063 -9.3829 -9.3829 -9.3262 -9.3262 0.3105 0.3105 0.4844 0.4844 0.7046 0.7046 0.9203 0.9203 1.1150 1.1150 1.3332 1.3332 1.5471 1.5471 1.8388 1.8388 2.0240 2.0240 2.1406 2.1406 2.5902 2.5902 2.7941 2.7941 2.9309 2.9309 3.2261 3.2261 3.2765 3.2765 3.5039 3.5039 3.6741 3.6741 3.7387 3.7387 5.2264 5.2264 5.3157 5.3157 5.3806 5.3806 5.5083 5.5083 5.7254 5.7254 5.7890 5.7890 6.8074 6.8074 6.9492 6.9492 7.0245 7.0245 7.1017 7.1017 k = 0.3237-0.2473-0.6061 ( 8281 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5568 -38.5568 -38.5566 -38.5566 -37.5483 -37.5483 -37.5479 -37.5479 -37.5011 -37.5011 -37.5009 -37.5009 -9.8246 -9.8246 -9.7314 -9.7314 -9.6297 -9.6297 -9.4104 -9.4104 -9.3866 -9.3866 -9.3216 -9.3216 0.3277 0.3277 0.4921 0.4921 0.7061 0.7061 0.9310 0.9310 1.1018 1.1018 1.3599 1.3599 1.5104 1.5104 1.8393 1.8393 2.0257 2.0257 2.1349 2.1349 2.5942 2.5942 2.7959 2.7959 2.9234 2.9234 3.2266 3.2266 3.2794 3.2794 3.4964 3.4964 3.6702 3.6702 3.7255 3.7255 5.2313 5.2313 5.3129 5.3129 5.3780 5.3780 5.5069 5.5069 5.7260 5.7260 5.7937 5.7937 6.7973 6.7973 6.9563 6.9563 7.0252 7.0252 7.1014 7.1014 k = 0.3335-0.2548-0.6245 ( 8271 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5567 -38.5567 -38.5567 -38.5567 -37.5482 -37.5482 -37.5480 -37.5480 -37.5011 -37.5011 -37.5008 -37.5008 -9.8023 -9.8023 -9.7449 -9.7449 -9.6362 -9.6362 -9.4144 -9.4144 -9.3903 -9.3903 -9.3175 -9.3175 0.3426 0.3426 0.4951 0.4951 0.7091 0.7091 0.9411 0.9411 1.0908 1.0908 1.3889 1.3889 1.4827 1.4827 1.8404 1.8404 2.0266 2.0266 2.1297 2.1297 2.5943 2.5943 2.7930 2.7930 2.9154 2.9154 3.2228 3.2228 3.2806 3.2806 3.4898 3.4898 3.6657 3.6657 3.7177 3.7177 5.2367 5.2367 5.3111 5.3111 5.3754 5.3754 5.5062 5.5062 5.7259 5.7259 5.7981 5.7981 6.7871 6.7871 6.9616 6.9616 7.0243 7.0243 7.1012 7.1012 k = 0.3433-0.2623-0.6428 ( 8275 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5568 -38.5568 -38.5566 -38.5566 -37.5483 -37.5483 -37.5479 -37.5479 -37.5011 -37.5011 -37.5008 -37.5008 -9.7823 -9.7823 -9.7575 -9.7575 -9.6408 -9.6408 -9.4182 -9.4182 -9.3939 -9.3939 -9.3140 -9.3140 0.3527 0.3527 0.4945 0.4945 0.7150 0.7150 0.9505 0.9505 1.0843 1.0843 1.4067 1.4067 1.4747 1.4747 1.8420 1.8420 2.0268 2.0268 2.1253 2.1253 2.5898 2.5898 2.7870 2.7870 2.9071 2.9071 3.2144 3.2144 3.2788 3.2788 3.4846 3.4846 3.6597 3.6597 3.7161 3.7161 5.2410 5.2410 5.3117 5.3117 5.3727 5.3727 5.5061 5.5061 5.7253 5.7253 5.8021 5.8021 6.7770 6.7770 6.9651 6.9651 7.0223 7.0223 7.1009 7.1009 k = 0.3531-0.2698-0.6612 ( 8280 PWs) bands (ev): -66.5282 -66.5282 -66.5282 -66.5282 -38.5569 -38.5569 -38.5565 -38.5565 -37.5484 -37.5484 -37.5478 -37.5478 -37.5011 -37.5011 -37.5008 -37.5008 -9.7731 -9.7731 -9.7615 -9.7615 -9.6426 -9.6426 -9.4219 -9.4219 -9.3973 -9.3973 -9.3109 -9.3109 0.3549 0.3549 0.4932 0.4932 0.7245 0.7245 0.9593 0.9593 1.0823 1.0823 1.4011 1.4011 1.4974 1.4974 1.8443 1.8443 2.0264 2.0264 2.1220 2.1220 2.5799 2.5799 2.7788 2.7788 2.8994 2.8994 3.2018 3.2018 3.2730 3.2730 3.4811 3.4811 3.6525 3.6525 3.7204 3.7204 5.2430 5.2430 5.3157 5.3157 5.3702 5.3702 5.5064 5.5064 5.7242 5.7242 5.8058 5.8058 6.7673 6.7673 6.9665 6.9665 7.0196 7.0196 7.1003 7.1003 k = 0.3629-0.2773-0.6796 ( 8278 PWs) bands (ev): -66.5282 -66.5282 -66.5281 -66.5281 -38.5569 -38.5569 -38.5564 -38.5564 -37.5486 -37.5486 -37.5476 -37.5476 -37.5011 -37.5011 -37.5008 -37.5008 -9.7834 -9.7834 -9.7494 -9.7494 -9.6403 -9.6403 -9.4255 -9.4255 -9.4006 -9.4006 -9.3085 -9.3085 0.3466 0.3466 0.4953 0.4953 0.7375 0.7375 0.9677 0.9677 1.0835 1.0835 1.3882 1.3882 1.5340 1.5340 1.8473 1.8473 2.0255 2.0255 2.1202 2.1202 2.5645 2.5645 2.7682 2.7682 2.8936 2.8936 3.1852 3.1852 3.2623 3.2623 3.4793 3.4793 3.6450 3.6450 3.7292 3.7292 5.2422 5.2422 5.3225 5.3225 5.3687 5.3687 5.5071 5.5071 5.7225 5.7225 5.8092 5.8092 6.7582 6.7582 6.9658 6.9658 7.0165 7.0165 7.0991 7.0991 k = 0.6371-0.0300-0.5134 ( 8278 PWs) bands (ev): -66.5282 -66.5282 -66.5281 -66.5281 -38.5569 -38.5569 -38.5564 -38.5564 -37.5486 -37.5486 -37.5476 -37.5476 -37.5011 -37.5011 -37.5008 -37.5008 -9.7834 -9.7834 -9.7494 -9.7494 -9.6403 -9.6403 -9.4255 -9.4255 -9.4006 -9.4006 -9.3085 -9.3085 0.3466 0.3466 0.4953 0.4953 0.7375 0.7375 0.9677 0.9677 1.0835 1.0835 1.3882 1.3882 1.5340 1.5340 1.8473 1.8473 2.0255 2.0255 2.1202 2.1202 2.5645 2.5645 2.7682 2.7682 2.8936 2.8936 3.1852 3.1852 3.2623 3.2623 3.4793 3.4793 3.6450 3.6450 3.7292 3.7292 5.2422 5.2422 5.3225 5.3225 5.3687 5.3687 5.5071 5.5071 5.7225 5.7225 5.8092 5.8092 6.7582 6.7582 6.9658 6.9658 7.0165 7.0165 7.0991 7.0991 k = 0.6273-0.0102-0.5134 ( 8286 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5570 -38.5570 -38.5564 -38.5564 -37.5487 -37.5487 -37.5475 -37.5475 -37.5011 -37.5011 -37.5008 -37.5008 -9.7944 -9.7944 -9.7409 -9.7409 -9.6334 -9.6334 -9.4289 -9.4289 -9.4038 -9.4038 -9.3068 -9.3068 0.3278 0.3278 0.5021 0.5021 0.7534 0.7534 0.9759 0.9759 1.0862 1.0862 1.3779 1.3779 1.5743 1.5743 1.8507 1.8507 2.0246 2.0246 2.1200 2.1200 2.5443 2.5443 2.7541 2.7541 2.8911 2.8911 3.1655 3.1655 3.2469 3.2469 3.4790 3.4790 3.6380 3.6380 3.7414 3.7414 5.2391 5.2391 5.3294 5.3294 5.3704 5.3704 5.5080 5.5080 5.7202 5.7202 5.8123 5.8123 6.7496 6.7496 6.9630 6.9630 7.0131 7.0131 7.0974 7.0974 k = 0.6175 0.0096-0.5134 ( 8288 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5571 -38.5571 -38.5563 -38.5563 -37.5488 -37.5488 -37.5473 -37.5473 -37.5011 -37.5011 -37.5008 -37.5008 -9.8049 -9.8049 -9.7368 -9.7368 -9.6219 -9.6219 -9.4321 -9.4321 -9.4068 -9.4068 -9.3057 -9.3057 0.3017 0.3017 0.5125 0.5125 0.7713 0.7713 0.9842 0.9842 1.0888 1.0888 1.3724 1.3724 1.6157 1.6157 1.8546 1.8546 2.0240 2.0240 2.1217 2.1217 2.5199 2.5199 2.7356 2.7356 2.8924 2.8924 3.1434 3.1434 3.2275 3.2275 3.4796 3.4796 3.6315 3.6315 3.7561 3.7561 5.2346 5.2346 5.3326 5.3326 5.3780 5.3780 5.5089 5.5089 5.7175 5.7175 5.8151 5.8151 6.7418 6.7418 6.9587 6.9587 7.0093 7.0093 7.0953 7.0953 k = 0.6077 0.0294-0.5134 ( 8282 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5572 -38.5572 -38.5562 -38.5562 -37.5490 -37.5490 -37.5472 -37.5472 -37.5011 -37.5011 -37.5008 -37.5008 -9.8147 -9.8147 -9.7361 -9.7361 -9.6073 -9.6073 -9.4350 -9.4350 -9.4096 -9.4096 -9.3053 -9.3053 0.2716 0.2716 0.5246 0.5246 0.7905 0.7905 0.9924 0.9924 1.0902 1.0902 1.3722 1.3722 1.6571 1.6571 1.8587 1.8587 2.0244 2.0244 2.1255 2.1255 2.4925 2.4925 2.7125 2.7125 2.8972 2.8972 3.1194 3.1194 3.2053 3.2053 3.4807 3.4807 3.6255 3.6255 3.7724 3.7724 5.2294 5.2294 5.3313 5.3313 5.3914 5.3914 5.5099 5.5099 5.7141 5.7141 5.8177 5.8177 6.7347 6.7347 6.9532 6.9532 7.0050 7.0050 7.0929 7.0929 k = 0.5979 0.0492-0.5134 ( 8290 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5572 -38.5572 -38.5562 -38.5562 -37.5491 -37.5491 -37.5471 -37.5471 -37.5011 -37.5011 -37.5008 -37.5008 -9.8238 -9.8238 -9.7375 -9.7375 -9.5909 -9.5909 -9.4378 -9.4378 -9.4123 -9.4123 -9.3056 -9.3056 0.2398 0.2398 0.5372 0.5372 0.8102 0.8102 1.0003 1.0003 1.0903 1.0903 1.3770 1.3770 1.6976 1.6976 1.8629 1.8629 2.0267 2.0267 2.1314 2.1314 2.4629 2.4629 2.6852 2.6852 2.9044 2.9044 3.0939 3.0939 3.1818 3.1818 3.4819 3.4819 3.6199 3.6199 3.7897 3.7897 5.2239 5.2239 5.3274 5.3274 5.4080 5.4080 5.5108 5.5108 5.7101 5.7101 5.8201 5.8201 6.7284 6.7284 6.9469 6.9469 6.9999 6.9999 7.0904 7.0904 k = 0.5881 0.0690-0.5134 ( 8292 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5573 -38.5573 -38.5561 -38.5561 -37.5492 -37.5492 -37.5470 -37.5470 -37.5011 -37.5011 -37.5008 -37.5008 -9.8321 -9.8321 -9.7400 -9.7400 -9.5738 -9.5738 -9.4404 -9.4404 -9.4147 -9.4147 -9.3065 -9.3065 0.2083 0.2083 0.5493 0.5493 0.8299 0.8299 1.0076 1.0076 1.0892 1.0892 1.3860 1.3860 1.7360 1.7360 1.8673 1.8673 2.0315 2.0315 2.1394 2.1394 2.4318 2.4318 2.6546 2.6546 2.9125 2.9125 3.0675 3.0675 3.1585 3.1585 3.4829 3.4829 3.6146 3.6146 3.8072 3.8072 5.2185 5.2185 5.3224 5.3224 5.4260 5.4260 5.5118 5.5118 5.7055 5.7055 5.8223 5.8223 6.7230 6.7230 6.9402 6.9402 6.9943 6.9943 7.0878 7.0878 k = 0.5783 0.0888-0.5134 ( 8290 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5573 -38.5573 -38.5561 -38.5561 -37.5493 -37.5493 -37.5469 -37.5469 -37.5011 -37.5011 -37.5008 -37.5008 -9.8395 -9.8395 -9.7430 -9.7430 -9.5568 -9.5568 -9.4426 -9.4426 -9.4169 -9.4169 -9.3081 -9.3081 0.1782 0.1782 0.5606 0.5606 0.8490 0.8490 1.0140 1.0140 1.0877 1.0877 1.3980 1.3980 1.7707 1.7707 1.8731 1.8731 2.0395 2.0395 2.1493 2.1493 2.3999 2.3999 2.6214 2.6214 2.9198 2.9198 3.0412 3.0412 3.1367 3.1367 3.4835 3.4835 3.6096 3.6096 3.8244 3.8244 5.2134 5.2134 5.3169 5.3169 5.4442 5.4442 5.5128 5.5128 5.7003 5.7003 5.8244 5.8244 6.7183 6.7183 6.9335 6.9335 6.9881 6.9881 7.0855 7.0855 k = 0.5685 0.1086-0.5134 ( 8296 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5574 -38.5574 -38.5560 -38.5560 -37.5494 -37.5494 -37.5468 -37.5468 -37.5011 -37.5011 -37.5008 -37.5008 -9.8462 -9.8462 -9.7462 -9.7462 -9.5404 -9.5404 -9.4447 -9.4447 -9.4189 -9.4189 -9.3102 -9.3102 0.1503 0.1503 0.5708 0.5708 0.8669 0.8669 1.0191 1.0191 1.0865 1.0865 1.4120 1.4120 1.7981 1.7981 1.8833 1.8833 2.0507 2.0507 2.1610 2.1610 2.3678 2.3678 2.5863 2.5863 2.9234 2.9234 3.0178 3.0178 3.1171 3.1171 3.4839 3.4839 3.6048 3.6048 3.8407 3.8407 5.2086 5.2086 5.3114 5.3114 5.4618 5.4618 5.5140 5.5140 5.6945 5.6945 5.8262 5.8262 6.7144 6.7144 6.9271 6.9271 6.9815 6.9815 7.0833 7.0833 k = 0.5588 0.1284-0.5134 ( 8300 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5574 -38.5574 -38.5560 -38.5560 -37.5494 -37.5494 -37.5467 -37.5467 -37.5011 -37.5011 -37.5008 -37.5008 -9.8520 -9.8520 -9.7491 -9.7491 -9.5251 -9.5251 -9.4465 -9.4465 -9.4207 -9.4207 -9.3128 -9.3128 0.1251 0.1251 0.5797 0.5797 0.8831 0.8831 1.0228 1.0228 1.0861 1.0861 1.4266 1.4266 1.8145 1.8145 1.9018 1.9018 2.0648 2.0648 2.1739 2.1739 2.3364 2.3364 2.5501 2.5501 2.9191 2.9191 3.0020 3.0020 3.0999 3.0999 3.4840 3.4840 3.6005 3.6005 3.8556 3.8556 5.2045 5.2045 5.3061 5.3061 5.4778 5.4778 5.5162 5.5162 5.6882 5.6882 5.8279 5.8279 6.7112 6.7112 6.9212 6.9212 6.9749 6.9749 7.0814 7.0814 k = 0.5490 0.1482-0.5134 ( 8290 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5574 -38.5574 -38.5559 -38.5559 -37.5495 -37.5495 -37.5467 -37.5467 -37.5011 -37.5011 -37.5008 -37.5008 -9.8570 -9.8570 -9.7518 -9.7518 -9.5110 -9.5110 -9.4480 -9.4480 -9.4222 -9.4222 -9.3157 -9.3157 0.1033 0.1033 0.5873 0.5873 0.8972 0.8972 1.0251 1.0251 1.0866 1.0866 1.4411 1.4411 1.8209 1.8209 1.9280 1.9280 2.0807 2.0807 2.1871 2.1871 2.3068 2.3068 2.5136 2.5136 2.9046 2.9046 2.9969 2.9969 3.0851 3.0851 3.4839 3.4839 3.5965 3.5965 3.8689 3.8689 5.2008 5.2008 5.3013 5.3013 5.4905 5.4905 5.5203 5.5203 5.6815 5.6815 5.8293 5.8293 6.7088 6.7088 6.9160 6.9160 6.9685 6.9685 7.0798 7.0798 k = 0.5392 0.1680-0.5134 ( 8288 PWs) bands (ev): -66.5283 -66.5283 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5495 -37.5495 -37.5466 -37.5466 -37.5011 -37.5011 -37.5008 -37.5008 -9.8611 -9.8611 -9.7541 -9.7541 -9.4987 -9.4987 -9.4492 -9.4492 -9.4235 -9.4235 -9.3187 -9.3187 0.0850 0.0850 0.5935 0.5935 0.9089 0.9089 1.0264 1.0264 1.0879 1.0879 1.4544 1.4544 1.8216 1.8216 1.9580 1.9580 2.0967 2.0967 2.1982 2.1982 2.2821 2.2821 2.4776 2.4776 2.8844 2.8844 2.9990 2.9990 3.0726 3.0726 3.4837 3.4837 3.5931 3.5931 3.8801 3.8801 5.1978 5.1978 5.2971 5.2971 5.4984 5.4984 5.5278 5.5278 5.6747 5.6747 5.8306 5.8306 6.7069 6.7069 6.9116 6.9116 6.9626 6.9626 7.0785 7.0785 k = 0.5294 0.1878-0.5134 ( 8286 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5466 -37.5466 -37.5011 -37.5011 -37.5008 -37.5008 -9.8643 -9.8643 -9.7559 -9.7559 -9.4885 -9.4885 -9.4501 -9.4501 -9.4246 -9.4246 -9.3216 -9.3216 0.0706 0.0706 0.5983 0.5983 0.9180 0.9180 1.0270 1.0270 1.0895 1.0895 1.4657 1.4657 1.8199 1.8199 1.9890 1.9890 2.1093 2.1093 2.2027 2.2027 2.2683 2.2683 2.4434 2.4434 2.8641 2.8641 3.0041 3.0041 3.0622 3.0622 3.4835 3.4835 3.5903 3.5903 3.8890 3.8890 5.1954 5.1954 5.2938 5.2938 5.5022 5.5022 5.5373 5.5373 5.6681 5.6681 5.8315 5.8315 6.7055 6.7055 6.9082 6.9082 6.9577 6.9577 7.0774 7.0774 k = 0.5196 0.2076-0.5134 ( 8290 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5466 -37.5466 -37.5011 -37.5011 -37.5008 -37.5008 -9.8665 -9.8665 -9.7573 -9.7573 -9.4809 -9.4809 -9.4507 -9.4507 -9.4253 -9.4253 -9.3240 -9.3240 0.0601 0.0601 0.6018 0.6018 0.9244 0.9244 1.0274 1.0274 1.0910 1.0910 1.4744 1.4744 1.8178 1.8178 2.0195 2.0195 2.1133 2.1133 2.1989 2.1989 2.2696 2.2696 2.4128 2.4128 2.8474 2.8474 3.0097 3.0097 3.0538 3.0538 3.4833 3.4833 3.5882 3.5882 3.8956 3.8956 5.1937 5.1937 5.2913 5.2913 5.5038 5.5038 5.5463 5.5463 5.6624 5.6624 5.8323 5.8323 6.7046 6.7046 6.9058 6.9058 6.9538 6.9538 7.0767 7.0767 k = 0.5098 0.2274-0.5134 ( 8294 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.8679 -9.8679 -9.7581 -9.7581 -9.4761 -9.4761 -9.4511 -9.4511 -9.4258 -9.4258 -9.3256 -9.3256 0.0538 0.0538 0.6038 0.6038 0.9282 0.9282 1.0276 1.0276 1.0921 1.0921 1.4798 1.4798 1.8161 1.8161 2.0475 2.0475 2.1051 2.1051 2.1954 2.1954 2.2784 2.2784 2.3893 2.3893 2.8365 2.8365 3.0144 3.0144 3.0478 3.0478 3.4831 3.4831 3.5869 3.5869 3.8995 3.8995 5.1926 5.1926 5.2897 5.2897 5.5045 5.5045 5.5525 5.5525 5.6584 5.6584 5.8327 5.8327 6.7040 6.7040 6.9043 6.9043 6.9514 6.9514 7.0762 7.0762 k = 0.5000 0.2472-0.5134 ( 8280 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.8684 -9.8684 -9.7584 -9.7584 -9.4745 -9.4745 -9.4512 -9.4512 -9.4260 -9.4260 -9.3262 -9.3262 0.0517 0.0517 0.6045 0.6045 0.9294 0.9294 1.0277 1.0277 1.0924 1.0924 1.4817 1.4817 1.8155 1.8155 2.0638 2.0638 2.0947 2.0947 2.1947 2.1947 2.2834 2.2834 2.3798 2.3798 2.8328 2.8328 3.0163 3.0163 3.0455 3.0455 3.4831 3.4831 3.5865 3.5865 3.9009 3.9009 5.1923 5.1923 5.2892 5.2892 5.5047 5.5047 5.5547 5.5547 5.6570 5.6570 5.8328 5.8328 6.7038 6.7038 6.9038 6.9038 6.9506 6.9506 7.0761 7.0761 k = 0.5000 0.2472-0.5134 ( 8280 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.8684 -9.8684 -9.7584 -9.7584 -9.4745 -9.4745 -9.4512 -9.4512 -9.4260 -9.4260 -9.3262 -9.3262 0.0517 0.0517 0.6045 0.6045 0.9294 0.9294 1.0277 1.0277 1.0924 1.0924 1.4817 1.4817 1.8155 1.8155 2.0638 2.0638 2.0947 2.0947 2.1947 2.1947 2.2834 2.2834 2.3798 2.3798 2.8328 2.8328 3.0163 3.0163 3.0455 3.0455 3.4831 3.4831 3.5865 3.5865 3.9009 3.9009 5.1923 5.1923 5.2892 5.2892 5.5047 5.5047 5.5547 5.5547 5.6570 5.6570 5.8328 5.8328 6.7038 6.7038 6.9038 6.9038 6.9506 6.9506 7.0761 7.0761 k = 0.5125 0.2534-0.4983 ( 8288 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.8687 -9.8687 -9.7581 -9.7581 -9.4744 -9.4744 -9.4555 -9.4555 -9.4216 -9.4216 -9.3262 -9.3262 0.0516 0.0516 0.6054 0.6054 0.9293 0.9293 1.0266 1.0266 1.0939 1.0939 1.4814 1.4814 1.8137 1.8137 2.0546 2.0546 2.1032 2.1032 2.1922 2.1922 2.2869 2.2869 2.3807 2.3807 2.8337 2.8337 3.0153 3.0153 3.0457 3.0457 3.4824 3.4824 3.5865 3.5865 3.9002 3.9002 5.1920 5.1920 5.2898 5.2898 5.5041 5.5041 5.5557 5.5557 5.6571 5.6571 5.8329 5.8329 6.7039 6.7039 6.9025 6.9025 6.9513 6.9513 7.0763 7.0763 k = 0.5249 0.2596-0.4832 ( 8289 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.8695 -9.8695 -9.7571 -9.7571 -9.4745 -9.4745 -9.4642 -9.4642 -9.4127 -9.4127 -9.3264 -9.3264 0.0514 0.0514 0.6079 0.6079 0.9290 0.9290 1.0234 1.0234 1.0980 1.0980 1.4807 1.4807 1.8083 1.8083 2.0384 2.0384 2.1157 2.1157 2.1881 2.1881 2.2950 2.2950 2.3841 2.3841 2.8367 2.8367 3.0126 3.0126 3.0464 3.0464 3.4806 3.4806 3.5866 3.5866 3.8983 3.8983 5.1910 5.1910 5.2914 5.2914 5.5026 5.5026 5.5585 5.5585 5.6574 5.6574 5.8332 5.8332 6.7039 6.7039 6.8985 6.8985 6.9531 6.9531 7.0771 7.0771 k = 0.5374 0.2657-0.4681 ( 8299 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.8710 -9.8710 -9.7555 -9.7555 -9.4778 -9.4778 -9.4706 -9.4706 -9.4026 -9.4026 -9.3266 -9.3266 0.0509 0.0509 0.6120 0.6120 0.9283 0.9283 1.0184 1.0184 1.1046 1.1046 1.4794 1.4794 1.7995 1.7995 2.0217 2.0217 2.1214 2.1214 2.1902 2.1902 2.3026 2.3026 2.3917 2.3917 2.8414 2.8414 3.0085 3.0085 3.0472 3.0472 3.4777 3.4777 3.5867 3.5867 3.8951 3.8951 5.1896 5.1896 5.2941 5.2941 5.5005 5.5005 5.5626 5.5626 5.6580 5.6580 5.8336 5.8336 6.7040 6.7040 6.8925 6.8925 6.9559 6.9559 7.0781 7.0781 k = 0.5499 0.2719-0.4530 ( 8302 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.8732 -9.8732 -9.7532 -9.7532 -9.4871 -9.4871 -9.4710 -9.4710 -9.3924 -9.3924 -9.3270 -9.3270 0.0503 0.0503 0.6176 0.6176 0.9274 0.9274 1.0121 1.0121 1.1134 1.1134 1.4775 1.4775 1.7874 1.7874 2.0057 2.0057 2.1172 2.1172 2.2017 2.2017 2.3067 2.3067 2.4046 2.4046 2.8477 2.8477 3.0033 3.0033 3.0478 3.0478 3.4741 3.4741 3.5866 3.5866 3.8909 3.8909 5.1877 5.1877 5.2976 5.2976 5.4982 5.4982 5.5675 5.5675 5.6589 5.6589 5.8341 5.8341 6.7042 6.7042 6.8848 6.8848 6.9594 6.9594 7.0793 7.0793 k = 0.5623 0.2780-0.4379 ( 8304 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5464 -37.5464 -37.5012 -37.5012 -37.5008 -37.5008 -9.8760 -9.8760 -9.7503 -9.7503 -9.4973 -9.4973 -9.4700 -9.4700 -9.3823 -9.3823 -9.3274 -9.3274 0.0496 0.0496 0.6245 0.6245 0.9259 0.9259 1.0049 1.0049 1.1241 1.1241 1.4751 1.4751 1.7724 1.7724 1.9907 1.9907 2.1076 2.1076 2.2181 2.2181 2.3076 2.3076 2.4224 2.4224 2.8552 2.8552 2.9974 2.9974 3.0479 3.0479 3.4699 3.4699 3.5864 3.5864 3.8859 3.8859 5.1858 5.1858 5.3018 5.3018 5.4961 5.4961 5.5728 5.5728 5.6601 5.6601 5.8347 5.8347 6.7044 6.7044 6.8759 6.8759 6.9635 6.9635 7.0804 7.0804 k = 0.5748 0.2842-0.4228 ( 8305 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5498 -37.5498 -37.5464 -37.5464 -37.5012 -37.5012 -37.5008 -37.5008 -9.8797 -9.8797 -9.7468 -9.7468 -9.5073 -9.5073 -9.4686 -9.4686 -9.3726 -9.3726 -9.3279 -9.3279 0.0488 0.0488 0.6324 0.6324 0.9237 0.9237 0.9973 0.9973 1.1366 1.1366 1.4721 1.4721 1.7550 1.7550 1.9766 1.9766 2.0965 2.0965 2.2336 2.2336 2.3083 2.3083 2.4434 2.4434 2.8636 2.8636 2.9909 2.9909 3.0475 3.0475 3.4656 3.4656 3.5860 3.5860 3.8802 3.8802 5.1837 5.1837 5.3065 5.3065 5.4943 5.4943 5.5782 5.5782 5.6616 5.6616 5.8353 5.8353 6.7047 6.7047 6.8661 6.8661 6.9679 6.9679 7.0812 7.0812 k = 0.5872 0.2904-0.4077 ( 8304 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5498 -37.5498 -37.5464 -37.5464 -37.5012 -37.5012 -37.5008 -37.5008 -9.8841 -9.8841 -9.7427 -9.7427 -9.5168 -9.5168 -9.4669 -9.4669 -9.3633 -9.3633 -9.3285 -9.3285 0.0480 0.0480 0.6410 0.6410 0.9204 0.9204 0.9902 0.9902 1.1505 1.1505 1.4684 1.4684 1.7357 1.7357 1.9633 1.9633 2.0857 2.0857 2.2428 2.2428 2.3138 2.3138 2.4661 2.4661 2.8723 2.8723 2.9843 2.9843 3.0467 3.0467 3.4615 3.4615 3.5853 3.5853 3.8741 3.8741 5.1819 5.1819 5.3116 5.3116 5.4928 5.4928 5.5832 5.5832 5.6634 5.6634 5.8359 5.8359 6.7051 6.7051 6.8559 6.8559 6.9727 6.9727 7.0816 7.0816 k = 0.5997 0.2965-0.3926 ( 8308 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5499 -37.5499 -37.5463 -37.5463 -37.5012 -37.5012 -37.5008 -37.5008 -9.8895 -9.8895 -9.7380 -9.7380 -9.5256 -9.5256 -9.4649 -9.4649 -9.3545 -9.3545 -9.3291 -9.3291 0.0472 0.0472 0.6499 0.6499 0.9152 0.9152 0.9845 0.9845 1.1656 1.1656 1.4642 1.4642 1.7150 1.7150 1.9506 1.9506 2.0758 2.0758 2.2426 2.2426 2.3270 2.3270 2.4895 2.4895 2.8806 2.8806 2.9781 2.9781 3.0456 3.0456 3.4579 3.4579 3.5844 3.5844 3.8679 3.8679 5.1802 5.1802 5.3170 5.3170 5.4917 5.4917 5.5878 5.5878 5.6656 5.6656 5.8363 5.8363 6.7055 6.7055 6.8454 6.8454 6.9778 6.9778 7.0816 7.0816 k = 0.6122 0.3027-0.3775 ( 8309 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5499 -37.5499 -37.5462 -37.5462 -37.5012 -37.5012 -37.5008 -37.5008 -9.8959 -9.8959 -9.7327 -9.7327 -9.5335 -9.5335 -9.4626 -9.4626 -9.3463 -9.3463 -9.3298 -9.3298 0.0465 0.0465 0.6587 0.6587 0.9077 0.9077 0.9814 0.9814 1.1815 1.1815 1.4595 1.4595 1.6935 1.6935 1.9383 1.9383 2.0671 2.0671 2.2355 2.2355 2.3456 2.3456 2.5127 2.5127 2.8875 2.8875 2.9728 2.9728 3.0445 3.0445 3.4549 3.4549 3.5834 3.5834 3.8617 3.8617 5.1788 5.1788 5.3225 5.3225 5.4911 5.4911 5.5919 5.5919 5.6680 5.6680 5.8366 5.8366 6.7059 6.7059 6.8349 6.8349 6.9830 6.9830 7.0810 7.0810 k = 0.6246 0.3089-0.3624 ( 8315 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5500 -37.5500 -37.5462 -37.5462 -37.5012 -37.5012 -37.5008 -37.5008 -9.9032 -9.9032 -9.7268 -9.7268 -9.5405 -9.5405 -9.4601 -9.4601 -9.3390 -9.3390 -9.3301 -9.3301 0.0460 0.0460 0.6669 0.6669 0.8976 0.8976 0.9813 0.9813 1.1975 1.1975 1.4546 1.4546 1.6718 1.6718 1.9263 1.9263 2.0596 2.0596 2.2247 2.2247 2.3664 2.3664 2.5353 2.5353 2.8917 2.8917 2.9696 2.9696 3.0439 3.0439 3.4529 3.4529 3.5823 3.5823 3.8560 3.8560 5.1778 5.1778 5.3282 5.3282 5.4907 5.4907 5.5953 5.5953 5.6707 5.6707 5.8365 5.8365 6.7064 6.7064 6.8247 6.8247 6.9882 6.9882 7.0801 7.0801 k = 0.6371 0.3150-0.3473 ( 8317 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5578 -38.5578 -38.5556 -38.5556 -37.5501 -37.5501 -37.5461 -37.5461 -37.5012 -37.5012 -37.5008 -37.5008 -9.9117 -9.9117 -9.7203 -9.7203 -9.5465 -9.5465 -9.4574 -9.4574 -9.3345 -9.3345 -9.3282 -9.3282 0.0457 0.0457 0.6737 0.6737 0.8854 0.8854 0.9845 0.9845 1.2129 1.2129 1.4499 1.4499 1.6503 1.6503 1.9146 1.9146 2.0531 2.0531 2.2122 2.2122 2.3875 2.3875 2.5569 2.5569 2.8920 2.8920 2.9691 2.9691 3.0442 3.0442 3.4519 3.4519 3.5812 3.5812 3.8509 3.8509 5.1771 5.1771 5.3339 5.3339 5.4907 5.4907 5.5980 5.5980 5.6736 5.6736 5.8360 5.8360 6.7069 6.7069 6.8151 6.8151 6.9932 6.9932 7.0788 7.0788 k = 0.6371 0.3150-0.3473 ( 8317 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5578 -38.5578 -38.5556 -38.5556 -37.5501 -37.5501 -37.5461 -37.5461 -37.5012 -37.5012 -37.5008 -37.5008 -9.9117 -9.9117 -9.7203 -9.7203 -9.5465 -9.5465 -9.4574 -9.4574 -9.3345 -9.3345 -9.3282 -9.3282 0.0457 0.0457 0.6737 0.6737 0.8854 0.8854 0.9845 0.9845 1.2129 1.2129 1.4499 1.4499 1.6503 1.6503 1.9146 1.9146 2.0531 2.0531 2.2122 2.2122 2.3875 2.3875 2.5569 2.5569 2.8920 2.8920 2.9691 2.9691 3.0442 3.0442 3.4519 3.4519 3.5812 3.5812 3.8509 3.8509 5.1771 5.1771 5.3339 5.3339 5.4907 5.4907 5.5980 5.5980 5.6736 5.6736 5.8360 5.8360 6.7069 6.7069 6.8151 6.8151 6.9932 6.9932 7.0788 7.0788 k = 0.6314 0.3122-0.3259 ( 8317 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5578 -38.5578 -38.5556 -38.5556 -37.5502 -37.5502 -37.5460 -37.5460 -37.5012 -37.5012 -37.5008 -37.5008 -9.9307 -9.9307 -9.6982 -9.6982 -9.5581 -9.5581 -9.4547 -9.4547 -9.3321 -9.3321 -9.3232 -9.3232 0.0546 0.0546 0.6739 0.6739 0.8908 0.8908 0.9835 0.9835 1.2299 1.2299 1.4331 1.4331 1.6544 1.6544 1.9029 1.9029 2.0474 2.0474 2.1913 2.1913 2.3936 2.3936 2.5919 2.5919 2.8682 2.8682 2.9627 2.9627 3.0352 3.0352 3.4497 3.4497 3.5720 3.5720 3.8461 3.8461 5.1803 5.1803 5.3519 5.3519 5.4918 5.4918 5.5978 5.5978 5.6747 5.6747 5.8353 5.8353 6.7002 6.7002 6.8085 6.8085 6.9952 6.9952 7.0739 7.0739 k = 0.6257 0.3094-0.3045 ( 8309 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5579 -38.5579 -38.5555 -38.5555 -37.5503 -37.5503 -37.5458 -37.5458 -37.5012 -37.5012 -37.5007 -37.5007 -9.9504 -9.9504 -9.6752 -9.6752 -9.5695 -9.5695 -9.4517 -9.4517 -9.3302 -9.3302 -9.3180 -9.3180 0.0648 0.0648 0.6709 0.6709 0.8965 0.8965 0.9808 0.9808 1.2486 1.2486 1.4173 1.4173 1.6600 1.6600 1.8920 1.8920 2.0400 2.0400 2.1722 2.1722 2.3944 2.3944 2.6306 2.6306 2.8318 2.8318 2.9527 2.9527 3.0392 3.0392 3.4464 3.4464 3.5641 3.5641 3.8435 3.8435 5.1845 5.1845 5.3705 5.3705 5.4928 5.4928 5.5972 5.5972 5.6755 5.6755 5.8335 5.8335 6.6942 6.6942 6.8025 6.8025 6.9964 6.9964 7.0685 7.0685 k = 0.6200 0.3065-0.2831 ( 8310 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5580 -38.5580 -38.5554 -38.5554 -37.5505 -37.5505 -37.5456 -37.5456 -37.5012 -37.5012 -37.5007 -37.5007 -9.9704 -9.9704 -9.6519 -9.6519 -9.5808 -9.5808 -9.4482 -9.4482 -9.3284 -9.3284 -9.3130 -9.3130 0.0761 0.0761 0.6651 0.6651 0.9025 0.9025 0.9775 0.9775 1.2667 1.2667 1.4050 1.4050 1.6639 1.6639 1.8829 1.8829 2.0298 2.0298 2.1564 2.1564 2.3900 2.3900 2.6658 2.6658 2.7970 2.7970 2.9344 2.9344 3.0537 3.0537 3.4423 3.4423 3.5579 3.5579 3.8433 3.8433 5.1897 5.1897 5.3893 5.3893 5.4935 5.4935 5.5963 5.5963 5.6762 5.6762 5.8305 5.8305 6.6892 6.6892 6.7973 6.7973 6.9965 6.9965 7.0634 7.0634 k = 0.6142 0.3037-0.2617 ( 8308 PWs) bands (ev): -66.5285 -66.5285 -66.5280 -66.5280 -38.5581 -38.5581 -38.5553 -38.5553 -37.5507 -37.5507 -37.5455 -37.5455 -37.5013 -37.5013 -37.5007 -37.5007 -9.9902 -9.9902 -9.6287 -9.6287 -9.5919 -9.5919 -9.4444 -9.4444 -9.3264 -9.3264 -9.3084 -9.3084 0.0885 0.0885 0.6574 0.6574 0.9086 0.9086 0.9746 0.9746 1.2806 1.2806 1.3998 1.3998 1.6637 1.6637 1.8768 1.8768 2.0163 2.0163 2.1450 2.1450 2.3802 2.3802 2.6772 2.6772 2.7834 2.7834 2.9149 2.9149 3.0719 3.0719 3.4380 3.4380 3.5533 3.5533 3.8457 3.8457 5.1955 5.1955 5.4077 5.4077 5.4936 5.4936 5.5951 5.5951 5.6768 5.6768 5.8263 5.8263 6.6855 6.6855 6.7929 6.7929 6.9950 6.9950 7.0594 7.0594 k = 0.6085 0.3009-0.2403 ( 8302 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5582 -38.5582 -38.5552 -38.5552 -37.5508 -37.5508 -37.5453 -37.5453 -37.5013 -37.5013 -37.5007 -37.5007 -10.0097 -10.0097 -9.6060 -9.6060 -9.6023 -9.6023 -9.4402 -9.4402 -9.3244 -9.3244 -9.3043 -9.3043 0.1017 0.1017 0.6485 0.6485 0.9150 0.9150 0.9727 0.9727 1.2860 1.2860 1.4053 1.4053 1.6578 1.6578 1.8746 1.8746 1.9999 1.9999 2.1379 2.1379 2.3646 2.3646 2.6530 2.6530 2.7943 2.7943 2.9054 2.9054 3.0909 3.0909 3.4342 3.4342 3.5505 3.5505 3.8507 3.8507 5.2018 5.2018 5.4254 5.4254 5.4928 5.4928 5.5937 5.5937 5.6775 5.6775 5.8208 5.8208 6.6833 6.6833 6.7894 6.7894 6.9916 6.9916 7.0569 7.0569 k = 0.6028 0.2981-0.2189 ( 8303 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5583 -38.5583 -38.5551 -38.5551 -37.5510 -37.5510 -37.5451 -37.5451 -37.5013 -37.5013 -37.5007 -37.5007 -10.0287 -10.0287 -9.6132 -9.6132 -9.5831 -9.5831 -9.4356 -9.4356 -9.3224 -9.3224 -9.3006 -9.3006 0.1158 0.1158 0.6395 0.6395 0.9214 0.9214 0.9718 0.9718 1.2826 1.2826 1.4213 1.4213 1.6456 1.6456 1.8765 1.8765 1.9815 1.9815 2.1345 2.1345 2.3426 2.3426 2.6162 2.6162 2.7923 2.7923 2.9200 2.9200 3.1112 3.1112 3.4319 3.4319 3.5495 3.5495 3.8585 3.8585 5.2084 5.2084 5.4415 5.4415 5.4909 5.4909 5.5925 5.5925 5.6784 5.6784 5.8140 5.8140 6.6830 6.6830 6.7867 6.7867 6.9864 6.9864 7.0562 7.0562 k = 0.5971 0.2952-0.1975 ( 8299 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5584 -38.5584 -38.5550 -38.5550 -37.5511 -37.5511 -37.5449 -37.5449 -37.5013 -37.5013 -37.5007 -37.5007 -10.0471 -10.0471 -9.6234 -9.6234 -9.5612 -9.5612 -9.4307 -9.4307 -9.3203 -9.3203 -9.2975 -9.2975 0.1305 0.1305 0.6313 0.6313 0.9277 0.9277 0.9722 0.9722 1.2733 1.2733 1.4439 1.4439 1.6281 1.6281 1.8813 1.8813 1.9622 1.9622 2.1339 2.1339 2.3141 2.3141 2.5793 2.5793 2.7710 2.7710 2.9490 2.9490 3.1363 3.1363 3.4315 3.4315 3.5504 3.5504 3.8693 3.8693 5.2151 5.2151 5.4552 5.4552 5.4881 5.4881 5.5918 5.5918 5.6796 5.6796 5.8059 5.8059 6.6848 6.6848 6.7850 6.7850 6.9798 6.9798 7.0570 7.0570 k = 0.5914 0.2924-0.1761 ( 8304 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5585 -38.5585 -38.5549 -38.5549 -37.5513 -37.5513 -37.5448 -37.5448 -37.5014 -37.5014 -37.5007 -37.5007 -10.0648 -10.0648 -9.6331 -9.6331 -9.5399 -9.5399 -9.4255 -9.4255 -9.3182 -9.3182 -9.2950 -9.2950 0.1456 0.1456 0.6245 0.6245 0.9339 0.9339 0.9738 0.9738 1.2612 1.2612 1.4681 1.4681 1.6079 1.6079 1.8870 1.8870 1.9437 1.9437 2.1351 2.1351 2.2797 2.2797 2.5456 2.5456 2.7416 2.7416 2.9722 2.9722 3.1718 3.1718 3.4334 3.4334 3.5529 3.5529 3.8832 3.8832 5.2219 5.2219 5.4648 5.4648 5.4851 5.4851 5.5919 5.5919 5.6810 5.6810 5.7966 5.7966 6.6886 6.6886 6.7842 6.7842 6.9726 6.9726 7.0589 7.0589 k = 0.5857 0.2896-0.1547 ( 8310 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5585 -38.5585 -38.5548 -38.5548 -37.5515 -37.5515 -37.5446 -37.5446 -37.5014 -37.5014 -37.5006 -37.5006 -10.0817 -10.0817 -9.6425 -9.6425 -9.5194 -9.5194 -9.4200 -9.4200 -9.3162 -9.3162 -9.2929 -9.2929 0.1611 0.1611 0.6199 0.6199 0.9399 0.9399 0.9765 0.9765 1.2481 1.2481 1.4870 1.4870 1.5911 1.5911 1.8888 1.8888 1.9299 1.9299 2.1370 2.1370 2.2416 2.2416 2.5156 2.5156 2.7090 2.7090 2.9815 2.9815 3.2195 3.2195 3.4376 3.4376 3.5570 3.5570 3.9001 3.9001 5.2285 5.2285 5.4668 5.4668 5.4847 5.4847 5.5934 5.5934 5.6826 5.6826 5.7861 5.7861 6.6944 6.6944 6.7843 6.7843 6.9654 6.9654 7.0615 7.0615 k = 0.5800 0.2868-0.1333 ( 8313 PWs) bands (ev): -66.5285 -66.5285 -66.5279 -66.5279 -38.5586 -38.5586 -38.5548 -38.5548 -37.5516 -37.5516 -37.5445 -37.5445 -37.5014 -37.5014 -37.5006 -37.5006 -10.0978 -10.0978 -9.6515 -9.6515 -9.4996 -9.4996 -9.4143 -9.4143 -9.3143 -9.3143 -9.2915 -9.2915 0.1768 0.1768 0.6181 0.6181 0.9456 0.9456 0.9800 0.9800 1.2347 1.2347 1.4885 1.4885 1.5897 1.5897 1.8800 1.8800 1.9264 1.9264 2.1370 2.1370 2.2042 2.2042 2.4886 2.4886 2.6750 2.6750 2.9782 2.9782 3.2755 3.2755 3.4442 3.4442 3.5629 3.5629 3.9202 3.9202 5.2350 5.2350 5.4614 5.4614 5.4864 5.4864 5.5965 5.5965 5.6843 5.6843 5.7746 5.7746 6.7018 6.7018 6.7853 6.7853 6.9589 6.9589 7.0647 7.0647 k = 0.5743 0.2839-0.1120 ( 8319 PWs) bands (ev): -66.5286 -66.5286 -66.5279 -66.5279 -38.5587 -38.5587 -38.5547 -38.5547 -37.5518 -37.5518 -37.5443 -37.5443 -37.5014 -37.5014 -37.5006 -37.5006 -10.1130 -10.1130 -9.6599 -9.6599 -9.4807 -9.4807 -9.4083 -9.4083 -9.3124 -9.3124 -9.2906 -9.2906 0.1926 0.1926 0.6192 0.6192 0.9511 0.9511 0.9840 0.9840 1.2215 1.2215 1.4685 1.4685 1.6078 1.6078 1.8626 1.8626 1.9303 1.9303 2.1270 2.1270 2.1783 2.1783 2.4636 2.4636 2.6406 2.6406 2.9664 2.9664 3.3334 3.3334 3.4536 3.4536 3.5709 3.5709 3.9433 3.9433 5.2411 5.2411 5.4526 5.4526 5.4861 5.4861 5.6012 5.6012 5.6859 5.6859 5.7624 5.7624 6.7102 6.7102 6.7871 6.7871 6.9537 6.9537 7.0681 7.0681 k = 0.5685 0.2811-0.0906 ( 8328 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5588 -38.5588 -38.5546 -38.5546 -37.5519 -37.5519 -37.5442 -37.5442 -37.5015 -37.5015 -37.5006 -37.5006 -10.1273 -10.1273 -9.6679 -9.6679 -9.4628 -9.4628 -9.4022 -9.4022 -9.3108 -9.3108 -9.2902 -9.2902 0.2083 0.2083 0.6236 0.6236 0.9562 0.9562 0.9882 0.9882 1.2090 1.2090 1.4374 1.4374 1.6350 1.6350 1.8418 1.8418 1.9353 1.9353 2.1008 2.1008 2.1724 2.1724 2.4396 2.4396 2.6061 2.6061 2.9492 2.9492 3.3858 3.3858 3.4677 3.4677 3.5828 3.5828 3.9691 3.9691 5.2470 5.2470 5.4421 5.4421 5.4828 5.4828 5.6071 5.6071 5.6867 5.6867 5.7502 5.7502 6.7190 6.7190 6.7894 6.7894 6.9505 6.9505 7.0718 7.0718 k = 0.5628 0.2783-0.0692 ( 8328 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5588 -38.5588 -38.5545 -38.5545 -37.5520 -37.5520 -37.5440 -37.5440 -37.5015 -37.5015 -37.5006 -37.5006 -10.1405 -10.1405 -9.6753 -9.6753 -9.4458 -9.4458 -9.3960 -9.3960 -9.3094 -9.3094 -9.2905 -9.2905 0.2239 0.2239 0.6312 0.6312 0.9611 0.9611 0.9919 0.9919 1.1975 1.1975 1.4022 1.4022 1.6636 1.6636 1.8200 1.8200 1.9384 1.9384 2.0723 2.0723 2.1754 2.1754 2.4161 2.4161 2.5718 2.5718 2.9288 2.9288 3.4231 3.4231 3.4894 3.4894 3.6024 3.6024 3.9976 3.9976 5.2526 5.2526 5.4305 5.4305 5.4768 5.4768 5.6133 5.6133 5.6862 5.6862 5.7390 5.7390 6.7276 6.7276 6.7919 6.7919 6.9501 6.9501 7.0757 7.0757 k = 0.5571 0.2755-0.0478 ( 8326 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5589 -38.5589 -38.5545 -38.5545 -37.5521 -37.5521 -37.5439 -37.5439 -37.5015 -37.5015 -37.5006 -37.5006 -10.1528 -10.1528 -9.6822 -9.6822 -9.4299 -9.4299 -9.3896 -9.3896 -9.3083 -9.3083 -9.2912 -9.2912 0.2395 0.2395 0.6420 0.6420 0.9655 0.9655 0.9949 0.9949 1.1870 1.1870 1.3655 1.3655 1.6876 1.6876 1.8011 1.8011 1.9383 1.9383 2.0500 2.0500 2.1808 2.1808 2.3928 2.3928 2.5379 2.5379 2.9067 2.9067 3.4439 3.4439 3.5134 3.5134 3.6341 3.6341 4.0282 4.0282 5.2579 5.2579 5.4181 5.4181 5.4685 5.4685 5.6191 5.6191 5.6831 5.6831 5.7303 5.7303 6.7354 6.7354 6.7941 6.7941 6.9527 6.9527 7.0800 7.0800 k = 0.5514 0.2727-0.0264 ( 8325 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5544 -38.5544 -37.5522 -37.5522 -37.5438 -37.5438 -37.5015 -37.5015 -37.5006 -37.5006 -10.1640 -10.1640 -9.6884 -9.6884 -9.4149 -9.4149 -9.3831 -9.3831 -9.3076 -9.3076 -9.2925 -9.2925 0.2548 0.2548 0.6556 0.6556 0.9693 0.9693 0.9967 0.9967 1.1780 1.1780 1.3291 1.3291 1.6956 1.6956 1.7954 1.7954 1.9349 1.9349 2.0365 2.0365 2.1866 2.1866 2.3697 2.3697 2.5046 2.5046 2.8842 2.8842 3.4564 3.4564 3.5307 3.5307 3.6772 3.6772 4.0606 4.0606 5.2630 5.2630 5.4054 5.4054 5.4583 5.4583 5.6233 5.6233 5.6771 5.6771 5.7254 5.7254 6.7422 6.7422 6.7955 6.7955 6.9583 6.9583 7.0846 7.0846 k = 0.5457 0.2698-0.0050 ( 8321 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5590 -38.5590 -38.5544 -38.5544 -37.5523 -37.5523 -37.5437 -37.5437 -37.5015 -37.5015 -37.5006 -37.5006 -10.1740 -10.1740 -9.6941 -9.6941 -9.4011 -9.4011 -9.3766 -9.3766 -9.3072 -9.3072 -9.2943 -9.2943 0.2699 0.2699 0.6716 0.6716 0.9720 0.9720 0.9970 0.9970 1.1707 1.1707 1.2943 1.2943 1.6807 1.6807 1.8099 1.8099 1.9300 1.9300 2.0305 2.0305 2.1922 2.1922 2.3468 2.3468 2.4720 2.4720 2.8620 2.8620 3.4657 3.4657 3.5417 3.5417 3.7248 3.7248 4.0943 4.0943 5.2680 5.2680 5.3928 5.3928 5.4464 5.4464 5.6247 5.6247 5.6702 5.6702 5.7237 5.7237 6.7480 6.7480 6.7958 6.7958 6.9664 6.9664 7.0899 7.0899 k = 0.5400 0.2670 0.0164 ( 8320 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5543 -38.5543 -37.5524 -37.5524 -37.5436 -37.5436 -37.5015 -37.5015 -37.5006 -37.5006 -10.1830 -10.1830 -9.6992 -9.6992 -9.3883 -9.3883 -9.3701 -9.3701 -9.3072 -9.3072 -9.2966 -9.2966 0.2847 0.2847 0.6896 0.6896 0.9732 0.9732 0.9954 0.9954 1.1650 1.1650 1.2623 1.2623 1.6528 1.6528 1.8346 1.8346 1.9266 1.9266 2.0293 2.0293 2.1969 2.1969 2.3246 2.3246 2.4404 2.4404 2.8410 2.8410 3.4732 3.4732 3.5490 3.5490 3.7715 3.7715 4.1288 4.1288 5.2730 5.2730 5.3804 5.3804 5.4332 5.4332 5.6218 5.6218 5.6653 5.6653 5.7241 5.7241 6.7527 6.7527 6.7951 6.7951 6.9760 6.9760 7.0959 7.0959 k = 0.5343 0.2642 0.0378 ( 8325 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5543 -38.5543 -37.5525 -37.5525 -37.5435 -37.5435 -37.5016 -37.5016 -37.5006 -37.5006 -10.1908 -10.1908 -9.7036 -9.7036 -9.3766 -9.3766 -9.3637 -9.3637 -9.3078 -9.3078 -9.2993 -9.2993 0.2988 0.2988 0.7088 0.7088 0.9724 0.9724 0.9920 0.9920 1.1611 1.1611 1.2344 1.2344 1.6212 1.6212 1.8590 1.8590 1.9282 1.9282 2.0309 2.0309 2.2002 2.2002 2.3035 2.3035 2.4100 2.4100 2.8216 2.8216 3.4795 3.4795 3.5544 3.5544 3.8140 3.8140 4.1630 4.1630 5.2783 5.2783 5.3688 5.3688 5.4189 5.4189 5.6146 5.6146 5.6638 5.6638 5.7253 5.7253 6.7565 6.7565 6.7938 6.7938 6.9857 6.9857 7.1027 7.1027 k = 0.5286 0.2614 0.0592 ( 8323 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5591 -38.5591 -38.5542 -38.5542 -37.5525 -37.5525 -37.5435 -37.5435 -37.5016 -37.5016 -37.5006 -37.5006 -10.1975 -10.1975 -9.7074 -9.7074 -9.3660 -9.3660 -9.3574 -9.3574 -9.3088 -9.3088 -9.3025 -9.3025 0.3122 0.3122 0.7287 0.7287 0.9693 0.9693 0.9871 0.9871 1.1586 1.1586 1.2116 1.2116 1.5899 1.5899 1.8762 1.8762 1.9393 1.9393 2.0340 2.0340 2.2012 2.2012 2.2845 2.2845 2.3814 2.3814 2.8044 2.8044 3.4847 3.4847 3.5587 3.5587 3.8508 3.8508 4.1959 4.1959 5.2839 5.2839 5.3582 5.3582 5.4037 5.4037 5.6055 5.6055 5.6644 5.6644 5.7270 5.7270 6.7595 6.7595 6.7922 6.7922 6.9946 6.9946 7.1101 7.1101 k = 0.5228 0.2585 0.0806 ( 8321 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5434 -37.5434 -37.5016 -37.5016 -37.5006 -37.5006 -10.2030 -10.2030 -9.7104 -9.7104 -9.3565 -9.3565 -9.3513 -9.3513 -9.3105 -9.3105 -9.3060 -9.3060 0.3242 0.3242 0.7481 0.7481 0.9639 0.9639 0.9812 0.9812 1.1571 1.1571 1.1945 1.1945 1.5612 1.5612 1.8842 1.8842 1.9600 1.9600 2.0381 2.0381 2.1990 2.1990 2.2687 2.2687 2.3554 2.3554 2.7897 2.7897 3.4889 3.4889 3.5622 3.5622 3.8812 3.8812 4.2260 4.2260 5.2902 5.2902 5.3489 5.3489 5.3879 5.3879 5.5965 5.5965 5.6657 5.6657 5.7286 5.7286 6.7616 6.7616 6.7908 6.7908 7.0019 7.0019 7.1177 7.1177 k = 0.5171 0.2557 0.1020 ( 8315 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2072 -10.2072 -9.7129 -9.7129 -9.3482 -9.3482 -9.3454 -9.3454 -9.3128 -9.3128 -9.3098 -9.3098 0.3344 0.3344 0.7660 0.7660 0.9569 0.9569 0.9751 0.9751 1.1556 1.1556 1.1833 1.1833 1.5370 1.5370 1.8873 1.8873 1.9837 1.9837 2.0431 2.0431 2.1925 2.1925 2.2573 2.2573 2.3332 2.3332 2.7780 2.7780 3.4921 3.4921 3.5649 3.5649 3.9048 3.9048 4.2517 4.2517 5.2974 5.2974 5.3413 5.3413 5.3722 5.3722 5.5887 5.5887 5.6671 5.6671 5.7301 5.7301 6.7629 6.7629 6.7897 6.7897 7.0075 7.0075 7.1248 7.1248 k = 0.5114 0.2529 0.1234 ( 8317 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5542 -38.5542 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5006 -37.5006 -10.2103 -10.2103 -9.7146 -9.7146 -9.3412 -9.3412 -9.3401 -9.3401 -9.3156 -9.3156 -9.3134 -9.3134 0.3422 0.3422 0.7809 0.7809 0.9497 0.9497 0.9697 0.9697 1.1539 1.1539 1.1775 1.1775 1.5184 1.5184 1.8887 1.8887 2.0040 2.0040 2.0498 2.0498 2.1825 2.1825 2.2502 2.2502 2.3161 2.3161 2.7695 2.7695 3.4944 3.4944 3.5670 3.5670 3.9215 3.9215 4.2715 4.2715 5.3057 5.3057 5.3355 5.3355 5.3573 5.3573 5.5829 5.5829 5.6682 5.6682 5.7312 5.7312 6.7637 6.7637 6.7890 6.7890 7.0113 7.0113 7.1306 7.1306 k = 0.5057 0.2501 0.1448 ( 8301 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2121 -10.2121 -9.7156 -9.7156 -9.3361 -9.3361 -9.3355 -9.3355 -9.3188 -9.3188 -9.3164 -9.3164 0.3472 0.3472 0.7910 0.7910 0.9443 0.9443 0.9658 0.9658 1.1523 1.1523 1.1753 1.1753 1.5068 1.5068 1.8893 1.8893 2.0165 2.0165 2.0577 2.0577 2.1725 2.1725 2.2466 2.2466 2.3054 2.3054 2.7643 2.7643 3.4957 3.4957 3.5682 3.5682 3.9316 3.9316 4.2839 4.2839 5.3152 5.3152 5.3311 5.3311 5.3442 5.3442 5.5793 5.5793 5.6689 5.6689 5.7319 5.7319 6.7641 6.7641 6.7886 6.7886 7.0135 7.0135 7.1343 7.1343 k = 0.5000 0.2472 0.1661 ( 8288 PWs) bands (ev): -66.5286 -66.5286 -66.5278 -66.5278 -38.5592 -38.5592 -38.5541 -38.5541 -37.5526 -37.5526 -37.5433 -37.5433 -37.5016 -37.5016 -37.5005 -37.5005 -10.2127 -10.2127 -9.7160 -9.7160 -9.3342 -9.3342 -9.3332 -9.3332 -9.3204 -9.3204 -9.3177 -9.3177 0.3489 0.3489 0.7946 0.7946 0.9422 0.9422 0.9645 0.9645 1.1517 1.1517 1.1747 1.1747 1.5028 1.5028 1.8895 1.8895 2.0203 2.0203 2.0617 2.0617 2.1680 2.1680 2.2454 2.2454 2.3018 2.3018 2.7625 2.7625 3.4962 3.4962 3.5686 3.5686 3.9349 3.9349 4.2882 4.2882 5.3247 5.3247 5.3253 5.3253 5.3380 5.3380 5.5781 5.5781 5.6692 5.6692 5.7322 5.7322 6.7642 6.7642 6.7885 6.7885 7.0142 7.0142 7.1356 7.1356 k = 0.5000-0.3820-0.2567 ( 8292 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9292 -9.9292 -9.8189 -9.8189 -9.4104 -9.4104 -9.3880 -9.3880 -9.3816 -9.3816 -9.3540 -9.3540 -0.0444 -0.0444 0.5493 0.5493 0.5974 0.5974 1.0836 1.0836 1.1490 1.1490 1.5775 1.5775 1.6372 1.6372 1.9424 1.9424 1.9935 1.9935 2.1080 2.1080 2.2661 2.2661 2.7208 2.7208 2.9683 2.9683 3.2175 3.2175 3.2388 3.2388 3.5358 3.5358 3.7099 3.7099 3.9658 3.9658 5.1688 5.1688 5.1794 5.1794 5.5498 5.5498 5.6168 5.6168 5.6472 5.6472 5.7867 5.7867 6.6984 6.6984 6.9531 6.9531 7.0371 7.0371 7.0612 7.0612 k = 0.5144-0.3690-0.2480 ( 8288 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9290 -9.9290 -9.8186 -9.8186 -9.4111 -9.4111 -9.3876 -9.3876 -9.3836 -9.3836 -9.3522 -9.3522 -0.0441 -0.0441 0.5503 0.5503 0.5983 0.5983 1.0827 1.0827 1.1506 1.1506 1.5744 1.5744 1.6378 1.6378 1.9429 1.9429 1.9926 1.9926 2.1108 2.1108 2.2661 2.2661 2.7207 2.7207 2.9670 2.9670 3.2149 3.2149 3.2400 3.2400 3.5353 3.5353 3.7095 3.7095 3.9648 3.9648 5.1672 5.1672 5.1818 5.1818 5.5488 5.5488 5.6170 5.6170 5.6479 5.6479 5.7869 5.7869 6.6987 6.6987 6.9520 6.9520 7.0367 7.0367 7.0617 7.0617 k = 0.5289-0.3560-0.2392 ( 8291 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5496 -37.5496 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9284 -9.9284 -9.8177 -9.8177 -9.4131 -9.4131 -9.3908 -9.3908 -9.3844 -9.3844 -9.3480 -9.3480 -0.0432 -0.0432 0.5533 0.5533 0.6011 0.6011 1.0800 1.0800 1.1554 1.1554 1.5657 1.5657 1.6388 1.6388 1.9442 1.9442 1.9906 1.9906 2.1187 2.1187 2.2659 2.2659 2.7202 2.7202 2.9633 2.9633 3.2084 3.2084 3.2425 3.2425 3.5338 3.5338 3.7082 3.7082 3.9619 3.9619 5.1644 5.1644 5.1868 5.1868 5.5459 5.5459 5.6176 5.6176 5.6498 5.6498 5.7877 5.7877 6.6996 6.6996 6.9484 6.9484 7.0356 7.0356 7.0632 7.0632 k = 0.5433-0.3429-0.2305 ( 8302 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5497 -37.5497 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9273 -9.9273 -9.8162 -9.8162 -9.4160 -9.4160 -9.3982 -9.3982 -9.3820 -9.3820 -9.3432 -9.3432 -0.0417 -0.0417 0.5583 0.5583 0.6058 0.6058 1.0759 1.0759 1.1629 1.1629 1.5532 1.5532 1.6391 1.6391 1.9457 1.9457 1.9886 1.9886 2.1306 2.1306 2.2657 2.2657 2.7193 2.7193 2.9574 2.9574 3.1996 3.1996 3.2446 3.2446 3.5313 3.5313 3.7060 3.7060 3.9571 3.9571 5.1618 5.1618 5.1932 5.1932 5.5415 5.5415 5.6181 5.6181 5.6529 5.6529 5.7889 5.7889 6.7009 6.7009 6.9425 6.9425 7.0344 7.0344 7.0651 7.0651 k = 0.5577-0.3299-0.2217 ( 8299 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5575 -38.5575 -38.5559 -38.5559 -37.5497 -37.5497 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9259 -9.9259 -9.8142 -9.8142 -9.4196 -9.4196 -9.4066 -9.4066 -9.3789 -9.3789 -9.3383 -9.3383 -0.0397 -0.0397 0.5652 0.5652 0.6123 0.6123 1.0709 1.0709 1.1725 1.1725 1.5381 1.5381 1.6381 1.6381 1.9461 1.9461 1.9880 1.9880 2.1456 2.1456 2.2660 2.2660 2.7175 2.7175 2.9498 2.9498 3.1892 3.1892 3.2454 3.2454 3.5278 3.5278 3.7030 3.7030 3.9507 3.9507 5.1597 5.1597 5.2004 5.2004 5.5363 5.5363 5.6186 5.6186 5.6568 5.6568 5.7906 5.7906 6.7029 6.7029 6.9344 6.9344 7.0332 7.0332 7.0673 7.0673 k = 0.5722-0.3169-0.2130 ( 8295 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5011 -37.5011 -37.5008 -37.5008 -9.9241 -9.9241 -9.8116 -9.8116 -9.4243 -9.4243 -9.4149 -9.4149 -9.3756 -9.3756 -9.3339 -9.3339 -0.0371 -0.0371 0.5737 0.5737 0.6206 0.6206 1.0652 1.0652 1.1838 1.1838 1.5216 1.5216 1.6352 1.6352 1.9447 1.9447 1.9897 1.9897 2.1621 2.1621 2.2673 2.2673 2.7147 2.7147 2.9409 2.9409 3.1774 3.1774 3.2447 3.2447 3.5234 3.5234 3.6991 3.6991 3.9429 3.9429 5.1582 5.1582 5.2082 5.2082 5.5306 5.5306 5.6186 5.6186 5.6611 5.6611 5.7928 5.7928 6.7054 6.7054 6.9243 6.9243 7.0322 7.0322 7.0696 7.0696 k = 0.5866-0.3039-0.2042 ( 8299 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5012 -37.5012 -37.5008 -37.5008 -9.9219 -9.9219 -9.8084 -9.8084 -9.4314 -9.4314 -9.4215 -9.4215 -9.3721 -9.3721 -9.3299 -9.3299 -0.0338 -0.0338 0.5838 0.5838 0.6306 0.6306 1.0590 1.0590 1.1964 1.1964 1.5048 1.5048 1.6306 1.6306 1.9416 1.9416 1.9936 1.9936 2.1787 2.1787 2.2706 2.2706 2.7101 2.7101 2.9315 2.9315 3.1646 3.1646 3.2421 3.2421 3.5182 3.5182 3.6944 3.6944 3.9339 3.9339 5.1572 5.1572 5.2166 5.2166 5.5248 5.5248 5.6184 5.6184 5.6655 5.6655 5.7954 5.7954 6.7085 6.7085 6.9125 6.9125 7.0312 7.0312 7.0717 7.0717 k = 0.6010-0.2909-0.1955 ( 8305 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5012 -37.5012 -37.5008 -37.5008 -9.9196 -9.9196 -9.8046 -9.8046 -9.4408 -9.4408 -9.4261 -9.4261 -9.3685 -9.3685 -9.3265 -9.3265 -0.0301 -0.0301 0.5951 0.5951 0.6424 0.6424 1.0525 1.0525 1.2097 1.2097 1.4886 1.4886 1.6242 1.6242 1.9374 1.9374 1.9990 1.9990 2.1934 2.1934 2.2774 2.2774 2.7035 2.7035 2.9223 2.9223 3.1507 3.1507 3.2373 3.2373 3.5124 3.5124 3.6888 3.6888 3.9241 3.9241 5.1568 5.1568 5.2255 5.2255 5.5191 5.5191 5.6179 5.6179 5.6697 5.6697 5.7985 5.7985 6.7119 6.7119 6.8994 6.8994 7.0301 7.0301 7.0738 7.0738 k = 0.6154-0.2779-0.1868 ( 8304 PWs) bands (ev): -66.5284 -66.5284 -66.5281 -66.5281 -38.5576 -38.5576 -38.5558 -38.5558 -37.5497 -37.5497 -37.5465 -37.5465 -37.5012 -37.5012 -37.5008 -37.5008 -9.9170 -9.9170 -9.8003 -9.8003 -9.4513 -9.4513 -9.4299 -9.4299 -9.3650 -9.3650 -9.3237 -9.3237 -0.0258 -0.0258 0.6073 0.6073 0.6559 0.6559 1.0458 1.0458 1.2229 1.2229 1.4741 1.4741 1.6163 1.6163 1.9326 1.9326 2.0051 2.0051 2.2044 2.2044 2.2889 2.2889 2.6942 2.6942 2.9140 2.9140 3.1360 3.1360 3.2303 3.2303 3.5060 3.5060 3.6824 3.6824 3.9139 3.9139 5.1569 5.1569 5.2346 5.2346 5.5138 5.5138 5.6171 5.6171 5.6735 5.6735 5.8020 5.8020 6.7158 6.7158 6.8852 6.8852 7.0289 7.0289 7.0757 7.0757 k = 0.6299-0.2649-0.1780 ( 8304 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5498 -37.5498 -37.5464 -37.5464 -37.5012 -37.5012 -37.5008 -37.5008 -9.9144 -9.9144 -9.7955 -9.7955 -9.4621 -9.4621 -9.4334 -9.4334 -9.3615 -9.3615 -9.3216 -9.3216 -0.0209 -0.0209 0.6200 0.6200 0.6711 0.6711 1.0390 1.0390 1.2350 1.2350 1.4624 1.4624 1.6071 1.6071 1.9279 1.9279 2.0114 2.0114 2.2112 2.2112 2.3054 2.3054 2.6821 2.6821 2.9073 2.9073 3.1206 3.1206 3.2208 3.2208 3.4993 3.4993 3.6752 3.6752 3.9036 3.9036 5.1574 5.1574 5.2441 5.2441 5.5088 5.5088 5.6162 5.6162 5.6766 5.6766 5.8058 5.8058 6.7200 6.7200 6.8705 6.8705 7.0273 7.0273 7.0776 7.0776 k = 0.6443-0.2519-0.1693 ( 8307 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5498 -37.5498 -37.5464 -37.5464 -37.5012 -37.5012 -37.5008 -37.5008 -9.9117 -9.9117 -9.7902 -9.7902 -9.4731 -9.4731 -9.4366 -9.4366 -9.3581 -9.3581 -9.3200 -9.3200 -0.0156 -0.0156 0.6325 0.6325 0.6881 0.6881 1.0324 1.0324 1.2447 1.2447 1.4549 1.4549 1.5970 1.5970 1.9233 1.9233 2.0176 2.0176 2.2149 2.2149 2.3252 2.3252 2.6671 2.6671 2.9023 2.9023 3.1046 3.1046 3.2089 3.2089 3.4924 3.4924 3.6672 3.6672 3.8937 3.8937 5.1584 5.1584 5.2536 5.2536 5.5044 5.5044 5.6151 5.6151 5.6790 5.6790 5.8098 5.8098 6.7244 6.7244 6.8558 6.8558 7.0252 7.0252 7.0793 7.0793 k = 0.6587-0.2388-0.1605 ( 8303 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5498 -37.5498 -37.5464 -37.5464 -37.5012 -37.5012 -37.5008 -37.5008 -9.9092 -9.9092 -9.7843 -9.7843 -9.4840 -9.4840 -9.4397 -9.4397 -9.3547 -9.3547 -9.3191 -9.3191 -0.0098 -0.0098 0.6445 0.6445 0.7068 0.7068 1.0259 1.0259 1.2506 1.2506 1.4529 1.4529 1.5864 1.5864 1.9191 1.9191 2.0234 2.0234 2.2165 2.2165 2.3465 2.3465 2.6497 2.6497 2.8993 2.8993 3.0883 3.0883 3.1944 3.1944 3.4857 3.4857 3.6584 3.6584 3.8843 3.8843 5.1597 5.1597 5.2632 5.2632 5.5006 5.5006 5.6138 5.6138 5.6808 5.6808 5.8138 5.8138 6.7285 6.7285 6.8415 6.8415 7.0228 7.0228 7.0808 7.0808 k = 0.6732-0.2258-0.1518 ( 8297 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5576 -38.5576 -38.5558 -38.5558 -37.5498 -37.5498 -37.5463 -37.5463 -37.5012 -37.5012 -37.5008 -37.5008 -9.9070 -9.9070 -9.7779 -9.7779 -9.4946 -9.4946 -9.4426 -9.4426 -9.3515 -9.3515 -9.3187 -9.3187 -0.0036 -0.0036 0.6553 0.6553 0.7270 0.7270 1.0199 1.0199 1.2521 1.2521 1.4565 1.4565 1.5760 1.5760 1.9154 1.9154 2.0288 2.0288 2.2172 2.2172 2.3676 2.3676 2.6306 2.6306 2.8978 2.8978 3.0718 3.0718 3.1776 3.1776 3.4792 3.4792 3.6490 3.6490 3.8758 3.8758 5.1612 5.1612 5.2728 5.2728 5.4974 5.4974 5.6123 5.6123 5.6819 5.6819 5.8179 5.8179 6.7321 6.7321 6.8284 6.8284 7.0199 7.0199 7.0820 7.0820 k = 0.6876-0.2128-0.1430 ( 8305 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5499 -37.5499 -37.5463 -37.5463 -37.5012 -37.5012 -37.5008 -37.5008 -9.9051 -9.9051 -9.7711 -9.7711 -9.5047 -9.5047 -9.4453 -9.4453 -9.3484 -9.3484 -9.3189 -9.3189 0.0030 0.0030 0.6647 0.6647 0.7486 0.7486 1.0143 1.0143 1.2495 1.2495 1.4645 1.4645 1.5671 1.5671 1.9124 1.9124 2.0336 2.0336 2.2173 2.2173 2.3872 2.3872 2.6107 2.6107 2.8978 2.8978 3.0553 3.0553 3.1588 3.1588 3.4731 3.4731 3.6390 3.6390 3.8684 3.8684 5.1631 5.1631 5.2822 5.2822 5.4948 5.4948 5.6107 5.6107 5.6822 5.6822 5.8217 5.8217 6.7344 6.7344 6.8172 6.8172 7.0166 7.0166 7.0829 7.0829 k = 0.7020-0.1998-0.1343 ( 8310 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5499 -37.5499 -37.5463 -37.5463 -37.5012 -37.5012 -37.5008 -37.5008 -9.9038 -9.9038 -9.7637 -9.7637 -9.5143 -9.5143 -9.4478 -9.4478 -9.3454 -9.3454 -9.3196 -9.3196 0.0098 0.0098 0.6721 0.6721 0.7712 0.7712 1.0093 1.0093 1.2440 1.2440 1.4734 1.4734 1.5624 1.5624 1.9101 1.9101 2.0378 2.0378 2.2171 2.2171 2.4036 2.4036 2.5915 2.5915 2.8986 2.8986 3.0389 3.0389 3.1385 3.1385 3.4676 3.4676 3.6287 3.6287 3.8622 3.8622 5.1651 5.1651 5.2916 5.2916 5.4927 5.4927 5.6090 5.6090 5.6820 5.6820 5.8253 5.8253 6.7346 6.7346 6.8091 6.8091 7.0130 7.0130 7.0835 7.0835 k = 0.7165-0.1868-0.1255 ( 8308 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5499 -37.5499 -37.5463 -37.5463 -37.5012 -37.5012 -37.5008 -37.5008 -9.9033 -9.9033 -9.7559 -9.7559 -9.5230 -9.5230 -9.4501 -9.4501 -9.3426 -9.3426 -9.3208 -9.3208 0.0169 0.0169 0.6772 0.6772 0.7946 0.7946 1.0046 1.0046 1.2369 1.2369 1.4781 1.4781 1.5657 1.5657 1.9088 1.9088 2.0415 2.0415 2.2167 2.2167 2.4148 2.4148 2.5749 2.5749 2.8998 2.8998 3.0230 3.0230 3.1173 3.1173 3.4628 3.4628 3.6182 3.6182 3.8574 3.8574 5.1673 5.1673 5.3006 5.3006 5.4913 5.4913 5.6071 5.6071 5.6812 5.6812 5.8285 5.8285 6.7321 6.7321 6.8047 6.8047 7.0092 7.0092 7.0836 7.0836 k = 0.7309-0.1738-0.1168 ( 8310 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5500 -37.5500 -37.5462 -37.5462 -37.5012 -37.5012 -37.5008 -37.5008 -9.9036 -9.9036 -9.7477 -9.7477 -9.5307 -9.5307 -9.4523 -9.4523 -9.3400 -9.3400 -9.3224 -9.3224 0.0241 0.0241 0.6800 0.6800 0.8183 0.8183 1.0000 1.0000 1.2297 1.2297 1.4759 1.4759 1.5790 1.5790 1.9085 1.9085 2.0447 2.0447 2.2162 2.2162 2.4189 2.4189 2.5629 2.5629 2.9007 2.9007 3.0077 3.0077 3.0962 3.0962 3.4587 3.4587 3.6079 3.6079 3.8539 3.8539 5.1696 5.1696 5.3095 5.3095 5.4904 5.4904 5.6051 5.6051 5.6799 5.6799 5.8313 5.8313 6.7271 6.7271 6.8040 6.8040 7.0052 7.0052 7.0832 7.0832 k = 0.7453-0.1608-0.1080 ( 8310 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5500 -37.5500 -37.5462 -37.5462 -37.5012 -37.5012 -37.5008 -37.5008 -9.9051 -9.9051 -9.7390 -9.7390 -9.5373 -9.5373 -9.4542 -9.4542 -9.3376 -9.3376 -9.3244 -9.3244 0.0314 0.0314 0.6803 0.6803 0.8418 0.8418 0.9952 0.9952 1.2230 1.2230 1.4685 1.4685 1.5996 1.5996 1.9093 1.9093 2.0476 2.0476 2.2154 2.2154 2.4146 2.4146 2.5568 2.5568 2.9005 2.9005 2.9933 2.9933 3.0762 3.0762 3.4554 3.4554 3.5981 3.5981 3.8516 3.8516 5.1720 5.1720 5.3180 5.3180 5.4900 5.4900 5.6029 5.6029 5.6782 5.6782 5.8335 5.8335 6.7205 6.7205 6.8062 6.8062 7.0011 7.0011 7.0823 7.0823 k = 0.7597-0.1478-0.0993 ( 8311 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5577 -38.5577 -38.5557 -38.5557 -37.5500 -37.5500 -37.5462 -37.5462 -37.5012 -37.5012 -37.5008 -37.5008 -9.9077 -9.9077 -9.7298 -9.7298 -9.5426 -9.5426 -9.4559 -9.4559 -9.3356 -9.3356 -9.3265 -9.3265 0.0386 0.0386 0.6781 0.6781 0.8645 0.8645 0.9900 0.9900 1.2175 1.2175 1.4591 1.4591 1.6241 1.6241 1.9113 1.9113 2.0503 2.0503 2.2141 2.2141 2.4033 2.4033 2.5556 2.5556 2.8980 2.8980 2.9803 2.9803 3.0584 3.0584 3.4531 3.4531 3.5891 3.5891 3.8507 3.8507 5.1746 5.1746 5.3261 5.3261 5.4902 5.4902 5.6005 5.6005 5.6761 5.6761 5.8351 5.8351 6.7135 6.7135 6.8102 6.8102 6.9971 6.9971 7.0808 7.0808 k = 0.7742-0.1348-0.0906 ( 8317 PWs) bands (ev): -66.5284 -66.5284 -66.5280 -66.5280 -38.5578 -38.5578 -38.5556 -38.5556 -37.5501 -37.5501 -37.5461 -37.5461 -37.5012 -37.5012 -37.5008 -37.5008 -9.9117 -9.9117 -9.7203 -9.7203 -9.5465 -9.5465 -9.4574 -9.4574 -9.3345 -9.3345 -9.3282 -9.3282 0.0457 0.0457 0.6737 0.6737 0.8854 0.8854 0.9845 0.9845 1.2129 1.2129 1.4499 1.4499 1.6503 1.6503 1.9146 1.9146 2.0531 2.0531 2.2122 2.2122 2.3875 2.3875 2.5569 2.5569 2.8920 2.8920 2.9691 2.9691 3.0442 3.0442 3.4519 3.4519 3.5812 3.5812 3.8509 3.8509 5.1771 5.1771 5.3339 5.3339 5.4907 5.4907 5.5980 5.5980 5.6736 5.6736 5.8360 5.8360 6.7069 6.7069 6.8151 6.8151 6.9932 6.9932 7.0788 7.0788 Writing output data file CrBr3.save init_run : 1.11s CPU 1.59s WALL ( 1 calls) electrons : 504.93s CPU 530.00s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.19s WALL ( 1 calls) potinit : 0.09s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 504.93s CPU 529.99s WALL ( 1 calls) v_of_rho : 0.03s CPU 0.04s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.03s CPU 0.03s WALL ( 1 calls) newd : 0.31s CPU 0.32s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.07s WALL ( 222 calls) cegterg : 474.92s CPU 498.12s WALL ( 222 calls) Called by sum_band: Called by *egterg: h_psi : 321.05s CPU 346.61s WALL ( 4275 calls) s_psi : 15.63s CPU 15.58s WALL ( 4275 calls) g_psi : 1.10s CPU 1.09s WALL ( 3831 calls) cdiaghg : 97.89s CPU 96.38s WALL ( 4053 calls) cegterg:over : 28.22s CPU 27.14s WALL ( 3831 calls) cegterg:upda : 11.21s CPU 12.36s WALL ( 3831 calls) cegterg:last : 10.67s CPU 11.12s WALL ( 1110 calls) Called by h_psi: h_psi:vloc : 298.55s CPU 323.54s WALL ( 4275 calls) h_psi:vnl : 22.31s CPU 22.60s WALL ( 4275 calls) add_vuspsi : 9.51s CPU 10.96s WALL ( 4275 calls) General routines calbec : 12.79s CPU 11.63s WALL ( 4275 calls) fft : 0.07s CPU 0.07s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 279.07s CPU 299.73s WALL ( 1174700 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.04s CPU 0.64s WALL ( 444 calls) Parallel routines fft_scatter : 138.71s CPU 143.28s WALL ( 1174723 calls) PWSCF : 8m57.64s CPU 9m47.21s WALL This run was terminated on: 20:28:18 27Jul2015 =------------------------------------------------------------------------------= JOB DONE. 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