Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 15:52:29 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./ScBO3.save/ file Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 3P 3P renormalized file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 79 40 11 2533 905 139 Max 80 41 12 2536 923 142 Sum 2859 1449 415 91225 32971 5045 bravais-lattice index = 14 lattice parameter (alat) = 10.9205 a.u. unit-cell volume = 670.2530 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 51.0000 Ry charge density cutoff = 402.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.920501 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.662477 celldm(5)= 0.662477 celldm(6)= 0.662477 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.662477 0.749083 0.000000 ) a(3) = ( 0.662477 0.298500 0.687039 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.884384 -0.580008 ) b(2) = ( 0.000000 1.334966 -0.580008 ) b(3) = ( 0.000000 0.000000 1.455522 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sc read from file: /users/gautes/Pseudo/Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: e27f768e72ba10e20459589e24f2b6a7 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1173 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. # 3 for B read from file: /users/gautes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 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 O 6.00 15.99940 O( 1.00) Sc 11.00 44.95590 Sc( 1.00) B 3.00 10.81100 B( 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 and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 281 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 2) = ( 0.0125000 -0.0110548 -0.0072501), wk = 0.0035587 k( 3) = ( 0.0250000 -0.0221096 -0.0145002), wk = 0.0035587 k( 4) = ( 0.0375000 -0.0331644 -0.0217503), wk = 0.0035587 k( 5) = ( 0.0500000 -0.0442192 -0.0290004), wk = 0.0035587 k( 6) = ( 0.0625000 -0.0552740 -0.0362505), wk = 0.0035587 k( 7) = ( 0.0750000 -0.0663288 -0.0435006), wk = 0.0035587 k( 8) = ( 0.0875000 -0.0773836 -0.0507507), wk = 0.0035587 k( 9) = ( 0.1000000 -0.0884384 -0.0580008), wk = 0.0035587 k( 10) = ( 0.1125000 -0.0994932 -0.0652509), wk = 0.0035587 k( 11) = ( 0.1250000 -0.1105480 -0.0725009), wk = 0.0035587 k( 12) = ( 0.1375000 -0.1216028 -0.0797510), wk = 0.0035587 k( 13) = ( 0.1500000 -0.1326576 -0.0870011), wk = 0.0035587 k( 14) = ( 0.1625000 -0.1437124 -0.0942512), wk = 0.0035587 k( 15) = ( 0.1750000 -0.1547672 -0.1015013), wk = 0.0035587 k( 16) = ( 0.1875000 -0.1658220 -0.1087514), wk = 0.0035587 k( 17) = ( 0.2000000 -0.1768767 -0.1160015), wk = 0.0035587 k( 18) = ( 0.2125000 -0.1879315 -0.1232516), wk = 0.0035587 k( 19) = ( 0.2250000 -0.1989863 -0.1305017), wk = 0.0035587 k( 20) = ( 0.2375000 -0.2100411 -0.1377518), wk = 0.0035587 k( 21) = ( 0.2500000 -0.2210959 -0.1450019), wk = 0.0035587 k( 22) = ( 0.2625000 -0.2321507 -0.1522520), wk = 0.0035587 k( 23) = ( 0.2750000 -0.2432055 -0.1595021), wk = 0.0035587 k( 24) = ( 0.2875000 -0.2542603 -0.1667522), wk = 0.0035587 k( 25) = ( 0.3000000 -0.2653151 -0.1740023), wk = 0.0035587 k( 26) = ( 0.3125000 -0.2763699 -0.1812524), wk = 0.0035587 k( 27) = ( 0.3250000 -0.2874247 -0.1885025), wk = 0.0035587 k( 28) = ( 0.3375000 -0.2984795 -0.1957526), wk = 0.0035587 k( 29) = ( 0.3500000 -0.3095343 -0.2030026), wk = 0.0035587 k( 30) = ( 0.3625000 -0.3205891 -0.2102527), wk = 0.0035587 k( 31) = ( 0.3750000 -0.3316439 -0.2175028), wk = 0.0035587 k( 32) = ( 0.3875000 -0.3426987 -0.2247529), wk = 0.0035587 k( 33) = ( 0.4000000 -0.3537535 -0.2320030), wk = 0.0035587 k( 34) = ( 0.4125000 -0.3648083 -0.2392531), wk = 0.0035587 k( 35) = ( 0.4250000 -0.3758631 -0.2465032), wk = 0.0035587 k( 36) = ( 0.4375000 -0.3869179 -0.2537533), wk = 0.0035587 k( 37) = ( 0.4500000 -0.3979727 -0.2610034), wk = 0.0035587 k( 38) = ( 0.4625000 -0.4090275 -0.2682535), wk = 0.0035587 k( 39) = ( 0.4750000 -0.4200823 -0.2755036), wk = 0.0035587 k( 40) = ( 0.4875000 -0.4311371 -0.2827537), wk = 0.0035587 k( 41) = ( 0.5000000 -0.4421919 -0.2900038), wk = 0.0035587 k( 42) = ( 0.5000000 -0.4421919 -0.2900038), wk = 0.0035587 k( 43) = ( 0.5000000 -0.4322920 -0.3050989), wk = 0.0035587 k( 44) = ( 0.5000000 -0.4223922 -0.3201939), wk = 0.0035587 k( 45) = ( 0.5000000 -0.4124924 -0.3352890), wk = 0.0035587 k( 46) = ( 0.5000000 -0.4025925 -0.3503841), wk = 0.0035587 k( 47) = ( 0.5000000 -0.3926927 -0.3654791), wk = 0.0035587 k( 48) = ( 0.5000000 -0.3827928 -0.3805742), wk = 0.0035587 k( 49) = ( 0.5000000 -0.3728930 -0.3956693), wk = 0.0035587 k( 50) = ( 0.5000000 -0.3629932 -0.4107643), wk = 0.0035587 k( 51) = ( 0.5000000 -0.3530933 -0.4258594), wk = 0.0035587 k( 52) = ( 0.5000000 -0.3431935 -0.4409545), wk = 0.0035587 k( 53) = ( 0.5000000 -0.3332937 -0.4560496), wk = 0.0035587 k( 54) = ( 0.5000000 -0.3233938 -0.4711446), wk = 0.0035587 k( 55) = ( 0.5000000 -0.3134940 -0.4862397), wk = 0.0035587 k( 56) = ( 0.5000000 -0.3035942 -0.5013348), wk = 0.0035587 k( 57) = ( 0.5000000 -0.2936943 -0.5164298), wk = 0.0035587 k( 58) = ( 0.5000000 -0.2837945 -0.5315249), wk = 0.0035587 k( 59) = ( 0.5000000 -0.2738946 -0.5466200), wk = 0.0035587 k( 60) = ( 0.5000000 -0.2639948 -0.5617151), wk = 0.0035587 k( 61) = ( 0.5000000 -0.2540950 -0.5768101), wk = 0.0035587 k( 62) = ( 0.5000000 -0.2441951 -0.5919052), wk = 0.0035587 k( 63) = ( 0.5000000 -0.2342953 -0.6070003), wk = 0.0035587 k( 64) = ( 0.5000000 -0.2243954 -0.6220954), wk = 0.0035587 k( 65) = ( 0.5000000 -0.2144956 -0.6371904), wk = 0.0035587 k( 66) = ( 0.5000000 -0.2045958 -0.6522855), wk = 0.0035587 k( 67) = ( 0.5000000 -0.1946959 -0.6673806), wk = 0.0035587 k( 68) = ( 0.5000000 -0.1847961 -0.6824756), wk = 0.0035587 k( 69) = ( 0.5000000 -0.1748963 -0.6975707), wk = 0.0035587 k( 70) = ( 0.5000000 -0.1649964 -0.7126658), wk = 0.0035587 k( 71) = ( 0.5000000 -0.1550966 -0.7277608), wk = 0.0035587 k( 72) = ( 0.7849419 -0.0267068 -0.4322543), wk = 0.0035587 k( 73) = ( 0.7774434 -0.0200753 -0.4169909), wk = 0.0035587 k( 74) = ( 0.7699449 -0.0134437 -0.4017276), wk = 0.0035587 k( 75) = ( 0.7624465 -0.0068122 -0.3864642), wk = 0.0035587 k( 76) = ( 0.7549480 -0.0001807 -0.3712009), wk = 0.0035587 k( 77) = ( 0.7474495 0.0064508 -0.3559375), wk = 0.0035587 k( 78) = ( 0.7399511 0.0130824 -0.3406741), wk = 0.0035587 k( 79) = ( 0.7324526 0.0197139 -0.3254108), wk = 0.0035587 k( 80) = ( 0.7249541 0.0263454 -0.3101474), wk = 0.0035587 k( 81) = ( 0.7174557 0.0329769 -0.2948841), wk = 0.0035587 k( 82) = ( 0.7099572 0.0396085 -0.2796207), wk = 0.0035587 k( 83) = ( 0.7024587 0.0462400 -0.2643574), wk = 0.0035587 k( 84) = ( 0.6949602 0.0528715 -0.2490940), wk = 0.0035587 k( 85) = ( 0.6874618 0.0595031 -0.2338306), wk = 0.0035587 k( 86) = ( 0.6799633 0.0661346 -0.2185673), wk = 0.0035587 k( 87) = ( 0.6724648 0.0727661 -0.2033039), wk = 0.0035587 k( 88) = ( 0.6649664 0.0793976 -0.1880406), wk = 0.0035587 k( 89) = ( 0.6574679 0.0860292 -0.1727772), wk = 0.0035587 k( 90) = ( 0.6499694 0.0926607 -0.1575139), wk = 0.0035587 k( 91) = ( 0.6424709 0.0992922 -0.1422505), wk = 0.0035587 k( 92) = ( 0.6349725 0.1059237 -0.1269872), wk = 0.0035587 k( 93) = ( 0.6274740 0.1125553 -0.1117238), wk = 0.0035587 k( 94) = ( 0.6199755 0.1191868 -0.0964604), wk = 0.0035587 k( 95) = ( 0.6124771 0.1258183 -0.0811971), wk = 0.0035587 k( 96) = ( 0.6049786 0.1324498 -0.0659337), wk = 0.0035587 k( 97) = ( 0.5974801 0.1390814 -0.0506704), wk = 0.0035587 k( 98) = ( 0.5899817 0.1457129 -0.0354070), wk = 0.0035587 k( 99) = ( 0.5824832 0.1523444 -0.0201436), wk = 0.0035587 k( 100) = ( 0.5749847 0.1589759 -0.0048803), wk = 0.0035587 k( 101) = ( 0.5674862 0.1656075 0.0103831), wk = 0.0035587 k( 102) = ( 0.5599878 0.1722390 0.0256464), wk = 0.0035587 k( 103) = ( 0.5524893 0.1788705 0.0409098), wk = 0.0035587 k( 104) = ( 0.5449908 0.1855020 0.0561731), wk = 0.0035587 k( 105) = ( 0.5374923 0.1921336 0.0714365), wk = 0.0035587 k( 106) = ( 0.5299939 0.1987651 0.0866999), wk = 0.0035587 k( 107) = ( 0.5224954 0.2053966 0.1019632), wk = 0.0035587 k( 108) = ( 0.5149969 0.2120282 0.1172266), wk = 0.0035587 k( 109) = ( 0.5074985 0.2186597 0.1324899), wk = 0.0035587 k( 110) = ( 0.5000000 0.2252912 0.1477533), wk = 0.0035587 k( 111) = ( 0.5000000 0.2252912 0.1477533), wk = 0.0035587 k( 112) = ( 0.4838710 0.2180237 0.1429870), wk = 0.0035587 k( 113) = ( 0.4677419 0.2107563 0.1382208), wk = 0.0035587 k( 114) = ( 0.4516129 0.2034888 0.1334546), wk = 0.0035587 k( 115) = ( 0.4354839 0.1962214 0.1286883), wk = 0.0035587 k( 116) = ( 0.4193548 0.1889539 0.1239221), wk = 0.0035587 k( 117) = ( 0.4032258 0.1816865 0.1191559), wk = 0.0035587 k( 118) = ( 0.3870968 0.1744190 0.1143896), wk = 0.0035587 k( 119) = ( 0.3709677 0.1671515 0.1096234), wk = 0.0035587 k( 120) = ( 0.3548387 0.1598841 0.1048572), wk = 0.0035587 k( 121) = ( 0.3387097 0.1526166 0.1000909), wk = 0.0035587 k( 122) = ( 0.3225807 0.1453492 0.0953247), wk = 0.0035587 k( 123) = ( 0.3064516 0.1380817 0.0905585), wk = 0.0035587 k( 124) = ( 0.2903226 0.1308142 0.0857922), wk = 0.0035587 k( 125) = ( 0.2741936 0.1235468 0.0810260), wk = 0.0035587 k( 126) = ( 0.2580645 0.1162793 0.0762598), wk = 0.0035587 k( 127) = ( 0.2419355 0.1090119 0.0714935), wk = 0.0035587 k( 128) = ( 0.2258064 0.1017444 0.0667273), wk = 0.0035587 k( 129) = ( 0.2096774 0.0944770 0.0619611), wk = 0.0035587 k( 130) = ( 0.1935484 0.0872095 0.0571948), wk = 0.0035587 k( 131) = ( 0.1774194 0.0799420 0.0524286), wk = 0.0035587 k( 132) = ( 0.1612903 0.0726746 0.0476623), wk = 0.0035587 k( 133) = ( 0.1451613 0.0654071 0.0428961), wk = 0.0035587 k( 134) = ( 0.1290323 0.0581397 0.0381299), wk = 0.0035587 k( 135) = ( 0.1129032 0.0508722 0.0333636), wk = 0.0035587 k( 136) = ( 0.0967742 0.0436047 0.0285974), wk = 0.0035587 k( 137) = ( 0.0806452 0.0363373 0.0238312), wk = 0.0035587 k( 138) = ( 0.0645161 0.0290698 0.0190649), wk = 0.0035587 k( 139) = ( 0.0483871 0.0218024 0.0142987), wk = 0.0035587 k( 140) = ( 0.0322581 0.0145349 0.0095325), wk = 0.0035587 k( 141) = ( 0.0161290 0.0072675 0.0047662), wk = 0.0035587 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 144) = ( 0.0074485 -0.0065874 -0.0151617), wk = 0.0035587 k( 145) = ( 0.0148970 -0.0131747 -0.0303234), wk = 0.0035587 k( 146) = ( 0.0223456 -0.0197621 -0.0454851), wk = 0.0035587 k( 147) = ( 0.0297941 -0.0263494 -0.0606467), wk = 0.0035587 k( 148) = ( 0.0372426 -0.0329368 -0.0758084), wk = 0.0035587 k( 149) = ( 0.0446911 -0.0395241 -0.0909701), wk = 0.0035587 k( 150) = ( 0.0521397 -0.0461115 -0.1061318), wk = 0.0035587 k( 151) = ( 0.0595882 -0.0526988 -0.1212935), wk = 0.0035587 k( 152) = ( 0.0670367 -0.0592862 -0.1364552), wk = 0.0035587 k( 153) = ( 0.0744852 -0.0658735 -0.1516168), wk = 0.0035587 k( 154) = ( 0.0819337 -0.0724609 -0.1667785), wk = 0.0035587 k( 155) = ( 0.0893823 -0.0790482 -0.1819402), wk = 0.0035587 k( 156) = ( 0.0968308 -0.0856356 -0.1971019), wk = 0.0035587 k( 157) = ( 0.1042793 -0.0922229 -0.2122636), wk = 0.0035587 k( 158) = ( 0.1117278 -0.0988103 -0.2274253), wk = 0.0035587 k( 159) = ( 0.1191764 -0.1053976 -0.2425869), wk = 0.0035587 k( 160) = ( 0.1266249 -0.1119850 -0.2577486), wk = 0.0035587 k( 161) = ( 0.1340734 -0.1185723 -0.2729103), wk = 0.0035587 k( 162) = ( 0.1415219 -0.1251597 -0.2880720), wk = 0.0035587 k( 163) = ( 0.1489704 -0.1317470 -0.3032337), wk = 0.0035587 k( 164) = ( 0.1564190 -0.1383344 -0.3183954), wk = 0.0035587 k( 165) = ( 0.1638675 -0.1449217 -0.3335570), wk = 0.0035587 k( 166) = ( 0.1713160 -0.1515091 -0.3487187), wk = 0.0035587 k( 167) = ( 0.1787645 -0.1580964 -0.3638804), wk = 0.0035587 k( 168) = ( 0.1862130 -0.1646838 -0.3790421), wk = 0.0035587 k( 169) = ( 0.1936616 -0.1712711 -0.3942038), wk = 0.0035587 k( 170) = ( 0.2011101 -0.1778585 -0.4093655), wk = 0.0035587 k( 171) = ( 0.2085586 -0.1844458 -0.4245272), wk = 0.0035587 k( 172) = ( 0.2160071 -0.1910332 -0.4396889), wk = 0.0035587 k( 173) = ( 0.2234557 -0.1976206 -0.4548505), wk = 0.0035587 k( 174) = ( 0.2309042 -0.2042079 -0.4700122), wk = 0.0035587 k( 175) = ( 0.2383527 -0.2107953 -0.4851739), wk = 0.0035587 k( 176) = ( 0.2458012 -0.2173826 -0.5003356), wk = 0.0035587 k( 177) = ( 0.2532497 -0.2239700 -0.5154973), wk = 0.0035587 k( 178) = ( 0.2606983 -0.2305573 -0.5306590), wk = 0.0035587 k( 179) = ( 0.2681468 -0.2371447 -0.5458206), wk = 0.0035587 k( 180) = ( 0.2755953 -0.2437320 -0.5609823), wk = 0.0035587 k( 181) = ( 0.2830438 -0.2503194 -0.5761440), wk = 0.0035587 k( 182) = ( 0.2904924 -0.2569067 -0.5913057), wk = 0.0035587 k( 183) = ( 0.2979409 -0.2634941 -0.6064674), wk = 0.0035587 k( 184) = ( 0.3053894 -0.2700814 -0.6216291), wk = 0.0035587 k( 185) = ( 0.3128379 -0.2766688 -0.6367907), wk = 0.0035587 k( 186) = ( 0.3202864 -0.2832561 -0.6519524), wk = 0.0035587 k( 187) = ( 0.3277350 -0.2898435 -0.6671141), wk = 0.0035587 k( 188) = ( 0.3351835 -0.2964308 -0.6822758), wk = 0.0035587 k( 189) = ( 0.3426320 -0.3030182 -0.6974375), wk = 0.0035587 k( 190) = ( 0.3500805 -0.3096055 -0.7125992), wk = 0.0035587 k( 191) = ( 0.3575291 -0.3161929 -0.7277608), wk = 0.0035587 k( 192) = ( 0.6424709 -0.0909017 -0.5800076), wk = 0.0035587 k( 193) = ( 0.6349725 -0.0742600 -0.5800076), wk = 0.0035587 k( 194) = ( 0.6274740 -0.0576182 -0.5800076), wk = 0.0035587 k( 195) = ( 0.6199755 -0.0409765 -0.5800076), wk = 0.0035587 k( 196) = ( 0.6124771 -0.0243348 -0.5800076), wk = 0.0035587 k( 197) = ( 0.6049786 -0.0076930 -0.5800076), wk = 0.0035587 k( 198) = ( 0.5974801 0.0089487 -0.5800076), wk = 0.0035587 k( 199) = ( 0.5899817 0.0255904 -0.5800076), wk = 0.0035587 k( 200) = ( 0.5824832 0.0422322 -0.5800076), wk = 0.0035587 k( 201) = ( 0.5749847 0.0588739 -0.5800076), wk = 0.0035587 k( 202) = ( 0.5674862 0.0755156 -0.5800076), wk = 0.0035587 k( 203) = ( 0.5599878 0.0921573 -0.5800076), wk = 0.0035587 k( 204) = ( 0.5524893 0.1087991 -0.5800076), wk = 0.0035587 k( 205) = ( 0.5449908 0.1254408 -0.5800076), wk = 0.0035587 k( 206) = ( 0.5374923 0.1420826 -0.5800076), wk = 0.0035587 k( 207) = ( 0.5299939 0.1587243 -0.5800076), wk = 0.0035587 k( 208) = ( 0.5224954 0.1753660 -0.5800076), wk = 0.0035587 k( 209) = ( 0.5149969 0.1920077 -0.5800076), wk = 0.0035587 k( 210) = ( 0.5074985 0.2086495 -0.5800076), wk = 0.0035587 k( 211) = ( 0.5000000 0.2252912 -0.5800076), wk = 0.0035587 k( 212) = ( 0.5000000 0.2252912 -0.5800076), wk = 0.0035587 k( 213) = ( 0.5118726 0.2306408 -0.5676948), wk = 0.0035587 k( 214) = ( 0.5237452 0.2359904 -0.5553820), wk = 0.0035587 k( 215) = ( 0.5356177 0.2413399 -0.5430692), wk = 0.0035587 k( 216) = ( 0.5474903 0.2466895 -0.5307565), wk = 0.0035587 k( 217) = ( 0.5593629 0.2520391 -0.5184437), wk = 0.0035587 k( 218) = ( 0.5712355 0.2573886 -0.5061309), wk = 0.0035587 k( 219) = ( 0.5831080 0.2627382 -0.4938181), wk = 0.0035587 k( 220) = ( 0.5949806 0.2680878 -0.4815054), wk = 0.0035587 k( 221) = ( 0.6068532 0.2734374 -0.4691926), wk = 0.0035587 k( 222) = ( 0.6187258 0.2787870 -0.4568798), wk = 0.0035587 k( 223) = ( 0.6305984 0.2841365 -0.4445671), wk = 0.0035587 k( 224) = ( 0.6424709 0.2894861 -0.4322543), wk = 0.0035587 k( 225) = ( 0.6424709 0.2894861 -0.4322543), wk = 0.0035587 k( 226) = ( 0.6381537 0.2875408 -0.4146783), wk = 0.0035587 k( 227) = ( 0.6338363 0.2855955 -0.3971023), wk = 0.0035587 k( 228) = ( 0.6295190 0.2836502 -0.3795263), wk = 0.0035587 k( 229) = ( 0.6252017 0.2817049 -0.3619503), wk = 0.0035587 k( 230) = ( 0.6208844 0.2797596 -0.3443743), wk = 0.0035587 k( 231) = ( 0.6165671 0.2778143 -0.3267984), wk = 0.0035587 k( 232) = ( 0.6122498 0.2758690 -0.3092224), wk = 0.0035587 k( 233) = ( 0.6079325 0.2739237 -0.2916464), wk = 0.0035587 k( 234) = ( 0.6036152 0.2719784 -0.2740704), wk = 0.0035587 k( 235) = ( 0.5992979 0.2700331 -0.2564944), wk = 0.0035587 k( 236) = ( 0.5949806 0.2680878 -0.2389184), wk = 0.0035587 k( 237) = ( 0.5906633 0.2661425 -0.2213424), wk = 0.0035587 k( 238) = ( 0.5863460 0.2641972 -0.2037665), wk = 0.0035587 k( 239) = ( 0.5820287 0.2622519 -0.1861905), wk = 0.0035587 k( 240) = ( 0.5777114 0.2603066 -0.1686145), wk = 0.0035587 k( 241) = ( 0.5733941 0.2583613 -0.1510385), wk = 0.0035587 k( 242) = ( 0.5690768 0.2564160 -0.1334625), wk = 0.0035587 k( 243) = ( 0.5647595 0.2544707 -0.1158865), wk = 0.0035587 k( 244) = ( 0.5604422 0.2525254 -0.0983105), wk = 0.0035587 k( 245) = ( 0.5561249 0.2505801 -0.0807346), wk = 0.0035587 k( 246) = ( 0.5518076 0.2486348 -0.0631586), wk = 0.0035587 k( 247) = ( 0.5474903 0.2466895 -0.0455826), wk = 0.0035587 k( 248) = ( 0.5431730 0.2447442 -0.0280066), wk = 0.0035587 k( 249) = ( 0.5388557 0.2427989 -0.0104306), wk = 0.0035587 k( 250) = ( 0.5345384 0.2408536 0.0071454), wk = 0.0035587 k( 251) = ( 0.5302211 0.2389083 0.0247214), wk = 0.0035587 k( 252) = ( 0.5259038 0.2369630 0.0422974), wk = 0.0035587 k( 253) = ( 0.5215865 0.2350177 0.0598734), wk = 0.0035587 k( 254) = ( 0.5172692 0.2330724 0.0774493), wk = 0.0035587 k( 255) = ( 0.5129519 0.2311271 0.0950253), wk = 0.0035587 k( 256) = ( 0.5086346 0.2291818 0.1126013), wk = 0.0035587 k( 257) = ( 0.5043173 0.2272365 0.1301773), wk = 0.0035587 k( 258) = ( 0.5000000 0.2252912 0.1477533), wk = 0.0035587 k( 259) = ( 0.5000000 -0.4421919 -0.2900038), wk = 0.0035587 k( 260) = ( 0.5129519 -0.4319514 -0.2832877), wk = 0.0035587 k( 261) = ( 0.5259038 -0.4217109 -0.2765717), wk = 0.0035587 k( 262) = ( 0.5388557 -0.4114703 -0.2698556), wk = 0.0035587 k( 263) = ( 0.5518076 -0.4012298 -0.2631396), wk = 0.0035587 k( 264) = ( 0.5647595 -0.3909893 -0.2564235), wk = 0.0035587 k( 265) = ( 0.5777114 -0.3807488 -0.2497074), wk = 0.0035587 k( 266) = ( 0.5906633 -0.3705083 -0.2429914), wk = 0.0035587 k( 267) = ( 0.6036152 -0.3602678 -0.2362753), wk = 0.0035587 k( 268) = ( 0.6165671 -0.3500273 -0.2295593), wk = 0.0035587 k( 269) = ( 0.6295190 -0.3397868 -0.2228432), wk = 0.0035587 k( 270) = ( 0.6424709 -0.3295463 -0.2161271), wk = 0.0035587 k( 271) = ( 0.6554229 -0.3193058 -0.2094111), wk = 0.0035587 k( 272) = ( 0.6683748 -0.3090653 -0.2026950), wk = 0.0035587 k( 273) = ( 0.6813267 -0.2988247 -0.1959790), wk = 0.0035587 k( 274) = ( 0.6942786 -0.2885842 -0.1892629), wk = 0.0035587 k( 275) = ( 0.7072305 -0.2783437 -0.1825468), wk = 0.0035587 k( 276) = ( 0.7201824 -0.2681032 -0.1758308), wk = 0.0035587 k( 277) = ( 0.7331343 -0.2578627 -0.1691147), wk = 0.0035587 k( 278) = ( 0.7460862 -0.2476222 -0.1623987), wk = 0.0035587 k( 279) = ( 0.7590381 -0.2373817 -0.1556826), wk = 0.0035587 k( 280) = ( 0.7719900 -0.2271412 -0.1489666), wk = 0.0035587 k( 281) = ( 0.7849419 -0.2169007 -0.1422505), wk = 0.0035587 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 2) = ( 0.0125000 -0.0000000 -0.0000000), wk = 0.0035587 k( 3) = ( 0.0250000 -0.0000000 -0.0000000), wk = 0.0035587 k( 4) = ( 0.0375000 -0.0000000 -0.0000000), wk = 0.0035587 k( 5) = ( 0.0500000 -0.0000000 -0.0000000), wk = 0.0035587 k( 6) = ( 0.0625000 0.0000000 -0.0000000), wk = 0.0035587 k( 7) = ( 0.0750000 -0.0000000 -0.0000000), wk = 0.0035587 k( 8) = ( 0.0875000 0.0000000 -0.0000000), wk = 0.0035587 k( 9) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0035587 k( 10) = ( 0.1125000 -0.0000000 -0.0000000), wk = 0.0035587 k( 11) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0035587 k( 12) = ( 0.1375000 -0.0000000 -0.0000000), wk = 0.0035587 k( 13) = ( 0.1500000 -0.0000000 -0.0000000), wk = 0.0035587 k( 14) = ( 0.1625000 -0.0000000 -0.0000000), wk = 0.0035587 k( 15) = ( 0.1750000 0.0000000 -0.0000000), wk = 0.0035587 k( 16) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0035587 k( 17) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0035587 k( 18) = ( 0.2125000 -0.0000000 0.0000000), wk = 0.0035587 k( 19) = ( 0.2250000 -0.0000000 -0.0000000), wk = 0.0035587 k( 20) = ( 0.2375000 0.0000000 -0.0000000), wk = 0.0035587 k( 21) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0035587 k( 22) = ( 0.2625000 -0.0000000 -0.0000000), wk = 0.0035587 k( 23) = ( 0.2750000 -0.0000000 -0.0000000), wk = 0.0035587 k( 24) = ( 0.2875000 -0.0000000 -0.0000000), wk = 0.0035587 k( 25) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0035587 k( 26) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0035587 k( 27) = ( 0.3250000 -0.0000000 -0.0000000), wk = 0.0035587 k( 28) = ( 0.3375000 -0.0000000 -0.0000000), wk = 0.0035587 k( 29) = ( 0.3500000 0.0000000 -0.0000000), wk = 0.0035587 k( 30) = ( 0.3625000 -0.0000000 -0.0000000), wk = 0.0035587 k( 31) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0035587 k( 32) = ( 0.3875000 -0.0000000 -0.0000000), wk = 0.0035587 k( 33) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0035587 k( 34) = ( 0.4125000 0.0000000 -0.0000000), wk = 0.0035587 k( 35) = ( 0.4250000 -0.0000000 0.0000000), wk = 0.0035587 k( 36) = ( 0.4375000 -0.0000000 -0.0000000), wk = 0.0035587 k( 37) = ( 0.4500000 -0.0000000 -0.0000000), wk = 0.0035587 k( 38) = ( 0.4625000 -0.0000000 -0.0000000), wk = 0.0035587 k( 39) = ( 0.4750000 0.0000000 -0.0000000), wk = 0.0035587 k( 40) = ( 0.4875000 -0.0000000 -0.0000000), wk = 0.0035587 k( 41) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035587 k( 42) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035587 k( 43) = ( 0.5000000 0.0074158 -0.0074158), wk = 0.0035587 k( 44) = ( 0.5000000 0.0148316 -0.0148316), wk = 0.0035587 k( 45) = ( 0.5000000 0.0222474 -0.0222474), wk = 0.0035587 k( 46) = ( 0.5000000 0.0296632 -0.0296632), wk = 0.0035587 k( 47) = ( 0.5000000 0.0370790 -0.0370790), wk = 0.0035587 k( 48) = ( 0.5000000 0.0444948 -0.0444948), wk = 0.0035587 k( 49) = ( 0.5000000 0.0519106 -0.0519106), wk = 0.0035587 k( 50) = ( 0.5000000 0.0593264 -0.0593264), wk = 0.0035587 k( 51) = ( 0.5000000 0.0667422 -0.0667422), wk = 0.0035587 k( 52) = ( 0.5000000 0.0741580 -0.0741580), wk = 0.0035587 k( 53) = ( 0.5000000 0.0815738 -0.0815738), wk = 0.0035587 k( 54) = ( 0.5000000 0.0889896 -0.0889896), wk = 0.0035587 k( 55) = ( 0.5000000 0.0964054 -0.0964054), wk = 0.0035587 k( 56) = ( 0.5000000 0.1038212 -0.1038212), wk = 0.0035587 k( 57) = ( 0.5000000 0.1112369 -0.1112370), wk = 0.0035587 k( 58) = ( 0.5000000 0.1186527 -0.1186528), wk = 0.0035587 k( 59) = ( 0.5000000 0.1260685 -0.1260685), wk = 0.0035587 k( 60) = ( 0.5000000 0.1334843 -0.1334843), wk = 0.0035587 k( 61) = ( 0.5000000 0.1409001 -0.1409001), wk = 0.0035587 k( 62) = ( 0.5000000 0.1483159 -0.1483159), wk = 0.0035587 k( 63) = ( 0.5000000 0.1557317 -0.1557317), wk = 0.0035587 k( 64) = ( 0.5000000 0.1631475 -0.1631475), wk = 0.0035587 k( 65) = ( 0.5000000 0.1705633 -0.1705633), wk = 0.0035587 k( 66) = ( 0.5000000 0.1779791 -0.1779791), wk = 0.0035587 k( 67) = ( 0.5000000 0.1853949 -0.1853949), wk = 0.0035587 k( 68) = ( 0.5000000 0.1928107 -0.1928107), wk = 0.0035587 k( 69) = ( 0.5000000 0.2002265 -0.2002265), wk = 0.0035587 k( 70) = ( 0.5000000 0.2076423 -0.2076423), wk = 0.0035587 k( 71) = ( 0.5000000 0.2150581 -0.2150581), wk = 0.0035587 k( 72) = ( 0.7849419 0.5000000 0.2150581), wk = 0.0035587 k( 73) = ( 0.7774434 0.5000000 0.2225566), wk = 0.0035587 k( 74) = ( 0.7699449 0.5000000 0.2300550), wk = 0.0035587 k( 75) = ( 0.7624465 0.5000000 0.2375535), wk = 0.0035587 k( 76) = ( 0.7549480 0.5000000 0.2450520), wk = 0.0035587 k( 77) = ( 0.7474495 0.5000000 0.2525505), wk = 0.0035587 k( 78) = ( 0.7399511 0.5000000 0.2600489), wk = 0.0035587 k( 79) = ( 0.7324526 0.5000000 0.2675474), wk = 0.0035587 k( 80) = ( 0.7249541 0.5000000 0.2750459), wk = 0.0035587 k( 81) = ( 0.7174557 0.5000000 0.2825443), wk = 0.0035587 k( 82) = ( 0.7099572 0.5000000 0.2900428), wk = 0.0035587 k( 83) = ( 0.7024587 0.5000000 0.2975413), wk = 0.0035587 k( 84) = ( 0.6949602 0.5000000 0.3050398), wk = 0.0035587 k( 85) = ( 0.6874618 0.5000000 0.3125382), wk = 0.0035587 k( 86) = ( 0.6799633 0.5000000 0.3200367), wk = 0.0035587 k( 87) = ( 0.6724648 0.5000000 0.3275352), wk = 0.0035587 k( 88) = ( 0.6649664 0.5000000 0.3350336), wk = 0.0035587 k( 89) = ( 0.6574679 0.5000000 0.3425321), wk = 0.0035587 k( 90) = ( 0.6499694 0.5000000 0.3500306), wk = 0.0035587 k( 91) = ( 0.6424709 0.5000000 0.3575291), wk = 0.0035587 k( 92) = ( 0.6349725 0.5000000 0.3650275), wk = 0.0035587 k( 93) = ( 0.6274740 0.5000000 0.3725260), wk = 0.0035587 k( 94) = ( 0.6199755 0.5000000 0.3800245), wk = 0.0035587 k( 95) = ( 0.6124771 0.5000000 0.3875229), wk = 0.0035587 k( 96) = ( 0.6049786 0.5000000 0.3950214), wk = 0.0035587 k( 97) = ( 0.5974801 0.5000000 0.4025199), wk = 0.0035587 k( 98) = ( 0.5899817 0.5000000 0.4100183), wk = 0.0035587 k( 99) = ( 0.5824832 0.5000000 0.4175168), wk = 0.0035587 k( 100) = ( 0.5749847 0.5000000 0.4250153), wk = 0.0035587 k( 101) = ( 0.5674862 0.5000000 0.4325138), wk = 0.0035587 k( 102) = ( 0.5599878 0.5000000 0.4400122), wk = 0.0035587 k( 103) = ( 0.5524893 0.5000000 0.4475107), wk = 0.0035587 k( 104) = ( 0.5449908 0.5000000 0.4550092), wk = 0.0035587 k( 105) = ( 0.5374923 0.5000000 0.4625076), wk = 0.0035587 k( 106) = ( 0.5299939 0.5000000 0.4700061), wk = 0.0035587 k( 107) = ( 0.5224954 0.5000000 0.4775046), wk = 0.0035587 k( 108) = ( 0.5149969 0.5000000 0.4850031), wk = 0.0035587 k( 109) = ( 0.5074985 0.5000000 0.4925015), wk = 0.0035587 k( 110) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035587 k( 111) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035587 k( 112) = ( 0.4838710 0.4838710 0.4838710), wk = 0.0035587 k( 113) = ( 0.4677419 0.4677419 0.4677419), wk = 0.0035587 k( 114) = ( 0.4516129 0.4516129 0.4516129), wk = 0.0035587 k( 115) = ( 0.4354839 0.4354839 0.4354839), wk = 0.0035587 k( 116) = ( 0.4193548 0.4193548 0.4193548), wk = 0.0035587 k( 117) = ( 0.4032258 0.4032258 0.4032258), wk = 0.0035587 k( 118) = ( 0.3870968 0.3870968 0.3870968), wk = 0.0035587 k( 119) = ( 0.3709677 0.3709677 0.3709677), wk = 0.0035587 k( 120) = ( 0.3548387 0.3548387 0.3548387), wk = 0.0035587 k( 121) = ( 0.3387097 0.3387097 0.3387097), wk = 0.0035587 k( 122) = ( 0.3225807 0.3225807 0.3225807), wk = 0.0035587 k( 123) = ( 0.3064516 0.3064516 0.3064516), wk = 0.0035587 k( 124) = ( 0.2903226 0.2903226 0.2903226), wk = 0.0035587 k( 125) = ( 0.2741936 0.2741936 0.2741936), wk = 0.0035587 k( 126) = ( 0.2580645 0.2580645 0.2580645), wk = 0.0035587 k( 127) = ( 0.2419355 0.2419355 0.2419355), wk = 0.0035587 k( 128) = ( 0.2258064 0.2258065 0.2258064), wk = 0.0035587 k( 129) = ( 0.2096774 0.2096774 0.2096774), wk = 0.0035587 k( 130) = ( 0.1935484 0.1935484 0.1935484), wk = 0.0035587 k( 131) = ( 0.1774194 0.1774194 0.1774193), wk = 0.0035587 k( 132) = ( 0.1612903 0.1612903 0.1612903), wk = 0.0035587 k( 133) = ( 0.1451613 0.1451613 0.1451613), wk = 0.0035587 k( 134) = ( 0.1290323 0.1290323 0.1290323), wk = 0.0035587 k( 135) = ( 0.1129032 0.1129032 0.1129032), wk = 0.0035587 k( 136) = ( 0.0967742 0.0967742 0.0967742), wk = 0.0035587 k( 137) = ( 0.0806452 0.0806452 0.0806452), wk = 0.0035587 k( 138) = ( 0.0645161 0.0645161 0.0645161), wk = 0.0035587 k( 139) = ( 0.0483871 0.0483871 0.0483871), wk = 0.0035587 k( 140) = ( 0.0322581 0.0322581 0.0322581), wk = 0.0035587 k( 141) = ( 0.0161290 0.0161290 0.0161290), wk = 0.0035587 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035587 k( 144) = ( 0.0074485 -0.0000000 -0.0074485), wk = 0.0035587 k( 145) = ( 0.0148970 -0.0000000 -0.0148970), wk = 0.0035587 k( 146) = ( 0.0223456 0.0000000 -0.0223456), wk = 0.0035587 k( 147) = ( 0.0297941 -0.0000000 -0.0297941), wk = 0.0035587 k( 148) = ( 0.0372426 0.0000000 -0.0372426), wk = 0.0035587 k( 149) = ( 0.0446911 -0.0000000 -0.0446911), wk = 0.0035587 k( 150) = ( 0.0521397 -0.0000000 -0.0521397), wk = 0.0035587 k( 151) = ( 0.0595882 -0.0000000 -0.0595882), wk = 0.0035587 k( 152) = ( 0.0670367 -0.0000000 -0.0670367), wk = 0.0035587 k( 153) = ( 0.0744852 0.0000000 -0.0744852), wk = 0.0035587 k( 154) = ( 0.0819337 -0.0000000 -0.0819337), wk = 0.0035587 k( 155) = ( 0.0893823 -0.0000000 -0.0893823), wk = 0.0035587 k( 156) = ( 0.0968308 0.0000000 -0.0968308), wk = 0.0035587 k( 157) = ( 0.1042793 0.0000000 -0.1042793), wk = 0.0035587 k( 158) = ( 0.1117278 -0.0000000 -0.1117278), wk = 0.0035587 k( 159) = ( 0.1191764 -0.0000000 -0.1191764), wk = 0.0035587 k( 160) = ( 0.1266249 -0.0000000 -0.1266249), wk = 0.0035587 k( 161) = ( 0.1340734 0.0000000 -0.1340734), wk = 0.0035587 k( 162) = ( 0.1415219 -0.0000000 -0.1415219), wk = 0.0035587 k( 163) = ( 0.1489704 0.0000000 -0.1489704), wk = 0.0035587 k( 164) = ( 0.1564190 0.0000000 -0.1564190), wk = 0.0035587 k( 165) = ( 0.1638675 -0.0000000 -0.1638675), wk = 0.0035587 k( 166) = ( 0.1713160 -0.0000000 -0.1713160), wk = 0.0035587 k( 167) = ( 0.1787645 -0.0000000 -0.1787645), wk = 0.0035587 k( 168) = ( 0.1862130 0.0000000 -0.1862131), wk = 0.0035587 k( 169) = ( 0.1936616 -0.0000000 -0.1936616), wk = 0.0035587 k( 170) = ( 0.2011101 -0.0000000 -0.2011101), wk = 0.0035587 k( 171) = ( 0.2085586 -0.0000000 -0.2085586), wk = 0.0035587 k( 172) = ( 0.2160071 -0.0000000 -0.2160071), wk = 0.0035587 k( 173) = ( 0.2234557 -0.0000000 -0.2234557), wk = 0.0035587 k( 174) = ( 0.2309042 0.0000000 -0.2309042), wk = 0.0035587 k( 175) = ( 0.2383527 -0.0000000 -0.2383527), wk = 0.0035587 k( 176) = ( 0.2458012 -0.0000000 -0.2458012), wk = 0.0035587 k( 177) = ( 0.2532497 -0.0000000 -0.2532498), wk = 0.0035587 k( 178) = ( 0.2606983 -0.0000000 -0.2606983), wk = 0.0035587 k( 179) = ( 0.2681468 0.0000000 -0.2681468), wk = 0.0035587 k( 180) = ( 0.2755953 0.0000000 -0.2755953), wk = 0.0035587 k( 181) = ( 0.2830438 0.0000000 -0.2830438), wk = 0.0035587 k( 182) = ( 0.2904924 0.0000000 -0.2904924), wk = 0.0035587 k( 183) = ( 0.2979409 0.0000000 -0.2979409), wk = 0.0035587 k( 184) = ( 0.3053894 0.0000000 -0.3053894), wk = 0.0035587 k( 185) = ( 0.3128379 0.0000000 -0.3128379), wk = 0.0035587 k( 186) = ( 0.3202864 -0.0000000 -0.3202864), wk = 0.0035587 k( 187) = ( 0.3277350 -0.0000000 -0.3277350), wk = 0.0035587 k( 188) = ( 0.3351835 -0.0000000 -0.3351835), wk = 0.0035587 k( 189) = ( 0.3426320 -0.0000000 -0.3426320), wk = 0.0035587 k( 190) = ( 0.3500805 -0.0000000 -0.3500805), wk = 0.0035587 k( 191) = ( 0.3575291 -0.0000000 -0.3575291), wk = 0.0035587 k( 192) = ( 0.6424709 0.3575291 -0.0000000), wk = 0.0035587 k( 193) = ( 0.6349725 0.3650275 -0.0000000), wk = 0.0035587 k( 194) = ( 0.6274740 0.3725260 -0.0000000), wk = 0.0035587 k( 195) = ( 0.6199755 0.3800245 -0.0000000), wk = 0.0035587 k( 196) = ( 0.6124771 0.3875229 -0.0000000), wk = 0.0035587 k( 197) = ( 0.6049786 0.3950214 -0.0000000), wk = 0.0035587 k( 198) = ( 0.5974801 0.4025199 -0.0000000), wk = 0.0035587 k( 199) = ( 0.5899817 0.4100183 -0.0000000), wk = 0.0035587 k( 200) = ( 0.5824832 0.4175168 -0.0000000), wk = 0.0035587 k( 201) = ( 0.5749847 0.4250153 -0.0000000), wk = 0.0035587 k( 202) = ( 0.5674862 0.4325138 -0.0000000), wk = 0.0035587 k( 203) = ( 0.5599878 0.4400122 -0.0000000), wk = 0.0035587 k( 204) = ( 0.5524893 0.4475107 -0.0000000), wk = 0.0035587 k( 205) = ( 0.5449908 0.4550092 -0.0000000), wk = 0.0035587 k( 206) = ( 0.5374923 0.4625076 -0.0000000), wk = 0.0035587 k( 207) = ( 0.5299939 0.4700061 -0.0000000), wk = 0.0035587 k( 208) = ( 0.5224954 0.4775046 -0.0000000), wk = 0.0035587 k( 209) = ( 0.5149969 0.4850031 -0.0000000), wk = 0.0035587 k( 210) = ( 0.5074985 0.4925015 -0.0000000), wk = 0.0035587 k( 211) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035587 k( 212) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035587 k( 213) = ( 0.5118726 0.5118726 0.0179215), wk = 0.0035587 k( 214) = ( 0.5237452 0.5237452 0.0358430), wk = 0.0035587 k( 215) = ( 0.5356177 0.5356177 0.0537645), wk = 0.0035587 k( 216) = ( 0.5474903 0.5474903 0.0716860), wk = 0.0035587 k( 217) = ( 0.5593629 0.5593629 0.0896075), wk = 0.0035587 k( 218) = ( 0.5712355 0.5712355 0.1075290), wk = 0.0035587 k( 219) = ( 0.5831080 0.5831080 0.1254506), wk = 0.0035587 k( 220) = ( 0.5949806 0.5949806 0.1433721), wk = 0.0035587 k( 221) = ( 0.6068532 0.6068532 0.1612936), wk = 0.0035587 k( 222) = ( 0.6187258 0.6187258 0.1792151), wk = 0.0035587 k( 223) = ( 0.6305984 0.6305984 0.1971366), wk = 0.0035587 k( 224) = ( 0.6424709 0.6424710 0.2150581), wk = 0.0035587 k( 225) = ( 0.6424709 0.6424710 0.2150581), wk = 0.0035587 k( 226) = ( 0.6381537 0.6381537 0.2236927), wk = 0.0035587 k( 227) = ( 0.6338363 0.6338363 0.2323273), wk = 0.0035587 k( 228) = ( 0.6295190 0.6295190 0.2409619), wk = 0.0035587 k( 229) = ( 0.6252017 0.6252017 0.2495965), wk = 0.0035587 k( 230) = ( 0.6208844 0.6208844 0.2582311), wk = 0.0035587 k( 231) = ( 0.6165671 0.6165671 0.2668657), wk = 0.0035587 k( 232) = ( 0.6122498 0.6122498 0.2755003), wk = 0.0035587 k( 233) = ( 0.6079325 0.6079325 0.2841349), wk = 0.0035587 k( 234) = ( 0.6036152 0.6036152 0.2927695), wk = 0.0035587 k( 235) = ( 0.5992979 0.5992979 0.3014041), wk = 0.0035587 k( 236) = ( 0.5949806 0.5949806 0.3100387), wk = 0.0035587 k( 237) = ( 0.5906633 0.5906633 0.3186733), wk = 0.0035587 k( 238) = ( 0.5863460 0.5863460 0.3273079), wk = 0.0035587 k( 239) = ( 0.5820287 0.5820287 0.3359425), wk = 0.0035587 k( 240) = ( 0.5777114 0.5777114 0.3445771), wk = 0.0035587 k( 241) = ( 0.5733941 0.5733941 0.3532117), wk = 0.0035587 k( 242) = ( 0.5690768 0.5690768 0.3618463), wk = 0.0035587 k( 243) = ( 0.5647595 0.5647595 0.3704810), wk = 0.0035587 k( 244) = ( 0.5604422 0.5604422 0.3791156), wk = 0.0035587 k( 245) = ( 0.5561249 0.5561249 0.3877502), wk = 0.0035587 k( 246) = ( 0.5518076 0.5518076 0.3963848), wk = 0.0035587 k( 247) = ( 0.5474903 0.5474903 0.4050194), wk = 0.0035587 k( 248) = ( 0.5431730 0.5431730 0.4136540), wk = 0.0035587 k( 249) = ( 0.5388557 0.5388557 0.4222886), wk = 0.0035587 k( 250) = ( 0.5345384 0.5345384 0.4309232), wk = 0.0035587 k( 251) = ( 0.5302211 0.5302211 0.4395578), wk = 0.0035587 k( 252) = ( 0.5259038 0.5259038 0.4481924), wk = 0.0035587 k( 253) = ( 0.5215865 0.5215865 0.4568270), wk = 0.0035587 k( 254) = ( 0.5172692 0.5172692 0.4654616), wk = 0.0035587 k( 255) = ( 0.5129519 0.5129519 0.4740962), wk = 0.0035587 k( 256) = ( 0.5086346 0.5086346 0.4827308), wk = 0.0035587 k( 257) = ( 0.5043173 0.5043173 0.4913654), wk = 0.0035587 k( 258) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035587 k( 259) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035587 k( 260) = ( 0.5129519 0.0162513 0.0162513), wk = 0.0035587 k( 261) = ( 0.5259038 0.0325026 0.0325026), wk = 0.0035587 k( 262) = ( 0.5388557 0.0487540 0.0487540), wk = 0.0035587 k( 263) = ( 0.5518076 0.0650053 0.0650053), wk = 0.0035587 k( 264) = ( 0.5647595 0.0812566 0.0812566), wk = 0.0035587 k( 265) = ( 0.5777114 0.0975079 0.0975079), wk = 0.0035587 k( 266) = ( 0.5906633 0.1137592 0.1137592), wk = 0.0035587 k( 267) = ( 0.6036152 0.1300106 0.1300106), wk = 0.0035587 k( 268) = ( 0.6165671 0.1462619 0.1462619), wk = 0.0035587 k( 269) = ( 0.6295190 0.1625132 0.1625132), wk = 0.0035587 k( 270) = ( 0.6424709 0.1787645 0.1787645), wk = 0.0035587 k( 271) = ( 0.6554229 0.1950158 0.1950158), wk = 0.0035587 k( 272) = ( 0.6683748 0.2112672 0.2112672), wk = 0.0035587 k( 273) = ( 0.6813267 0.2275185 0.2275185), wk = 0.0035587 k( 274) = ( 0.6942786 0.2437698 0.2437698), wk = 0.0035587 k( 275) = ( 0.7072305 0.2600211 0.2600211), wk = 0.0035587 k( 276) = ( 0.7201824 0.2762725 0.2762724), wk = 0.0035587 k( 277) = ( 0.7331343 0.2925238 0.2925238), wk = 0.0035587 k( 278) = ( 0.7460862 0.3087751 0.3087751), wk = 0.0035587 k( 279) = ( 0.7590381 0.3250264 0.3250264), wk = 0.0035587 k( 280) = ( 0.7719900 0.3412777 0.3412777), wk = 0.0035587 k( 281) = ( 0.7849419 0.3575291 0.3575291), wk = 0.0035587 Dense grid: 91225 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 32971 G-vectors FFT dimensions: ( 50, 50, 50) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.26 Mb ( 228, 76) NL pseudopotentials 0.31 Mb ( 114, 180) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2536) G-vector shells 0.02 Mb ( 2079) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.06 Mb ( 228, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.42 Mb ( 180, 2, 76) Check: negative/imaginary core charge= -0.000008 0.000000 The potential is recalculated from file : ./ScBO3.save/charge-density.dat negative rho (up, down): 4.366E-04 0.000E+00 Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.8 secs Computing kpt #: 2 total cpu time spent up to now is 5.9 secs Computing kpt #: 3 total cpu time spent up to now is 7.0 secs Computing kpt #: 4 total cpu time spent up to now is 8.2 secs Computing kpt #: 5 total cpu time spent up to now is 9.3 secs Computing kpt #: 6 total cpu time spent up to now is 10.4 secs Computing kpt #: 7 total cpu time spent up to now is 11.5 secs Computing kpt #: 8 total cpu time spent up to now is 12.7 secs Computing kpt #: 9 total cpu time spent up to now is 13.8 secs Computing kpt #: 10 total cpu time spent up to now is 15.0 secs Computing kpt #: 11 total cpu time spent up to now is 16.1 secs Computing kpt #: 12 total cpu time spent up to now is 17.3 secs Computing kpt #: 13 total cpu time spent up to now is 18.4 secs Computing kpt #: 14 total cpu time spent up to now is 19.6 secs Computing kpt #: 15 total cpu time spent up to now is 20.8 secs Computing kpt #: 16 total cpu time spent up to now is 21.9 secs Computing kpt #: 17 total cpu time spent up to now is 23.1 secs Computing kpt #: 18 total cpu time spent up to now is 24.3 secs Computing kpt #: 19 total cpu time spent up to now is 25.4 secs Computing kpt #: 20 total cpu time spent up to now is 26.6 secs Computing kpt #: 21 total cpu time spent up to now is 29.9 secs Computing kpt #: 22 total cpu time spent up to now is 31.1 secs Computing kpt #: 23 total cpu time spent up to now is 32.3 secs Computing kpt #: 24 total cpu time spent up to now is 33.5 secs Computing kpt #: 25 total cpu time spent up to now is 34.7 secs Computing kpt #: 26 total cpu time spent up to now is 35.9 secs Computing kpt #: 27 total cpu time spent up to now is 37.0 secs Computing kpt #: 28 total cpu time spent up to now is 38.2 secs Computing kpt #: 29 total cpu time spent up to now is 39.4 secs Computing kpt #: 30 total cpu time spent up to now is 40.6 secs Computing kpt #: 31 total cpu time spent up to now is 41.8 secs Computing kpt #: 32 total cpu time spent up to now is 43.0 secs Computing kpt #: 33 total cpu time spent up to now is 44.2 secs Computing kpt #: 34 total cpu time spent up to now is 45.4 secs Computing kpt #: 35 total cpu time spent up to now is 46.5 secs Computing kpt #: 36 total cpu time spent up to now is 47.7 secs Computing kpt #: 37 total cpu time spent up to now is 48.9 secs Computing kpt #: 38 total cpu time spent up to now is 50.1 secs Computing kpt #: 39 total cpu time spent up to now is 51.3 secs Computing kpt #: 40 total cpu time spent up to now is 52.5 secs Computing kpt #: 41 total cpu time spent up to now is 53.7 secs Computing kpt #: 42 total cpu time spent up to now is 54.9 secs Computing kpt #: 43 total cpu time spent up to now is 56.1 secs Computing kpt #: 44 total cpu time spent up to now is 57.3 secs Computing kpt #: 45 total cpu time spent up to now is 58.5 secs Computing kpt #: 46 total cpu time spent up to now is 59.7 secs Computing kpt #: 47 total cpu time spent up to now is 60.9 secs Computing kpt #: 48 total cpu time spent up to now is 62.1 secs Computing kpt #: 49 total cpu time spent up to now is 63.3 secs Computing kpt #: 50 total cpu time spent up to now is 64.5 secs Computing kpt #: 51 total cpu time spent up to now is 65.7 secs Computing kpt #: 52 total cpu time spent up to now is 66.9 secs Computing kpt #: 53 total cpu time spent up to now is 68.1 secs Computing kpt #: 54 total cpu time spent up to now is 69.3 secs Computing kpt #: 55 total cpu time spent up to now is 70.5 secs Computing kpt #: 56 total cpu time spent up to now is 71.6 secs Computing kpt #: 57 total cpu time spent up to now is 72.8 secs Computing kpt #: 58 total cpu time spent up to now is 74.0 secs Computing kpt #: 59 total cpu time spent up to now is 75.2 secs Computing kpt #: 60 total cpu time spent up to now is 76.4 secs Computing kpt #: 61 total cpu time spent up to now is 77.6 secs Computing kpt #: 62 total cpu time spent up to now is 78.7 secs Computing kpt #: 63 total cpu time spent up to now is 79.9 secs Computing kpt #: 64 total cpu time spent up to now is 81.1 secs Computing kpt #: 65 total cpu time spent up to now is 82.3 secs Computing kpt #: 66 total cpu time spent up to now is 83.4 secs Computing kpt #: 67 total cpu time spent up to now is 84.6 secs Computing kpt #: 68 total cpu time spent up to now is 85.7 secs Computing kpt #: 69 total cpu time spent up to now is 86.9 secs Computing kpt #: 70 total cpu time spent up to now is 88.0 secs Computing kpt #: 71 total cpu time spent up to now is 89.2 secs Computing kpt #: 72 total cpu time spent up to now is 90.4 secs Computing kpt #: 73 total cpu time spent up to now is 91.5 secs Computing kpt #: 74 total cpu time spent up to now is 92.7 secs Computing kpt #: 75 total cpu time spent up to now is 93.8 secs Computing kpt #: 76 total cpu time spent up to now is 95.0 secs Computing kpt #: 77 total cpu time spent up to now is 96.1 secs Computing kpt #: 78 total cpu time spent up to now is 97.3 secs Computing kpt #: 79 total cpu time spent up to now is 98.4 secs Computing kpt #: 80 total cpu time spent up to now is 99.6 secs Computing kpt #: 81 total cpu time spent up to now is 100.7 secs Computing kpt #: 82 total cpu time spent up to now is 101.9 secs Computing kpt #: 83 total cpu time spent up to now is 103.0 secs Computing kpt #: 84 total cpu time spent up to now is 104.2 secs Computing kpt #: 85 total cpu time spent up to now is 105.3 secs Computing kpt #: 86 total cpu time spent up to now is 106.5 secs Computing kpt #: 87 total cpu time spent up to now is 107.6 secs Computing kpt #: 88 total cpu time spent up to now is 108.8 secs Computing kpt #: 89 total cpu time spent up to now is 110.0 secs Computing kpt #: 90 total cpu time spent up to now is 111.1 secs Computing kpt #: 91 total cpu time spent up to now is 112.3 secs Computing kpt #: 92 total cpu time spent up to now is 113.4 secs Computing kpt #: 93 total cpu time spent up to now is 114.5 secs Computing kpt #: 94 total cpu time spent up to now is 115.6 secs Computing kpt #: 95 total cpu time spent up to now is 116.8 secs Computing kpt #: 96 total cpu time spent up to now is 117.9 secs Computing kpt #: 97 total cpu time spent up to now is 119.1 secs Computing kpt #: 98 total cpu time spent up to now is 120.2 secs Computing kpt #: 99 total cpu time spent up to now is 121.4 secs Computing kpt #: 100 total cpu time spent up to now is 122.6 secs Computing kpt #: 101 total cpu time spent up to now is 123.7 secs Computing kpt #: 102 total cpu time spent up to now is 124.9 secs Computing kpt #: 103 total cpu time spent up to now is 126.1 secs Computing kpt #: 104 total cpu time spent up to now is 127.2 secs Computing kpt #: 105 total cpu time spent up to now is 128.3 secs Computing kpt #: 106 total cpu time spent up to now is 129.5 secs Computing kpt #: 107 total cpu time spent up to now is 130.6 secs Computing kpt #: 108 total cpu time spent up to now is 131.8 secs Computing kpt #: 109 total cpu time spent up to now is 133.0 secs Computing kpt #: 110 total cpu time spent up to now is 134.1 secs Computing kpt #: 111 total cpu time spent up to now is 135.2 secs Computing kpt #: 112 total cpu time spent up to now is 136.4 secs Computing kpt #: 113 total cpu time spent up to now is 137.5 secs Computing kpt #: 114 total cpu time spent up to now is 138.7 secs Computing kpt #: 115 total cpu time spent up to now is 139.8 secs Computing kpt #: 116 total cpu time spent up to now is 140.9 secs Computing kpt #: 117 total cpu time spent up to now is 142.1 secs Computing kpt #: 118 total cpu time spent up to now is 143.2 secs Computing kpt #: 119 total cpu time spent up to now is 144.3 secs Computing kpt #: 120 total cpu time spent up to now is 145.5 secs Computing kpt #: 121 total cpu time spent up to now is 146.6 secs Computing kpt #: 122 total cpu time spent up to now is 147.7 secs Computing kpt #: 123 total cpu time spent up to now is 148.9 secs Computing kpt #: 124 total cpu time spent up to now is 150.0 secs Computing kpt #: 125 total cpu time spent up to now is 151.1 secs Computing kpt #: 126 total cpu time spent up to now is 152.3 secs Computing kpt #: 127 total cpu time spent up to now is 153.4 secs Computing kpt #: 128 total cpu time spent up to now is 154.5 secs Computing kpt #: 129 total cpu time spent up to now is 155.6 secs Computing kpt #: 130 total cpu time spent up to now is 156.7 secs Computing kpt #: 131 total cpu time spent up to now is 157.9 secs Computing kpt #: 132 total cpu time spent up to now is 159.0 secs Computing kpt #: 133 total cpu time spent up to now is 160.1 secs Computing kpt #: 134 total cpu time spent up to now is 161.2 secs Computing kpt #: 135 total cpu time spent up to now is 162.3 secs Computing kpt #: 136 total cpu time spent up to now is 163.4 secs Computing kpt #: 137 total cpu time spent up to now is 164.5 secs Computing kpt #: 138 total cpu time spent up to now is 165.4 secs Computing kpt #: 139 total cpu time spent up to now is 166.3 secs Computing kpt #: 140 total cpu time spent up to now is 167.2 secs Computing kpt #: 141 total cpu time spent up to now is 168.3 secs Computing kpt #: 142 total cpu time spent up to now is 169.3 secs Computing kpt #: 143 total cpu time spent up to now is 170.4 secs Computing kpt #: 144 total cpu time spent up to now is 171.3 secs Computing kpt #: 145 total cpu time spent up to now is 172.4 secs Computing kpt #: 146 total cpu time spent up to now is 173.5 secs Computing kpt #: 147 total cpu time spent up to now is 174.6 secs Computing kpt #: 148 total cpu time spent up to now is 175.7 secs Computing kpt #: 149 total cpu time spent up to now is 176.8 secs Computing kpt #: 150 total cpu time spent up to now is 178.0 secs Computing kpt #: 151 total cpu time spent up to now is 179.1 secs Computing kpt #: 152 total cpu time spent up to now is 180.2 secs Computing kpt #: 153 total cpu time spent up to now is 181.4 secs Computing kpt #: 154 total cpu time spent up to now is 182.5 secs Computing kpt #: 155 total cpu time spent up to now is 183.7 secs Computing kpt #: 156 total cpu time spent up to now is 184.9 secs Computing kpt #: 157 total cpu time spent up to now is 186.0 secs Computing kpt #: 158 total cpu time spent up to now is 187.2 secs Computing kpt #: 159 total cpu time spent up to now is 188.4 secs Computing kpt #: 160 total cpu time spent up to now is 189.6 secs Computing kpt #: 161 total cpu time spent up to now is 190.8 secs Computing kpt #: 162 total cpu time spent up to now is 191.8 secs Computing kpt #: 163 total cpu time spent up to now is 193.0 secs Computing kpt #: 164 total cpu time spent up to now is 194.2 secs Computing kpt #: 165 total cpu time spent up to now is 195.4 secs Computing kpt #: 166 total cpu time spent up to now is 196.5 secs Computing kpt #: 167 total cpu time spent up to now is 197.7 secs Computing kpt #: 168 total cpu time spent up to now is 198.9 secs Computing kpt #: 169 total cpu time spent up to now is 200.1 secs Computing kpt #: 170 total cpu time spent up to now is 201.2 secs Computing kpt #: 171 total cpu time spent up to now is 202.4 secs Computing kpt #: 172 total cpu time spent up to now is 203.6 secs Computing kpt #: 173 total cpu time spent up to now is 204.8 secs Computing kpt #: 174 total cpu time spent up to now is 206.0 secs Computing kpt #: 175 total cpu time spent up to now is 207.1 secs Computing kpt #: 176 total cpu time spent up to now is 208.3 secs Computing kpt #: 177 total cpu time spent up to now is 209.5 secs Computing kpt #: 178 total cpu time spent up to now is 210.7 secs Computing kpt #: 179 total cpu time spent up to now is 211.8 secs Computing kpt #: 180 total cpu time spent up to now is 213.0 secs Computing kpt #: 181 total cpu time spent up to now is 214.2 secs Computing kpt #: 182 total cpu time spent up to now is 215.4 secs Computing kpt #: 183 total cpu time spent up to now is 216.5 secs Computing kpt #: 184 total cpu time spent up to now is 217.7 secs Computing kpt #: 185 total cpu time spent up to now is 218.9 secs Computing kpt #: 186 total cpu time spent up to now is 220.0 secs Computing kpt #: 187 total cpu time spent up to now is 221.2 secs Computing kpt #: 188 total cpu time spent up to now is 222.4 secs Computing kpt #: 189 total cpu time spent up to now is 223.5 secs Computing kpt #: 190 total cpu time spent up to now is 224.7 secs Computing kpt #: 191 total cpu time spent up to now is 225.8 secs Computing kpt #: 192 total cpu time spent up to now is 227.0 secs Computing kpt #: 193 total cpu time spent up to now is 228.2 secs Computing kpt #: 194 total cpu time spent up to now is 229.3 secs Computing kpt #: 195 total cpu time spent up to now is 230.5 secs Computing kpt #: 196 total cpu time spent up to now is 231.6 secs Computing kpt #: 197 total cpu time spent up to now is 232.8 secs Computing kpt #: 198 total cpu time spent up to now is 233.9 secs Computing kpt #: 199 total cpu time spent up to now is 235.1 secs Computing kpt #: 200 total cpu time spent up to now is 236.8 secs Computing kpt #: 201 total cpu time spent up to now is 238.0 secs Computing kpt #: 202 total cpu time spent up to now is 239.2 secs Computing kpt #: 203 total cpu time spent up to now is 240.4 secs Computing kpt #: 204 total cpu time spent up to now is 241.6 secs Computing kpt #: 205 total cpu time spent up to now is 242.7 secs Computing kpt #: 206 total cpu time spent up to now is 243.9 secs Computing kpt #: 207 total cpu time spent up to now is 245.1 secs Computing kpt #: 208 total cpu time spent up to now is 246.3 secs Computing kpt #: 209 total cpu time spent up to now is 247.4 secs Computing kpt #: 210 total cpu time spent up to now is 248.6 secs Computing kpt #: 211 total cpu time spent up to now is 249.8 secs Computing kpt #: 212 total cpu time spent up to now is 251.0 secs Computing kpt #: 213 total cpu time spent up to now is 252.2 secs Computing kpt #: 214 total cpu time spent up to now is 253.4 secs Computing kpt #: 215 total cpu time spent up to now is 254.5 secs Computing kpt #: 216 total cpu time spent up to now is 255.7 secs Computing kpt #: 217 total cpu time spent up to now is 256.9 secs Computing kpt #: 218 total cpu time spent up to now is 258.1 secs Computing kpt #: 219 total cpu time spent up to now is 259.3 secs Computing kpt #: 220 total cpu time spent up to now is 260.5 secs Computing kpt #: 221 total cpu time spent up to now is 261.8 secs Computing kpt #: 222 total cpu time spent up to now is 263.0 secs Computing kpt #: 223 total cpu time spent up to now is 264.1 secs Computing kpt #: 224 total cpu time spent up to now is 265.3 secs Computing kpt #: 225 total cpu time spent up to now is 266.5 secs Computing kpt #: 226 total cpu time spent up to now is 267.6 secs Computing kpt #: 227 total cpu time spent up to now is 268.8 secs Computing kpt #: 228 total cpu time spent up to now is 270.0 secs Computing kpt #: 229 total cpu time spent up to now is 271.1 secs Computing kpt #: 230 total cpu time spent up to now is 272.3 secs Computing kpt #: 231 total cpu time spent up to now is 273.4 secs Computing kpt #: 232 total cpu time spent up to now is 274.6 secs Computing kpt #: 233 total cpu time spent up to now is 275.8 secs Computing kpt #: 234 total cpu time spent up to now is 276.9 secs Computing kpt #: 235 total cpu time spent up to now is 278.1 secs Computing kpt #: 236 total cpu time spent up to now is 279.2 secs Computing kpt #: 237 total cpu time spent up to now is 280.4 secs Computing kpt #: 238 total cpu time spent up to now is 281.5 secs Computing kpt #: 239 total cpu time spent up to now is 282.6 secs Computing kpt #: 240 total cpu time spent up to now is 283.8 secs Computing kpt #: 241 total cpu time spent up to now is 284.9 secs Computing kpt #: 242 total cpu time spent up to now is 286.1 secs Computing kpt #: 243 total cpu time spent up to now is 287.2 secs Computing kpt #: 244 total cpu time spent up to now is 288.4 secs Computing kpt #: 245 total cpu time spent up to now is 289.4 secs Computing kpt #: 246 total cpu time spent up to now is 290.6 secs Computing kpt #: 247 total cpu time spent up to now is 291.7 secs Computing kpt #: 248 total cpu time spent up to now is 292.7 secs Computing kpt #: 249 total cpu time spent up to now is 293.9 secs Computing kpt #: 250 total cpu time spent up to now is 295.1 secs Computing kpt #: 251 total cpu time spent up to now is 296.1 secs Computing kpt #: 252 total cpu time spent up to now is 297.2 secs Computing kpt #: 253 total cpu time spent up to now is 298.4 secs Computing kpt #: 254 total cpu time spent up to now is 299.5 secs Computing kpt #: 255 total cpu time spent up to now is 300.7 secs Computing kpt #: 256 total cpu time spent up to now is 301.8 secs Computing kpt #: 257 total cpu time spent up to now is 303.0 secs Computing kpt #: 258 total cpu time spent up to now is 304.1 secs Computing kpt #: 259 total cpu time spent up to now is 305.3 secs Computing kpt #: 260 total cpu time spent up to now is 306.5 secs Computing kpt #: 261 total cpu time spent up to now is 307.7 secs Computing kpt #: 262 total cpu time spent up to now is 308.9 secs Computing kpt #: 263 total cpu time spent up to now is 310.1 secs Computing kpt #: 264 total cpu time spent up to now is 311.3 secs Computing kpt #: 265 total cpu time spent up to now is 312.4 secs Computing kpt #: 266 total cpu time spent up to now is 313.6 secs Computing kpt #: 267 total cpu time spent up to now is 314.8 secs Computing kpt #: 268 total cpu time spent up to now is 316.0 secs Computing kpt #: 269 total cpu time spent up to now is 317.2 secs Computing kpt #: 270 total cpu time spent up to now is 318.3 secs Computing kpt #: 271 total cpu time spent up to now is 319.5 secs Computing kpt #: 272 total cpu time spent up to now is 320.7 secs Computing kpt #: 273 total cpu time spent up to now is 321.9 secs Computing kpt #: 274 total cpu time spent up to now is 323.0 secs Computing kpt #: 275 total cpu time spent up to now is 324.2 secs Computing kpt #: 276 total cpu time spent up to now is 325.4 secs Computing kpt #: 277 total cpu time spent up to now is 326.5 secs Computing kpt #: 278 total cpu time spent up to now is 327.7 secs Computing kpt #: 279 total cpu time spent up to now is 328.9 secs Computing kpt #: 280 total cpu time spent up to now is 330.0 secs Computing kpt #: 281 total cpu time spent up to now is 331.2 secs ethr = 1.56E-08, avg # of iterations = 22.0 total cpu time spent up to now is 331.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4113 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6596 -19.6596 -19.5482 -19.5482 -19.1753 -19.1753 -19.1608 -19.1608 -19.0655 -19.0655 -18.9901 -18.9901 -12.0112 -12.0112 -11.0538 -11.0538 -10.2199 -10.2199 -10.2198 -10.2198 -9.6787 -9.6787 -9.6647 -9.6647 1.2809 1.2809 1.4877 1.4877 1.5586 1.5586 1.7935 1.7935 1.8053 1.8053 2.4098 2.4098 2.4122 2.4122 4.3311 4.3311 4.3341 4.3341 4.7546 4.7546 5.4810 5.4810 5.7887 5.7887 5.8037 5.8037 5.9458 5.9458 5.9700 5.9700 6.4940 6.4940 6.8930 6.8930 6.9047 6.9047 11.8765 11.8765 11.8829 11.8829 11.9318 11.9318 12.0409 12.0409 12.0629 12.0629 12.7194 12.7194 k = 0.0125-0.0111-0.0073 ( 4121 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6595 -19.6595 -19.5483 -19.5483 -19.1753 -19.1753 -19.1608 -19.1608 -19.0656 -19.0656 -18.9902 -18.9902 -12.0105 -12.0105 -11.0545 -11.0545 -10.2197 -10.2197 -10.2192 -10.2192 -9.6792 -9.6792 -9.6652 -9.6652 1.2796 1.2796 1.4879 1.4879 1.5597 1.5597 1.7949 1.7949 1.8068 1.8068 2.4094 2.4094 2.4125 2.4125 4.3275 4.3275 4.3338 4.3338 4.7583 4.7583 5.4824 5.4824 5.7877 5.7877 5.8027 5.8027 5.9453 5.9453 5.9694 5.9694 6.4942 6.4942 6.8917 6.8917 6.9035 6.9035 11.8765 11.8765 11.8829 11.8829 11.9320 11.9320 12.0405 12.0405 12.0626 12.0626 12.7189 12.7189 k = 0.0250-0.0221-0.0145 ( 4117 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6594 -19.6594 -19.5485 -19.5485 -19.1752 -19.1752 -19.1606 -19.1606 -19.0658 -19.0658 -18.9904 -18.9904 -12.0084 -12.0084 -11.0564 -11.0564 -10.2192 -10.2192 -10.2173 -10.2173 -9.6807 -9.6807 -9.6667 -9.6667 1.2758 1.2758 1.4883 1.4883 1.5631 1.5631 1.7987 1.7987 1.8121 1.8121 2.4067 2.4067 2.4148 2.4148 4.3144 4.3144 4.3361 4.3361 4.7688 4.7688 5.4866 5.4866 5.7834 5.7834 5.8011 5.8011 5.9430 5.9430 5.9682 5.9682 6.4946 6.4946 6.8872 6.8872 6.9007 6.9007 11.8763 11.8763 11.8828 11.8828 11.9326 11.9326 12.0395 12.0395 12.0615 12.0615 12.7174 12.7174 k = 0.0375-0.0332-0.0218 ( 4115 PWs) bands (ev): -40.5918 -40.5918 -40.5763 -40.5763 -19.6592 -19.6592 -19.5487 -19.5487 -19.1751 -19.1751 -19.1603 -19.1603 -19.0661 -19.0661 -18.9907 -18.9907 -12.0049 -12.0049 -11.0597 -11.0597 -10.2183 -10.2183 -10.2142 -10.2142 -9.6833 -9.6833 -9.6691 -9.6691 1.2699 1.2699 1.4890 1.4890 1.5688 1.5688 1.8037 1.8037 1.8221 1.8221 2.4018 2.4018 2.4193 2.4193 4.2935 4.2935 4.3403 4.3403 4.7850 4.7850 5.4933 5.4933 5.7743 5.7743 5.8007 5.8007 5.9375 5.9375 5.9676 5.9676 6.4954 6.4954 6.8784 6.8784 6.8974 6.8974 11.8761 11.8761 11.8826 11.8826 11.9336 11.9336 12.0377 12.0377 12.0600 12.0600 12.7149 12.7149 k = 0.0500-0.0442-0.0290 ( 4118 PWs) bands (ev): -40.5917 -40.5917 -40.5763 -40.5763 -19.6590 -19.6590 -19.5491 -19.5491 -19.1749 -19.1749 -19.1599 -19.1599 -19.0665 -19.0665 -18.9912 -18.9912 -12.0001 -12.0001 -11.0641 -11.0641 -10.2171 -10.2171 -10.2100 -10.2100 -9.6872 -9.6872 -9.6722 -9.6722 1.2620 1.2620 1.4898 1.4898 1.5765 1.5765 1.8097 1.8097 1.8366 1.8366 2.3949 2.3949 2.4256 2.4256 4.2667 4.2667 4.3462 4.3462 4.8050 4.8050 5.5026 5.5026 5.7610 5.7610 5.8015 5.8015 5.9280 5.9280 5.9679 5.9679 6.4964 6.4964 6.8650 6.8650 6.8940 6.8940 11.8755 11.8755 11.8823 11.8823 11.9350 11.9350 12.0353 12.0353 12.0582 12.0582 12.7113 12.7113 k = 0.0625-0.0553-0.0363 ( 4114 PWs) bands (ev): -40.5917 -40.5917 -40.5763 -40.5763 -19.6586 -19.6586 -19.5495 -19.5495 -19.1747 -19.1747 -19.1593 -19.1593 -19.0671 -19.0671 -18.9919 -18.9919 -11.9939 -11.9939 -11.0696 -11.0696 -10.2156 -10.2156 -10.2047 -10.2047 -9.6923 -9.6923 -9.6760 -9.6760 1.2528 1.2528 1.4905 1.4905 1.5863 1.5863 1.8172 1.8172 1.8552 1.8552 2.3863 2.3863 2.4335 2.4335 4.2355 4.2355 4.3537 4.3537 4.8276 4.8276 5.5142 5.5142 5.7444 5.7444 5.8025 5.8025 5.9150 5.9150 5.9685 5.9685 6.4978 6.4978 6.8476 6.8476 6.8903 6.8903 11.8745 11.8745 11.8819 11.8819 11.9367 11.9367 12.0323 12.0323 12.0563 12.0563 12.7067 12.7067 k = 0.0750-0.0663-0.0435 ( 4110 PWs) bands (ev): -40.5916 -40.5916 -40.5764 -40.5764 -19.6582 -19.6582 -19.5501 -19.5501 -19.1745 -19.1745 -19.1587 -19.1587 -19.0678 -19.0678 -18.9926 -18.9926 -11.9863 -11.9863 -11.0762 -11.0762 -10.2137 -10.2137 -10.1984 -10.1984 -9.6988 -9.6988 -9.6803 -9.6803 1.2427 1.2427 1.4910 1.4910 1.5980 1.5980 1.8265 1.8265 1.8771 1.8771 2.3762 2.3762 2.4430 2.4430 4.2012 4.2012 4.3628 4.3628 4.8515 4.8515 5.5277 5.5277 5.7255 5.7255 5.8023 5.8023 5.9000 5.9000 5.9688 5.9688 6.4994 6.4994 6.8266 6.8266 6.8861 6.8861 11.8727 11.8727 11.8814 11.8814 11.9387 11.9387 12.0292 12.0292 12.0545 12.0545 12.7011 12.7011 k = 0.0875-0.0774-0.0508 ( 4114 PWs) bands (ev): -40.5915 -40.5915 -40.5765 -40.5765 -19.6578 -19.6578 -19.5508 -19.5508 -19.1742 -19.1742 -19.1579 -19.1579 -19.0687 -19.0687 -18.9935 -18.9935 -11.9774 -11.9774 -11.0837 -11.0837 -10.2115 -10.2115 -10.1914 -10.1914 -9.7066 -9.7066 -9.6851 -9.6851 1.2321 1.2321 1.4910 1.4910 1.6116 1.6116 1.8377 1.8377 1.9019 1.9019 2.3650 2.3650 2.4540 2.4540 4.1646 4.1646 4.3733 4.3733 4.8758 4.8758 5.5430 5.5430 5.7047 5.7047 5.7988 5.7988 5.8851 5.8851 5.9681 5.9681 6.5013 6.5013 6.8024 6.8024 6.8815 6.8815 11.8698 11.8698 11.8810 11.8810 11.9410 11.9410 12.0262 12.0262 12.0527 12.0527 12.6945 12.6945 k = 0.1000-0.0884-0.0580 ( 4124 PWs) bands (ev): -40.5914 -40.5914 -40.5766 -40.5766 -19.6573 -19.6573 -19.5516 -19.5516 -19.1740 -19.1740 -19.1570 -19.1570 -19.0696 -19.0696 -18.9946 -18.9946 -11.9673 -11.9673 -11.0920 -11.0920 -10.2090 -10.2090 -10.1836 -10.1836 -9.7157 -9.7157 -9.6904 -9.6904 1.2213 1.2213 1.4905 1.4905 1.6268 1.6268 1.8510 1.8510 1.9291 1.9291 2.3528 2.3528 2.4663 2.4663 4.1267 4.1267 4.3851 4.3851 4.8998 4.8998 5.5594 5.5594 5.6825 5.6825 5.7885 5.7885 5.8738 5.8738 5.9663 5.9663 6.5034 6.5034 6.7753 6.7753 6.8765 6.8765 11.8653 11.8653 11.8808 11.8808 11.9436 11.9436 12.0240 12.0240 12.0511 12.0511 12.6868 12.6868 k = 0.1125-0.0995-0.0653 ( 4126 PWs) bands (ev): -40.5913 -40.5913 -40.5767 -40.5767 -19.6567 -19.6567 -19.5524 -19.5524 -19.1736 -19.1736 -19.1560 -19.1560 -19.0707 -19.0707 -18.9957 -18.9957 -11.9559 -11.9559 -11.1010 -11.1010 -10.2061 -10.2061 -10.1752 -10.1752 -9.7260 -9.7260 -9.6962 -9.6962 1.2107 1.2107 1.4894 1.4894 1.6436 1.6436 1.8664 1.8664 1.9584 1.9584 2.3400 2.3400 2.4798 2.4798 4.0879 4.0879 4.3983 4.3983 4.9231 4.9231 5.5765 5.5765 5.6593 5.6593 5.7688 5.7688 5.8688 5.8688 5.9634 5.9634 6.5058 6.5058 6.7457 6.7457 6.8711 6.8711 11.8592 11.8592 11.8809 11.8809 11.9465 11.9465 12.0227 12.0227 12.0497 12.0497 12.6781 12.6781 k = 0.1250-0.1105-0.0725 ( 4121 PWs) bands (ev): -40.5912 -40.5912 -40.5768 -40.5768 -19.6559 -19.6559 -19.5534 -19.5534 -19.1732 -19.1732 -19.1548 -19.1548 -19.0719 -19.0719 -18.9970 -18.9970 -11.9433 -11.9433 -11.1105 -11.1105 -10.2030 -10.2030 -10.1664 -10.1664 -9.7373 -9.7373 -9.7025 -9.7025 1.2005 1.2005 1.4875 1.4875 1.6617 1.6617 1.8841 1.8841 1.9894 1.9894 2.3271 2.3271 2.4944 2.4944 4.0486 4.0486 4.4127 4.4127 4.9452 4.9452 5.5932 5.5932 5.6359 5.6359 5.7404 5.7404 5.8693 5.8693 5.9593 5.9593 6.5082 6.5082 6.7140 6.7140 6.8655 6.8655 11.8515 11.8515 11.8812 11.8812 11.9497 11.9497 12.0226 12.0226 12.0484 12.0484 12.6683 12.6683 k = 0.1375-0.1216-0.0798 ( 4119 PWs) bands (ev): -40.5911 -40.5911 -40.5769 -40.5769 -19.6552 -19.6552 -19.5544 -19.5544 -19.1727 -19.1727 -19.1536 -19.1536 -19.0732 -19.0732 -18.9985 -18.9985 -11.9296 -11.9296 -11.1204 -11.1204 -10.1995 -10.1995 -10.1573 -10.1573 -9.7497 -9.7497 -9.7093 -9.7093 1.1910 1.1910 1.4849 1.4849 1.6811 1.6811 1.9038 1.9038 2.0218 2.0218 2.3145 2.3145 2.5099 2.5099 4.0094 4.0094 4.4282 4.4282 4.9659 4.9659 5.6022 5.6022 5.6192 5.6192 5.7055 5.7055 5.8732 5.8732 5.9542 5.9542 6.5106 6.5106 6.6807 6.6807 6.8596 6.8596 11.8423 11.8423 11.8818 11.8818 11.9532 11.9532 12.0238 12.0238 12.0473 12.0473 12.6576 12.6576 k = 0.1500-0.1327-0.0870 ( 4121 PWs) bands (ev): -40.5909 -40.5909 -40.5770 -40.5770 -19.6544 -19.6544 -19.5556 -19.5556 -19.1722 -19.1722 -19.1522 -19.1522 -19.0746 -19.0746 -19.0000 -19.0000 -11.9148 -11.9148 -11.1307 -11.1307 -10.1958 -10.1958 -10.1480 -10.1480 -9.7630 -9.7630 -9.7167 -9.7167 1.1824 1.1824 1.4816 1.4816 1.7014 1.7014 1.9255 1.9255 2.0553 2.0553 2.3027 2.3027 2.5263 2.5263 3.9705 3.9705 4.4446 4.4446 4.9849 4.9849 5.5825 5.5825 5.6293 5.6293 5.6661 5.6661 5.8789 5.8789 5.9486 5.9486 6.5128 6.5128 6.6462 6.6462 6.8538 6.8538 11.8320 11.8320 11.8826 11.8826 11.9570 11.9570 12.0261 12.0261 12.0466 12.0466 12.6459 12.6459 k = 0.1625-0.1437-0.0943 ( 4121 PWs) bands (ev): -40.5908 -40.5908 -40.5771 -40.5771 -19.6535 -19.6535 -19.5568 -19.5568 -19.1716 -19.1716 -19.1507 -19.1507 -19.0761 -19.0761 -19.0017 -19.0017 -11.8990 -11.8990 -11.1412 -11.1412 -10.1918 -10.1918 -10.1387 -10.1387 -9.7770 -9.7770 -9.7246 -9.7246 1.1748 1.1748 1.4775 1.4775 1.7222 1.7222 1.9489 1.9489 2.0895 2.0895 2.2923 2.2923 2.5432 2.5432 3.9323 3.9323 4.4618 4.4618 5.0021 5.0021 5.5578 5.5578 5.6205 5.6205 5.6446 5.6446 5.8857 5.8857 5.9428 5.9428 6.5139 6.5139 6.6116 6.6116 6.8479 6.8479 11.8210 11.8210 11.8838 11.8838 11.9610 11.9610 12.0289 12.0289 12.0464 12.0464 12.6333 12.6333 k = 0.1750-0.1548-0.1015 ( 4117 PWs) bands (ev): -40.5906 -40.5906 -40.5773 -40.5773 -19.6525 -19.6525 -19.5581 -19.5581 -19.1710 -19.1710 -19.1491 -19.1491 -19.0777 -19.0777 -19.0035 -19.0035 -11.8822 -11.8822 -11.1519 -11.1519 -10.1876 -10.1876 -10.1295 -10.1295 -9.7917 -9.7917 -9.7331 -9.7331 1.1684 1.1684 1.4729 1.4729 1.7433 1.7433 1.9739 1.9739 2.1240 2.1240 2.2843 2.2843 2.5607 2.5607 3.8949 3.8949 4.4798 4.4798 5.0173 5.0173 5.5325 5.5325 5.5747 5.5747 5.6545 5.6545 5.8928 5.8928 5.9376 5.9376 6.5120 6.5120 6.5791 6.5791 6.8423 6.8423 11.8097 11.8097 11.8853 11.8853 11.9653 11.9653 12.0317 12.0317 12.0473 12.0473 12.6199 12.6199 k = 0.1875-0.1658-0.1088 ( 4127 PWs) bands (ev): -40.5904 -40.5904 -40.5774 -40.5774 -19.6515 -19.6515 -19.5596 -19.5596 -19.1704 -19.1704 -19.1474 -19.1474 -19.0794 -19.0794 -19.0054 -19.0054 -11.8645 -11.8645 -11.1625 -11.1625 -10.1831 -10.1831 -10.1204 -10.1204 -9.8070 -9.8070 -9.7420 -9.7420 1.1631 1.1631 1.4678 1.4678 1.7640 1.7640 1.9999 1.9999 2.1581 2.1581 2.2797 2.2797 2.5785 2.5785 3.8586 3.8586 4.4984 4.4984 5.0300 5.0300 5.5067 5.5067 5.5267 5.5267 5.6612 5.6612 5.9000 5.9000 5.9336 5.9336 6.5005 6.5005 6.5555 6.5555 6.8370 6.8370 11.7986 11.7986 11.8871 11.8871 11.9698 11.9698 12.0334 12.0334 12.0501 12.0501 12.6057 12.6057 k = 0.2000-0.1769-0.1160 ( 4127 PWs) bands (ev): -40.5902 -40.5902 -40.5776 -40.5776 -19.6504 -19.6504 -19.5610 -19.5610 -19.1696 -19.1696 -19.1456 -19.1456 -19.0812 -19.0812 -19.0074 -19.0074 -11.8459 -11.8459 -11.1732 -11.1732 -10.1785 -10.1785 -10.1116 -10.1116 -9.8227 -9.8227 -9.7515 -9.7515 1.1592 1.1592 1.4621 1.4621 1.7840 1.7840 2.0268 2.0268 2.1903 2.1903 2.2807 2.2807 2.5966 2.5966 3.8237 3.8237 4.5173 4.5173 5.0400 5.0400 5.4712 5.4712 5.4872 5.4872 5.6632 5.6632 5.9070 5.9070 5.9315 5.9315 6.4736 6.4736 6.5468 6.5468 6.8321 6.8321 11.7880 11.7880 11.8893 11.8893 11.9745 11.9745 12.0338 12.0338 12.0549 12.0549 12.5910 12.5910 k = 0.2125-0.1879-0.1233 ( 4133 PWs) bands (ev): -40.5900 -40.5900 -40.5778 -40.5778 -19.6493 -19.6493 -19.5626 -19.5626 -19.1689 -19.1689 -19.1437 -19.1437 -19.0831 -19.0831 -19.0096 -19.0096 -11.8266 -11.8266 -11.1837 -11.1837 -10.1736 -10.1736 -10.1032 -10.1032 -9.8387 -9.8387 -9.7614 -9.7614 1.1566 1.1566 1.4561 1.4561 1.8024 1.8024 2.0541 2.0541 2.2182 2.2182 2.2901 2.2901 2.6149 2.6149 3.7904 3.7904 4.5365 4.5365 5.0465 5.0465 5.4216 5.4216 5.4619 5.4619 5.6598 5.6598 5.9134 5.9134 5.9316 5.9316 6.4381 6.4381 6.5463 6.5463 6.8278 6.8278 11.7783 11.7783 11.8918 11.8918 11.9794 11.9794 12.0333 12.0333 12.0611 12.0611 12.5757 12.5757 k = 0.2250-0.1990-0.1305 ( 4135 PWs) bands (ev): -40.5898 -40.5898 -40.5780 -40.5780 -19.6481 -19.6481 -19.5642 -19.5642 -19.1681 -19.1681 -19.1417 -19.1417 -19.0850 -19.0850 -19.0118 -19.0118 -11.8067 -11.8067 -11.1941 -11.1941 -10.1685 -10.1685 -10.0953 -10.0953 -9.8550 -9.8550 -9.7717 -9.7717 1.1554 1.1554 1.4499 1.4499 1.8189 1.8189 2.0815 2.0815 2.2397 2.2397 2.3107 2.3107 2.6331 2.6331 3.7590 3.7590 4.5557 4.5557 5.0486 5.0486 5.3717 5.3717 5.4390 5.4390 5.6509 5.6509 5.9192 5.9192 5.9335 5.9335 6.3998 6.3998 6.5487 6.5487 6.8241 6.8241 11.7696 11.7696 11.8945 11.8945 11.9845 11.9845 12.0324 12.0324 12.0681 12.0681 12.5602 12.5602 k = 0.2375-0.2100-0.1378 ( 4133 PWs) bands (ev): -40.5896 -40.5896 -40.5782 -40.5782 -19.6468 -19.6468 -19.5659 -19.5659 -19.1672 -19.1672 -19.1396 -19.1396 -19.0870 -19.0870 -19.0141 -19.0141 -11.7861 -11.7861 -11.2042 -11.2042 -10.1633 -10.1633 -10.0878 -10.0878 -9.8713 -9.8713 -9.7825 -9.7825 1.1555 1.1555 1.4434 1.4434 1.8329 1.8329 2.1083 2.1083 2.2577 2.2577 2.3400 2.3400 2.6514 2.6514 3.7294 3.7294 4.5748 4.5748 5.0446 5.0446 5.3248 5.3248 5.4175 5.4175 5.6370 5.6370 5.9244 5.9244 5.9368 5.9368 6.3603 6.3603 6.5522 6.5522 6.8211 6.8211 11.7622 11.7622 11.8975 11.8975 11.9897 11.9897 12.0312 12.0312 12.0757 12.0757 12.5444 12.5444 k = 0.2500-0.2211-0.1450 ( 4137 PWs) bands (ev): -40.5894 -40.5894 -40.5784 -40.5784 -19.6455 -19.6455 -19.5676 -19.5676 -19.1663 -19.1663 -19.1373 -19.1373 -19.0891 -19.0891 -19.0166 -19.0166 -11.7651 -11.7651 -11.2141 -11.2141 -10.1580 -10.1580 -10.0810 -10.0810 -9.8875 -9.8875 -9.7936 -9.7936 1.1569 1.1569 1.4367 1.4367 1.8441 1.8441 2.1342 2.1342 2.2767 2.2767 2.3739 2.3739 2.6695 2.6695 3.7020 3.7020 4.5934 4.5934 5.0319 5.0319 5.2839 5.2839 5.3973 5.3973 5.6188 5.6188 5.9286 5.9286 5.9407 5.9407 6.3204 6.3204 6.5565 6.5565 6.8188 6.8188 11.7562 11.7562 11.9005 11.9005 11.9951 11.9951 12.0298 12.0298 12.0837 12.0837 12.5286 12.5286 k = 0.2625-0.2322-0.1523 ( 4139 PWs) bands (ev): -40.5892 -40.5892 -40.5786 -40.5786 -19.6442 -19.6442 -19.5694 -19.5694 -19.1653 -19.1653 -19.1350 -19.1350 -19.0912 -19.0912 -19.0191 -19.0191 -11.7436 -11.7436 -11.2238 -11.2238 -10.1526 -10.1526 -10.0749 -10.0749 -9.9035 -9.9035 -9.8050 -9.8050 1.1597 1.1597 1.4299 1.4299 1.8526 1.8526 2.1586 2.1586 2.2991 2.2991 2.4098 2.4098 2.6875 2.6875 3.6769 3.6769 4.6113 4.6113 5.0083 5.0083 5.2520 5.2520 5.3785 5.3785 5.5972 5.5972 5.9316 5.9316 5.9445 5.9445 6.2805 6.2805 6.5614 6.5614 6.8173 6.8173 11.7517 11.7517 11.9035 11.9035 12.0006 12.0006 12.0286 12.0286 12.0919 12.0919 12.5129 12.5129 k = 0.2750-0.2432-0.1595 ( 4137 PWs) bands (ev): -40.5889 -40.5889 -40.5788 -40.5788 -19.6427 -19.6427 -19.5713 -19.5713 -19.1642 -19.1642 -19.1326 -19.1326 -19.0933 -19.0933 -19.0217 -19.0217 -11.7219 -11.7219 -11.2331 -11.2331 -10.1472 -10.1472 -10.0695 -10.0695 -9.9192 -9.9192 -9.8167 -9.8167 1.1638 1.1638 1.4231 1.4231 1.8586 1.8586 2.1809 2.1809 2.3257 2.3257 2.4465 2.4465 2.7053 2.7053 3.6541 3.6541 4.6283 4.6283 4.9734 4.9734 5.2300 5.2300 5.3613 5.3613 5.5732 5.5732 5.9331 5.9331 5.9479 5.9479 6.2409 6.2409 6.5668 6.5668 6.8164 6.8164 11.7487 11.7487 11.9062 11.9062 12.0063 12.0063 12.0276 12.0276 12.1003 12.1003 12.4975 12.4975 k = 0.2875-0.2543-0.1668 ( 4136 PWs) bands (ev): -40.5887 -40.5887 -40.5790 -40.5790 -19.6412 -19.6412 -19.5732 -19.5732 -19.1631 -19.1631 -19.1302 -19.1302 -19.0955 -19.0955 -19.0244 -19.0244 -11.7000 -11.7000 -11.2421 -11.2421 -10.1418 -10.1418 -10.0648 -10.0648 -9.9343 -9.9343 -9.8285 -9.8285 1.1689 1.1689 1.4163 1.4163 1.8628 1.8628 2.2007 2.2007 2.3566 2.3566 2.4833 2.4833 2.7230 2.7230 3.6337 3.6337 4.6440 4.6440 4.9294 4.9294 5.2163 5.2163 5.3454 5.3454 5.5478 5.5478 5.9327 5.9327 5.9504 5.9504 6.2019 6.2019 6.5727 6.5727 6.8161 6.8161 11.7471 11.7471 11.9084 11.9084 12.0119 12.0119 12.0271 12.0271 12.1089 12.1089 12.4825 12.4825 k = 0.3000-0.2653-0.1740 ( 4129 PWs) bands (ev): -40.5884 -40.5884 -40.5792 -40.5792 -19.6397 -19.6397 -19.5751 -19.5751 -19.1619 -19.1619 -19.1276 -19.1276 -19.0978 -19.0978 -19.0271 -19.0271 -11.6780 -11.6780 -11.2508 -11.2508 -10.1364 -10.1364 -10.0610 -10.0610 -9.9488 -9.9488 -9.8405 -9.8405 1.1752 1.1752 1.4095 1.4095 1.8656 1.8656 2.2175 2.2175 2.3915 2.3915 2.5200 2.5200 2.7406 2.7406 3.6154 3.6154 4.6581 4.6581 4.8795 4.8795 5.2082 5.2082 5.3307 5.3307 5.5222 5.5222 5.9302 5.9302 5.9517 5.9517 6.1638 6.1638 6.5793 6.5793 6.8163 6.8163 11.7468 11.7468 11.9099 11.9099 12.0173 12.0173 12.0278 12.0278 12.1175 12.1175 12.4681 12.4681 k = 0.3125-0.2764-0.1813 ( 4134 PWs) bands (ev): -40.5882 -40.5882 -40.5795 -40.5795 -19.6381 -19.6381 -19.5771 -19.5771 -19.1607 -19.1607 -19.1250 -19.1250 -19.1001 -19.1001 -19.0300 -19.0300 -11.6560 -11.6560 -11.2593 -11.2593 -10.1312 -10.1312 -10.0580 -10.0580 -9.9624 -9.9624 -9.8525 -9.8525 1.1824 1.1824 1.4028 1.4028 1.8677 1.8677 2.2308 2.2308 2.4298 2.4298 2.5563 2.5563 2.7580 2.7580 3.5993 3.5993 4.6703 4.6703 4.8269 4.8269 5.2032 5.2032 5.3164 5.3164 5.4976 5.4976 5.9255 5.9255 5.9516 5.9516 6.1270 6.1270 6.5865 6.5865 6.8168 6.8168 11.7477 11.7477 11.9102 11.9102 12.0214 12.0214 12.0308 12.0308 12.1262 12.1262 12.4543 12.4543 k = 0.3250-0.2874-0.1885 ( 4126 PWs) bands (ev): -40.5879 -40.5879 -40.5797 -40.5797 -19.6364 -19.6364 -19.5791 -19.5791 -19.1594 -19.1594 -19.1222 -19.1222 -19.1023 -19.1023 -19.0329 -19.0329 -11.6341 -11.6341 -11.2675 -11.2675 -10.1262 -10.1262 -10.0559 -10.0559 -9.9750 -9.9750 -9.8645 -9.8645 1.1905 1.1905 1.3961 1.3961 1.8698 1.8698 2.2403 2.2403 2.4711 2.4711 2.5920 2.5920 2.7752 2.7752 3.5848 3.5848 4.6804 4.6804 4.7737 4.7737 5.1999 5.1999 5.3019 5.3019 5.4758 5.4758 5.9182 5.9182 5.9500 5.9500 6.0919 6.0919 6.5944 6.5944 6.8175 6.8175 11.7497 11.7497 11.9093 11.9093 12.0244 12.0244 12.0360 12.0360 12.1351 12.1351 12.4412 12.4412 k = 0.3375-0.2985-0.1958 ( 4127 PWs) bands (ev): -40.5876 -40.5876 -40.5800 -40.5800 -19.6348 -19.6348 -19.5812 -19.5812 -19.1580 -19.1580 -19.1195 -19.1195 -19.1046 -19.1046 -19.0358 -19.0358 -11.6124 -11.6124 -11.2755 -11.2755 -10.1216 -10.1216 -10.0547 -10.0547 -9.9863 -9.9863 -9.8763 -9.8763 1.1991 1.1991 1.3896 1.3896 1.8722 1.8722 2.2459 2.2459 2.5148 2.5148 2.6271 2.6271 2.7922 2.7922 3.5715 3.5715 4.6878 4.6878 4.7217 4.7217 5.1973 5.1973 5.2861 5.2861 5.4583 5.4583 5.9081 5.9081 5.9470 5.9470 6.0591 6.0591 6.6031 6.6031 6.8180 6.8180 11.7525 11.7525 11.9070 11.9070 12.0275 12.0275 12.0426 12.0426 12.1441 12.1441 12.4288 12.4288 k = 0.3500-0.3095-0.2030 ( 4133 PWs) bands (ev): -40.5873 -40.5873 -40.5802 -40.5802 -19.6330 -19.6330 -19.5833 -19.5833 -19.1566 -19.1566 -19.1168 -19.1168 -19.1068 -19.1068 -19.0389 -19.0389 -11.5911 -11.5911 -11.2833 -11.2833 -10.1174 -10.1174 -10.0544 -10.0544 -9.9962 -9.9962 -9.8880 -9.8880 1.2083 1.2083 1.3831 1.3831 1.8756 1.8756 2.2473 2.2473 2.5603 2.5603 2.6615 2.6615 2.8088 2.8088 3.5588 3.5588 4.6713 4.6713 4.6934 4.6934 5.1946 5.1946 5.2681 5.2681 5.4465 5.4465 5.8950 5.8950 5.9427 5.9427 6.0290 6.0290 6.6124 6.6124 6.8183 6.8183 11.7561 11.7561 11.9033 11.9033 12.0312 12.0312 12.0496 12.0496 12.1532 12.1532 12.4171 12.4171 k = 0.3625-0.3206-0.2103 ( 4131 PWs) bands (ev): -40.5870 -40.5870 -40.5805 -40.5805 -19.6312 -19.6312 -19.5855 -19.5855 -19.1552 -19.1552 -19.1143 -19.1143 -19.1087 -19.1087 -19.0420 -19.0420 -11.5702 -11.5702 -11.2909 -11.2909 -10.1138 -10.1138 -10.0551 -10.0551 -10.0044 -10.0044 -9.8993 -9.8993 1.2179 1.2179 1.3768 1.3768 1.8802 1.8802 2.2447 2.2447 2.6069 2.6069 2.6954 2.6954 2.8249 2.8249 3.5460 3.5460 4.6255 4.6255 4.6950 4.6950 5.1916 5.1916 5.2479 5.2479 5.4411 5.4411 5.8788 5.8788 5.9372 5.9372 6.0021 6.0021 6.6225 6.6225 6.8182 6.8182 11.7602 11.7602 11.8984 11.8984 12.0357 12.0357 12.0568 12.0568 12.1627 12.1627 12.4061 12.4061 k = 0.3750-0.3316-0.2175 ( 4136 PWs) bands (ev): -40.5868 -40.5868 -40.5808 -40.5808 -19.6294 -19.6294 -19.5876 -19.5876 -19.1536 -19.1536 -19.1134 -19.1134 -19.1090 -19.1090 -19.0451 -19.0451 -11.5498 -11.5498 -11.2986 -11.2986 -10.1109 -10.1109 -10.0566 -10.0566 -10.0108 -10.0108 -9.9102 -9.9102 1.2276 1.2276 1.3707 1.3707 1.8862 1.8862 2.2383 2.2383 2.6536 2.6536 2.7294 2.7294 2.8401 2.8401 3.5321 3.5321 4.5843 4.5843 4.6937 4.6937 5.1879 5.1879 5.2262 5.2262 5.4418 5.4418 5.8596 5.8596 5.9307 5.9307 5.9786 5.9786 6.6333 6.6333 6.8174 6.8174 11.7646 11.7646 11.8923 11.8923 12.0408 12.0408 12.0638 12.0638 12.1725 12.1725 12.3955 12.3955 k = 0.3875-0.3427-0.2248 ( 4137 PWs) bands (ev): -40.5865 -40.5865 -40.5811 -40.5811 -19.6276 -19.6276 -19.5898 -19.5898 -19.1520 -19.1520 -19.1150 -19.1150 -19.1068 -19.1068 -19.0483 -19.0483 -11.5300 -11.5300 -11.3062 -11.3062 -10.1089 -10.1089 -10.0589 -10.0589 -10.0152 -10.0152 -9.9206 -9.9206 1.2373 1.2373 1.3646 1.3646 1.8941 1.8941 2.2283 2.2283 2.6987 2.6987 2.7645 2.7645 2.8544 2.8544 3.5162 3.5162 4.5487 4.5487 4.6892 4.6892 5.1833 5.1833 5.2043 5.2043 5.4479 5.4479 5.8381 5.8381 5.9235 5.9235 5.9581 5.9581 6.6447 6.6447 6.8159 6.8159 11.7693 11.7693 11.8855 11.8855 12.0465 12.0465 12.0706 12.0706 12.1828 12.1828 12.3854 12.3854 k = 0.4000-0.3538-0.2320 ( 4137 PWs) bands (ev): -40.5862 -40.5862 -40.5813 -40.5813 -19.6257 -19.6257 -19.5919 -19.5919 -19.1504 -19.1504 -19.1171 -19.1171 -19.1039 -19.1039 -19.0515 -19.0515 -11.5109 -11.5109 -11.3139 -11.3139 -10.1075 -10.1075 -10.0619 -10.0619 -10.0176 -10.0176 -9.9305 -9.9305 1.2469 1.2469 1.3586 1.3586 1.9038 1.9038 2.2151 2.2151 2.7395 2.7395 2.8031 2.8031 2.8673 2.8673 3.4975 3.4975 4.5197 4.5197 4.6813 4.6813 5.1769 5.1769 5.1843 5.1843 5.4585 5.4585 5.8151 5.8151 5.9159 5.9159 5.9403 5.9403 6.6567 6.6567 6.8134 6.8134 11.7742 11.7742 11.8780 11.8780 12.0524 12.0524 12.0767 12.0767 12.1937 12.1937 12.3756 12.3756 k = 0.4125-0.3648-0.2393 ( 4136 PWs) bands (ev): -40.5859 -40.5859 -40.5816 -40.5816 -19.6237 -19.6237 -19.5941 -19.5941 -19.1486 -19.1486 -19.1194 -19.1194 -19.1008 -19.1008 -19.0547 -19.0547 -11.4926 -11.4926 -11.3218 -11.3218 -10.1067 -10.1067 -10.0656 -10.0656 -10.0182 -10.0182 -9.9398 -9.9398 1.2563 1.2563 1.3528 1.3528 1.9155 1.9155 2.1992 2.1992 2.7740 2.7740 2.8468 2.8468 2.8788 2.8788 3.4752 3.4752 4.4978 4.4978 4.6699 4.6699 5.1629 5.1629 5.1732 5.1732 5.4726 5.4726 5.7912 5.7912 5.9080 5.9080 5.9247 5.9247 6.6690 6.6690 6.8099 6.8099 11.7791 11.7791 11.8702 11.8702 12.0585 12.0585 12.0821 12.0821 12.2051 12.2051 12.3659 12.3659 k = 0.4250-0.3759-0.2465 ( 4134 PWs) bands (ev): -40.5856 -40.5856 -40.5819 -40.5819 -19.6218 -19.6218 -19.5963 -19.5963 -19.1468 -19.1468 -19.1217 -19.1217 -19.0977 -19.0977 -19.0580 -19.0580 -11.4750 -11.4750 -11.3299 -11.3299 -10.1062 -10.1062 -10.0698 -10.0698 -10.0172 -10.0172 -9.9486 -9.9486 1.2654 1.2654 1.3470 1.3470 1.9292 1.9292 2.1809 2.1809 2.8024 2.8024 2.8863 2.8863 2.8971 2.8971 3.4487 3.4487 4.4833 4.4833 4.6552 4.6552 5.1473 5.1473 5.1658 5.1658 5.4896 5.4896 5.7671 5.7671 5.9003 5.9003 5.9110 5.9110 6.6816 6.6816 6.8053 6.8053 11.7842 11.7842 11.8623 11.8623 12.0645 12.0645 12.0866 12.0866 12.2170 12.2170 12.3563 12.3563 k = 0.4375-0.3869-0.2538 ( 4130 PWs) bands (ev): -40.5853 -40.5853 -40.5822 -40.5822 -19.6198 -19.6198 -19.5985 -19.5985 -19.1450 -19.1450 -19.1239 -19.1239 -19.0945 -19.0945 -19.0613 -19.0613 -11.4584 -11.4584 -11.3383 -11.3383 -10.1057 -10.1057 -10.0743 -10.0743 -10.0149 -10.0149 -9.9568 -9.9568 1.2740 1.2740 1.3412 1.3412 1.9448 1.9448 2.1607 2.1607 2.8260 2.8260 2.8949 2.8949 2.9470 2.9470 3.4179 3.4179 4.4761 4.4761 4.6375 4.6375 5.1349 5.1349 5.1582 5.1582 5.5088 5.5088 5.7429 5.7429 5.8930 5.8930 5.8994 5.8994 6.6945 6.6945 6.7996 6.7996 11.7894 11.7894 11.8543 11.8543 12.0703 12.0703 12.0901 12.0901 12.2293 12.2293 12.3464 12.3464 k = 0.4500-0.3980-0.2610 ( 4127 PWs) bands (ev): -40.5850 -40.5850 -40.5825 -40.5825 -19.6177 -19.6177 -19.6006 -19.6006 -19.1431 -19.1431 -19.1262 -19.1262 -19.0912 -19.0912 -19.0646 -19.0646 -11.4426 -11.4426 -11.3472 -11.3472 -10.1050 -10.1050 -10.0791 -10.0791 -10.0115 -10.0115 -9.9646 -9.9646 1.2823 1.2823 1.3354 1.3354 1.9623 1.9623 2.1391 2.1391 2.8460 2.8460 2.9001 2.9001 2.9992 2.9992 3.3827 3.3827 4.4759 4.4759 4.6174 4.6174 5.1260 5.1260 5.1502 5.1502 5.5297 5.5297 5.7188 5.7188 5.8863 5.8863 5.8898 5.8898 6.7073 6.7073 6.7929 6.7929 11.7947 11.7947 11.8465 11.8465 12.0757 12.0757 12.0924 12.0924 12.2419 12.2419 12.3364 12.3364 k = 0.4625-0.4090-0.2683 ( 4135 PWs) bands (ev): -40.5847 -40.5847 -40.5828 -40.5828 -19.6157 -19.6157 -19.6028 -19.6028 -19.1412 -19.1412 -19.1285 -19.1285 -19.0879 -19.0879 -19.0680 -19.0680 -11.4278 -11.4278 -11.3566 -11.3566 -10.1038 -10.1038 -10.0838 -10.0838 -10.0073 -10.0073 -9.9719 -9.9719 1.2901 1.2901 1.3295 1.3295 1.9815 1.9815 2.1164 2.1164 2.8627 2.8627 2.9029 2.9029 3.0519 3.0519 3.3434 3.3434 4.4820 4.4820 4.5955 4.5955 5.1206 5.1206 5.1423 5.1423 5.5519 5.5519 5.6947 5.6947 5.8806 5.8806 5.8822 5.8822 6.7200 6.7200 6.7850 6.7850 11.8001 11.8001 11.8389 11.8389 12.0806 12.0806 12.0937 12.0937 12.2546 12.2546 12.3259 12.3259 k = 0.4750-0.4201-0.2755 ( 4144 PWs) bands (ev): -40.5843 -40.5843 -40.5831 -40.5831 -19.6136 -19.6136 -19.6050 -19.6050 -19.1392 -19.1392 -19.1307 -19.1307 -19.0847 -19.0847 -19.0713 -19.0713 -11.4139 -11.4139 -11.3666 -11.3666 -10.1020 -10.1020 -10.0884 -10.0884 -10.0025 -10.0025 -9.9787 -9.9787 1.2974 1.2974 1.3236 1.3236 2.0020 2.0020 2.0932 2.0932 2.8764 2.8764 2.9030 2.9030 3.1043 3.1043 3.3006 3.3006 4.4934 4.4934 4.5727 4.5727 5.1186 5.1186 5.1347 5.1347 5.5749 5.5749 5.6706 5.6706 5.8761 5.8761 5.8769 5.8769 6.7323 6.7323 6.7761 6.7761 11.8058 11.8058 11.8316 11.8316 12.0848 12.0848 12.0938 12.0938 12.2673 12.2673 12.3151 12.3151 k = 0.4875-0.4311-0.2828 ( 4140 PWs) bands (ev): -40.5840 -40.5840 -40.5834 -40.5834 -19.6115 -19.6115 -19.6072 -19.6072 -19.1371 -19.1371 -19.1329 -19.1329 -19.0813 -19.0813 -19.0746 -19.0746 -11.4008 -11.4008 -11.3772 -11.3772 -10.0995 -10.0995 -10.0926 -10.0926 -9.9971 -9.9971 -9.9852 -9.9852 1.3044 1.3044 1.3174 1.3174 2.0238 2.0238 2.0697 2.0697 2.8873 2.8873 2.9005 2.9005 3.1560 3.1560 3.2547 3.2547 4.5094 4.5094 4.5501 4.5501 5.1195 5.1195 5.1281 5.1281 5.5985 5.5985 5.6465 5.6465 5.8733 5.8733 5.8737 5.8737 6.7443 6.7443 6.7663 6.7663 11.8118 11.8118 11.8246 11.8246 12.0884 12.0884 12.0930 12.0930 12.2798 12.2798 12.3038 12.3038 k = 0.5000-0.4422-0.2900 ( 4142 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6094 -19.6094 -19.6094 -19.6094 -19.1350 -19.1350 -19.1350 -19.1350 -19.0780 -19.0780 -19.0780 -19.0780 -11.3886 -11.3886 -11.3886 -11.3886 -10.0964 -10.0964 -10.0964 -10.0964 -9.9914 -9.9914 -9.9914 -9.9914 1.3111 1.3111 1.3111 1.3111 2.0465 2.0465 2.0465 2.0465 2.8953 2.8953 2.8953 2.8953 3.2063 3.2063 3.2063 3.2063 4.5286 4.5286 4.5286 4.5286 5.1228 5.1228 5.1229 5.1229 5.6225 5.6225 5.6225 5.6225 5.8725 5.8725 5.8725 5.8725 6.7556 6.7556 6.7557 6.7557 11.8180 11.8180 11.8180 11.8180 12.0911 12.0911 12.0911 12.0911 12.2920 12.2920 12.2920 12.2920 k = 0.5000-0.4422-0.2900 ( 4142 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6094 -19.6094 -19.6094 -19.6094 -19.1350 -19.1350 -19.1350 -19.1350 -19.0780 -19.0780 -19.0780 -19.0780 -11.3886 -11.3886 -11.3886 -11.3886 -10.0964 -10.0964 -10.0964 -10.0964 -9.9914 -9.9914 -9.9914 -9.9914 1.3111 1.3111 1.3111 1.3111 2.0465 2.0465 2.0465 2.0465 2.8953 2.8953 2.8953 2.8953 3.2063 3.2063 3.2063 3.2063 4.5286 4.5286 4.5286 4.5286 5.1228 5.1228 5.1229 5.1229 5.6225 5.6225 5.6225 5.6225 5.8725 5.8725 5.8725 5.8725 6.7556 6.7556 6.7557 6.7557 11.8180 11.8180 11.8180 11.8180 12.0911 12.0911 12.0911 12.0911 12.2920 12.2920 12.2920 12.2920 k = 0.5000-0.4323-0.3051 ( 4136 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6100 -19.6100 -19.6088 -19.6088 -19.1352 -19.1352 -19.1350 -19.1350 -19.0784 -19.0784 -19.0773 -19.0773 -11.3885 -11.3885 -11.3884 -11.3884 -10.0977 -10.0977 -10.0969 -10.0969 -9.9909 -9.9909 -9.9904 -9.9904 1.3115 1.3115 1.3116 1.3116 2.0464 2.0464 2.0466 2.0466 2.8947 2.8947 2.8948 2.8948 3.2067 3.2067 3.2071 3.2071 4.5290 4.5290 4.5297 4.5297 5.1201 5.1201 5.1204 5.1204 5.6202 5.6202 5.6223 5.6223 5.8740 5.8740 5.8759 5.8759 6.7560 6.7560 6.7561 6.7561 11.8177 11.8177 11.8182 11.8182 12.0880 12.0880 12.0891 12.0891 12.2925 12.2925 12.2943 12.2943 k = 0.5000-0.4224-0.3202 ( 4132 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6106 -19.6106 -19.6082 -19.6082 -19.1356 -19.1356 -19.1351 -19.1351 -19.0786 -19.0786 -19.0764 -19.0764 -11.3880 -11.3880 -11.3879 -11.3879 -10.1007 -10.1007 -10.0992 -10.0992 -9.9890 -9.9890 -9.9881 -9.9881 1.3129 1.3129 1.3132 1.3132 2.0464 2.0464 2.0469 2.0469 2.8929 2.8929 2.8930 2.8930 3.2084 3.2084 3.2092 3.2092 4.5309 4.5309 4.5322 4.5322 5.1122 5.1122 5.1128 5.1128 5.6157 5.6157 5.6196 5.6196 5.8802 5.8802 5.8838 5.8838 6.7572 6.7572 6.7573 6.7573 11.8173 11.8173 11.8182 11.8182 12.0802 12.0802 12.0822 12.0822 12.2957 12.2957 12.2991 12.2991 k = 0.5000-0.4125-0.3353 ( 4124 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6113 -19.6113 -19.6077 -19.6077 -19.1362 -19.1362 -19.1354 -19.1354 -19.0786 -19.0786 -19.0753 -19.0753 -11.3871 -11.3871 -11.3871 -11.3871 -10.1052 -10.1052 -10.1031 -10.1031 -9.9859 -9.9859 -9.9847 -9.9847 1.3153 1.3153 1.3157 1.3157 2.0465 2.0465 2.0472 2.0472 2.8899 2.8899 2.8901 2.8901 3.2114 3.2114 3.2126 3.2126 4.5342 4.5342 4.5361 4.5361 5.0997 5.0997 5.1005 5.1005 5.6091 5.6091 5.6145 5.6145 5.8908 5.8908 5.8958 5.8958 6.7591 6.7591 6.7592 6.7592 11.8167 11.8167 11.8181 11.8181 12.0683 12.0683 12.0711 12.0711 12.3009 12.3009 12.3057 12.3057 k = 0.5000-0.4026-0.3504 ( 4126 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6121 -19.6121 -19.6072 -19.6072 -19.1370 -19.1370 -19.1360 -19.1360 -19.0784 -19.0784 -19.0740 -19.0740 -11.3860 -11.3860 -11.3860 -11.3860 -10.1109 -10.1109 -10.1083 -10.1083 -9.9819 -9.9819 -9.9806 -9.9806 1.3186 1.3186 1.3190 1.3190 2.0467 2.0467 2.0475 2.0475 2.8858 2.8858 2.8860 2.8860 3.2157 3.2157 3.2172 3.2172 4.5388 4.5388 4.5413 4.5413 5.0832 5.0832 5.0842 5.0842 5.6005 5.6005 5.6070 5.6070 5.9050 5.9050 5.9110 5.9110 6.7618 6.7618 6.7619 6.7619 11.8159 11.8159 11.8178 11.8178 12.0533 12.0533 12.0565 12.0565 12.3074 12.3074 12.3133 12.3133 k = 0.5000-0.3927-0.3655 ( 4130 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6129 -19.6129 -19.6069 -19.6069 -19.1380 -19.1380 -19.1366 -19.1366 -19.0780 -19.0780 -19.0725 -19.0725 -11.3846 -11.3846 -11.3845 -11.3845 -10.1175 -10.1175 -10.1146 -10.1146 -9.9773 -9.9773 -9.9758 -9.9758 1.3227 1.3227 1.3233 1.3233 2.0470 2.0470 2.0480 2.0480 2.8806 2.8806 2.8808 2.8808 3.2212 3.2212 3.2231 3.2231 4.5446 4.5446 4.5477 4.5477 5.0633 5.0633 5.0645 5.0645 5.5901 5.5901 5.5973 5.5973 5.9221 5.9221 5.9288 5.9288 6.7651 6.7651 6.7653 6.7653 11.8149 11.8149 11.8172 11.8172 12.0359 12.0359 12.0394 12.0394 12.3146 12.3146 12.3214 12.3214 k = 0.5000-0.3828-0.3806 ( 4128 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6137 -19.6137 -19.6065 -19.6065 -19.1391 -19.1391 -19.1374 -19.1374 -19.0774 -19.0774 -19.0709 -19.0709 -11.3829 -11.3829 -11.3828 -11.3828 -10.1248 -10.1248 -10.1215 -10.1215 -9.9722 -9.9722 -9.9708 -9.9708 1.3277 1.3277 1.3284 1.3284 2.0474 2.0474 2.0487 2.0487 2.8743 2.8743 2.8746 2.8746 3.2280 3.2280 3.2302 3.2302 4.5514 4.5514 4.5551 4.5551 5.0410 5.0410 5.0424 5.0424 5.5780 5.5780 5.5857 5.5857 5.9413 5.9413 5.9484 5.9484 6.7691 6.7691 6.7693 6.7693 11.8137 11.8137 11.8165 11.8165 12.0170 12.0170 12.0206 12.0206 12.3218 12.3218 12.3295 12.3295 k = 0.5000-0.3729-0.3957 ( 4128 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6145 -19.6145 -19.6062 -19.6062 -19.1403 -19.1403 -19.1383 -19.1383 -19.0766 -19.0766 -19.0691 -19.0691 -11.3809 -11.3809 -11.3808 -11.3808 -10.1325 -10.1325 -10.1290 -10.1290 -9.9669 -9.9669 -9.9656 -9.9656 1.3334 1.3334 1.3342 1.3342 2.0481 2.0481 2.0495 2.0495 2.8669 2.8669 2.8673 2.8673 3.2360 3.2360 3.2386 3.2386 4.5590 4.5590 4.5633 4.5633 5.0171 5.0171 5.0187 5.0187 5.5643 5.5643 5.5723 5.5723 5.9618 5.9618 5.9691 5.9691 6.7736 6.7736 6.7739 6.7739 11.8121 11.8121 11.8154 11.8154 11.9970 11.9970 12.0007 12.0007 12.3288 12.3288 12.3371 12.3371 k = 0.5000-0.3630-0.4108 ( 4128 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6153 -19.6153 -19.6059 -19.6059 -19.1416 -19.1416 -19.1393 -19.1393 -19.0757 -19.0757 -19.0673 -19.0673 -11.3787 -11.3787 -11.3786 -11.3786 -10.1405 -10.1405 -10.1369 -10.1369 -9.9615 -9.9615 -9.9604 -9.9604 1.3397 1.3397 1.3405 1.3405 2.0490 2.0490 2.0505 2.0505 2.8586 2.8586 2.8590 2.8590 3.2452 3.2452 3.2481 3.2481 4.5671 4.5671 4.5718 4.5718 4.9924 4.9924 4.9941 4.9941 5.5492 5.5492 5.5572 5.5572 5.9829 5.9829 5.9902 5.9902 6.7787 6.7787 6.7789 6.7789 11.8101 11.8101 11.8138 11.8138 11.9767 11.9767 11.9804 11.9804 12.3352 12.3352 12.3441 12.3441 k = 0.5000-0.3531-0.4259 ( 4122 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6162 -19.6162 -19.6057 -19.6057 -19.1429 -19.1429 -19.1403 -19.1403 -19.0747 -19.0747 -19.0654 -19.0654 -11.3763 -11.3763 -11.3762 -11.3762 -10.1486 -10.1486 -10.1449 -10.1449 -9.9562 -9.9562 -9.9553 -9.9553 1.3466 1.3466 1.3475 1.3475 2.0502 2.0502 2.0519 2.0519 2.8493 2.8493 2.8498 2.8498 3.2555 3.2555 3.2588 3.2588 4.5752 4.5752 4.5804 4.5804 4.9678 4.9678 4.9698 4.9698 5.5327 5.5327 5.5408 5.5408 6.0040 6.0040 6.0113 6.0113 6.7841 6.7841 6.7844 6.7844 11.8072 11.8072 11.8114 11.8114 11.9567 11.9567 11.9603 11.9603 12.3409 12.3409 12.3503 12.3503 k = 0.5000-0.3432-0.4410 ( 4122 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6171 -19.6171 -19.6055 -19.6055 -19.1443 -19.1443 -19.1414 -19.1414 -19.0737 -19.0737 -19.0634 -19.0634 -11.3737 -11.3737 -11.3736 -11.3736 -10.1568 -10.1568 -10.1530 -10.1530 -9.9511 -9.9511 -9.9504 -9.9504 1.3538 1.3538 1.3547 1.3547 2.0518 2.0518 2.0536 2.0536 2.8392 2.8392 2.8397 2.8397 3.2670 3.2670 3.2706 3.2706 4.5827 4.5827 4.5884 4.5884 4.9443 4.9443 4.9465 4.9465 5.5150 5.5150 5.5230 5.5230 6.0246 6.0246 6.0317 6.0317 6.7899 6.7899 6.7901 6.7901 11.8033 11.8033 11.8079 11.8079 11.9378 11.9378 11.9412 11.9412 12.3457 12.3457 12.3557 12.3557 k = 0.5000-0.3333-0.4560 ( 4122 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6180 -19.6180 -19.6054 -19.6054 -19.1457 -19.1457 -19.1425 -19.1425 -19.0726 -19.0726 -19.0614 -19.0614 -11.3710 -11.3710 -11.3709 -11.3709 -10.1649 -10.1649 -10.1611 -10.1611 -9.9461 -9.9461 -9.9457 -9.9457 1.3613 1.3613 1.3622 1.3622 2.0538 2.0538 2.0557 2.0557 2.8282 2.8282 2.8287 2.8287 3.2796 3.2796 3.2834 3.2834 4.5889 4.5889 4.5950 4.5950 4.9229 4.9229 4.9254 4.9254 5.4964 5.4964 5.5043 5.5043 6.0441 6.0441 6.0511 6.0511 6.7959 6.7959 6.7961 6.7961 11.7977 11.7977 11.8027 11.8027 11.9207 11.9207 11.9241 11.9241 12.3497 12.3497 12.3601 12.3601 k = 0.5000-0.3234-0.4711 ( 4122 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6189 -19.6189 -19.6053 -19.6053 -19.1471 -19.1471 -19.1437 -19.1437 -19.0714 -19.0714 -19.0593 -19.0593 -11.3682 -11.3682 -11.3680 -11.3680 -10.1728 -10.1728 -10.1690 -10.1690 -9.9414 -9.9414 -9.9413 -9.9413 1.3689 1.3689 1.3698 1.3698 2.0564 2.0564 2.0583 2.0583 2.8165 2.8165 2.8170 2.8170 3.2932 3.2932 3.2973 3.2973 4.5930 4.5930 4.5993 4.5993 4.9047 4.9047 4.9076 4.9076 5.4769 5.4769 5.4847 5.4847 6.0623 6.0623 6.0691 6.0691 6.8020 6.8020 6.8023 6.8023 11.7898 11.7898 11.7951 11.7951 11.9063 11.9063 11.9098 11.9098 12.3529 12.3529 12.3637 12.3637 k = 0.5000-0.3135-0.4862 ( 4124 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6198 -19.6198 -19.6052 -19.6052 -19.1485 -19.1485 -19.1448 -19.1448 -19.0702 -19.0702 -19.0573 -19.0573 -11.3654 -11.3654 -11.3652 -11.3652 -10.1804 -10.1804 -10.1768 -10.1768 -9.9372 -9.9372 -9.9369 -9.9369 1.3764 1.3764 1.3773 1.3773 2.0596 2.0596 2.0616 2.0616 2.8040 2.8040 2.8046 2.8046 3.3078 3.3078 3.3122 3.3122 4.5940 4.5940 4.6004 4.6004 4.8909 4.8909 4.8943 4.8943 5.4568 5.4568 5.4645 5.4645 6.0788 6.0788 6.0854 6.0854 6.8081 6.8081 6.8084 6.8084 11.7794 11.7794 11.7847 11.7847 11.8954 11.8954 11.8991 11.8991 12.3552 12.3552 12.3664 12.3664 k = 0.5000-0.3036-0.5013 ( 4126 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6207 -19.6207 -19.6052 -19.6052 -19.1499 -19.1499 -19.1460 -19.1460 -19.0689 -19.0689 -19.0553 -19.0553 -11.3626 -11.3626 -11.3623 -11.3623 -10.1878 -10.1878 -10.1842 -10.1842 -9.9334 -9.9334 -9.9328 -9.9328 1.3837 1.3837 1.3845 1.3845 2.0636 2.0636 2.0656 2.0656 2.7908 2.7908 2.7914 2.7914 3.3233 3.3233 3.3279 3.3279 4.5910 4.5910 4.5974 4.5974 4.8824 4.8824 4.8864 4.8864 5.4363 5.4363 5.4439 5.4439 6.0934 6.0934 6.0997 6.0997 6.8142 6.8142 6.8145 6.8145 11.7663 11.7663 11.7716 11.7716 11.8881 11.8881 11.8921 11.8921 12.3567 12.3567 12.3682 12.3682 k = 0.5000-0.2937-0.5164 ( 4128 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6216 -19.6216 -19.6052 -19.6052 -19.1513 -19.1513 -19.1471 -19.1471 -19.0677 -19.0677 -19.0533 -19.0533 -11.3598 -11.3598 -11.3595 -11.3595 -10.1948 -10.1948 -10.1912 -10.1912 -9.9300 -9.9300 -9.9290 -9.9290 1.3905 1.3905 1.3913 1.3913 2.0684 2.0684 2.0704 2.0704 2.7771 2.7771 2.7776 2.7776 3.3395 3.3395 3.3443 3.3443 4.5837 4.5837 4.5899 4.5899 4.8797 4.8797 4.8844 4.8844 5.4157 5.4157 5.4232 5.4232 6.1059 6.1059 6.1120 6.1120 6.8200 6.8200 6.8203 6.8203 11.7511 11.7511 11.7563 11.7563 11.8842 11.8842 11.8885 11.8885 12.3575 12.3575 12.3693 12.3693 k = 0.5000-0.2838-0.5315 ( 4128 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6224 -19.6224 -19.6052 -19.6052 -19.1526 -19.1526 -19.1482 -19.1482 -19.0665 -19.0665 -19.0513 -19.0513 -11.3571 -11.3571 -11.3568 -11.3568 -10.2013 -10.2013 -10.1979 -10.1979 -9.9269 -9.9269 -9.9255 -9.9255 1.3968 1.3968 1.3976 1.3976 2.0743 2.0743 2.0762 2.0762 2.7628 2.7628 2.7633 2.7633 3.3563 3.3563 3.3614 3.3614 4.5722 4.5722 4.5783 4.5783 4.8828 4.8828 4.8882 4.8882 5.3953 5.3953 5.4026 5.4026 6.1160 6.1160 6.1219 6.1219 6.8254 6.8254 6.8258 6.8258 11.7346 11.7346 11.7396 11.7396 11.8830 11.8830 11.8878 11.8878 12.3576 12.3576 12.3697 12.3697 k = 0.5000-0.2739-0.5466 ( 4130 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6233 -19.6233 -19.6053 -19.6053 -19.1539 -19.1539 -19.1493 -19.1493 -19.0653 -19.0653 -19.0494 -19.0494 -11.3545 -11.3545 -11.3542 -11.3542 -10.2072 -10.2072 -10.2040 -10.2040 -9.9242 -9.9242 -9.9224 -9.9224 1.4024 1.4024 1.4030 1.4030 2.0812 2.0812 2.0830 2.0830 2.7480 2.7480 2.7484 2.7484 3.3736 3.3736 3.3789 3.3789 4.5572 4.5572 4.5631 4.5631 4.8909 4.8909 4.8970 4.8970 5.3753 5.3753 5.3824 5.3824 6.1237 6.1237 6.1294 6.1294 6.8305 6.8305 6.8309 6.8309 11.7175 11.7175 11.7223 11.7223 11.8840 11.8840 11.8892 11.8892 12.3571 12.3571 12.3695 12.3695 k = 0.5000-0.2640-0.5617 ( 4130 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6241 -19.6241 -19.6054 -19.6054 -19.1551 -19.1551 -19.1503 -19.1503 -19.0641 -19.0641 -19.0475 -19.0475 -11.3522 -11.3522 -11.3518 -11.3518 -10.2127 -10.2127 -10.2095 -10.2095 -9.9218 -9.9218 -9.9196 -9.9196 1.4071 1.4071 1.4076 1.4076 2.0892 2.0892 2.0910 2.0910 2.7327 2.7327 2.7331 2.7331 3.3912 3.3912 3.3967 3.3967 4.5397 4.5397 4.5454 4.5454 4.9032 4.9032 4.9099 4.9099 5.3560 5.3560 5.3630 5.3630 6.1289 6.1289 6.1344 6.1344 6.8349 6.8349 6.8355 6.8355 11.7005 11.7005 11.7050 11.7050 11.8868 11.8868 11.8925 11.8925 12.3560 12.3560 12.3687 12.3687 k = 0.5000-0.2541-0.5768 ( 4136 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6249 -19.6249 -19.6055 -19.6055 -19.1562 -19.1562 -19.1513 -19.1513 -19.0629 -19.0629 -19.0457 -19.0457 -11.3501 -11.3501 -11.3497 -11.3497 -10.2175 -10.2175 -10.2145 -10.2145 -9.9198 -9.9198 -9.9172 -9.9172 1.4108 1.4108 1.4111 1.4111 2.0985 2.0985 2.1002 2.1002 2.7170 2.7170 2.7174 2.7174 3.4089 3.4089 3.4146 3.4146 4.5206 4.5206 4.5262 4.5262 4.9187 4.9187 4.9259 4.9259 5.3378 5.3378 5.3446 5.3446 6.1316 6.1316 6.1370 6.1370 6.8387 6.8387 6.8394 6.8394 11.6838 11.6838 11.6882 11.6882 11.8910 11.8910 11.8971 11.8971 12.3545 12.3545 12.3674 12.3674 k = 0.5000-0.2442-0.5919 ( 4140 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6256 -19.6256 -19.6056 -19.6056 -19.1573 -19.1573 -19.1522 -19.1522 -19.0618 -19.0618 -19.0440 -19.0440 -11.3482 -11.3482 -11.3478 -11.3478 -10.2216 -10.2216 -10.2187 -10.2187 -9.9182 -9.9182 -9.9151 -9.9151 1.4133 1.4133 1.4135 1.4135 2.1090 2.1090 2.1105 2.1105 2.7010 2.7010 2.7013 2.7013 3.4263 3.4263 3.4322 3.4322 4.5007 4.5007 4.5061 4.5061 4.9367 4.9367 4.9443 4.9443 5.3210 5.3210 5.3275 5.3275 6.1317 6.1317 6.1370 6.1370 6.8417 6.8417 6.8426 6.8426 11.6679 11.6679 11.6721 11.6721 11.8966 11.8966 11.9030 11.9030 12.3526 12.3526 12.3657 12.3657 k = 0.5000-0.2343-0.6070 ( 4140 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6263 -19.6263 -19.6057 -19.6057 -19.1583 -19.1583 -19.1530 -19.1530 -19.0608 -19.0608 -19.0424 -19.0424 -11.3467 -11.3467 -11.3462 -11.3462 -10.2250 -10.2250 -10.2223 -10.2223 -9.9168 -9.9168 -9.9134 -9.9134 1.4147 1.4147 1.4147 1.4147 2.1208 2.1208 2.1222 2.1222 2.6847 2.6847 2.6849 2.6849 3.4433 3.4433 3.4494 3.4494 4.4807 4.4807 4.4860 4.4860 4.9564 4.9564 4.9643 4.9643 5.3059 5.3059 5.3120 5.3120 6.1294 6.1294 6.1345 6.1345 6.8439 6.8439 6.8449 6.8449 11.6529 11.6529 11.6570 11.6570 11.9032 11.9032 11.9099 11.9099 12.3503 12.3503 12.3636 12.3636 k = 0.5000-0.2244-0.6221 ( 4146 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6270 -19.6270 -19.6058 -19.6058 -19.1592 -19.1592 -19.1539 -19.1539 -19.0598 -19.0598 -19.0409 -19.0409 -11.3456 -11.3456 -11.3450 -11.3450 -10.2277 -10.2277 -10.2252 -10.2252 -9.9158 -9.9158 -9.9120 -9.9120 1.4146 1.4146 1.4147 1.4147 2.1338 2.1338 2.1350 2.1350 2.6682 2.6682 2.6683 2.6683 3.4595 3.4595 3.4656 3.4656 4.4613 4.4613 4.4665 4.4665 4.9772 4.9772 4.9853 4.9853 5.2929 5.2929 5.2986 5.2986 6.1246 6.1246 6.1296 6.1296 6.8451 6.8451 6.8464 6.8464 11.6391 11.6391 11.6431 11.6431 11.9108 11.9108 11.9178 11.9178 12.3478 12.3478 12.3612 12.3612 k = 0.5000-0.2145-0.6372 ( 4144 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6276 -19.6276 -19.6059 -19.6059 -19.1600 -19.1600 -19.1546 -19.1546 -19.0589 -19.0589 -19.0394 -19.0394 -11.3449 -11.3449 -11.3442 -11.3442 -10.2296 -10.2296 -10.2272 -10.2272 -9.9151 -9.9151 -9.9108 -9.9108 1.4133 1.4133 1.4136 1.4136 2.1479 2.1479 2.1491 2.1491 2.6515 2.6515 2.6516 2.6516 3.4744 3.4744 3.4806 3.4806 4.4431 4.4431 4.4480 4.4480 4.9986 4.9986 5.0068 5.0068 5.2824 5.2824 5.2876 5.2876 6.1175 6.1175 6.1224 6.1224 6.8454 6.8454 6.8468 6.8468 11.6266 11.6266 11.6305 11.6305 11.9192 11.9192 11.9266 11.9266 12.3450 12.3450 12.3586 12.3586 k = 0.5000-0.2046-0.6523 ( 4140 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6282 -19.6282 -19.6060 -19.6060 -19.1607 -19.1607 -19.1552 -19.1552 -19.0580 -19.0580 -19.0381 -19.0381 -11.3446 -11.3446 -11.3439 -11.3439 -10.2306 -10.2306 -10.2285 -10.2285 -9.9146 -9.9146 -9.9100 -9.9100 1.4108 1.4108 1.4112 1.4112 2.1632 2.1632 2.1641 2.1641 2.6347 2.6347 2.6350 2.6350 3.4876 3.4876 3.4939 3.4939 4.4264 4.4264 4.4311 4.4311 5.0201 5.0201 5.0281 5.0281 5.2750 5.2750 5.2795 5.2795 6.1083 6.1083 6.1131 6.1131 6.8445 6.8445 6.8462 6.8462 11.6155 11.6155 11.6192 11.6192 11.9285 11.9285 11.9360 11.9360 12.3421 12.3421 12.3559 12.3559 k = 0.5000-0.1947-0.6674 ( 4136 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6287 -19.6287 -19.6060 -19.6060 -19.1614 -19.1614 -19.1558 -19.1558 -19.0572 -19.0572 -19.0368 -19.0368 -11.3447 -11.3447 -11.3439 -11.3439 -10.2309 -10.2309 -10.2289 -10.2289 -9.9145 -9.9145 -9.9095 -9.9095 1.4070 1.4070 1.4077 1.4077 2.1793 2.1793 2.1801 2.1801 2.6179 2.6179 2.6184 2.6184 3.4988 3.4988 3.5050 3.5050 4.4119 4.4119 4.4163 4.4163 5.0409 5.0409 5.0485 5.0485 5.2710 5.2710 5.2745 5.2745 6.0972 6.0972 6.1018 6.1018 6.8425 6.8425 6.8445 6.8445 11.6058 11.6058 11.6095 11.6095 11.9384 11.9384 11.9461 11.9461 12.3391 12.3391 12.3530 12.3530 k = 0.5000-0.1848-0.6825 ( 4142 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6291 -19.6291 -19.6061 -19.6061 -19.1619 -19.1619 -19.1563 -19.1563 -19.0565 -19.0565 -19.0358 -19.0358 -11.3454 -11.3454 -11.3445 -11.3445 -10.2304 -10.2304 -10.2285 -10.2285 -9.9146 -9.9146 -9.9092 -9.9092 1.4021 1.4021 1.4029 1.4029 2.1962 2.1962 2.1968 2.1968 2.6013 2.6013 2.6019 2.6019 3.5073 3.5073 3.5135 3.5135 4.4000 4.4000 4.4040 4.4040 5.0606 5.0606 5.0676 5.0676 5.2710 5.2710 5.2734 5.2734 6.0842 6.0842 6.0888 6.0888 6.8393 6.8393 6.8416 6.8416 11.5976 11.5976 11.6012 11.6012 11.9488 11.9488 11.9567 11.9567 12.3360 12.3360 12.3500 12.3500 k = 0.5000-0.1749-0.6976 ( 4136 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6295 -19.6295 -19.6062 -19.6062 -19.1624 -19.1624 -19.1568 -19.1568 -19.0558 -19.0558 -19.0348 -19.0348 -11.3465 -11.3465 -11.3456 -11.3456 -10.2290 -10.2290 -10.2273 -10.2273 -9.9149 -9.9149 -9.9091 -9.9091 1.3963 1.3963 1.3972 1.3972 2.2136 2.2136 2.2140 2.2140 2.5850 2.5850 2.5858 2.5858 3.5129 3.5129 3.5189 3.5189 4.3912 4.3912 4.3947 4.3947 5.0785 5.0785 5.0847 5.0847 5.2754 5.2754 5.2764 5.2764 6.0699 6.0699 6.0743 6.0743 6.8349 6.8349 6.8375 6.8375 11.5909 11.5909 11.5944 11.5944 11.9598 11.9598 11.9678 11.9678 12.3328 12.3328 12.3469 12.3469 k = 0.5000-0.1650-0.7127 ( 4134 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6298 -19.6298 -19.6062 -19.6062 -19.1628 -19.1628 -19.1571 -19.1571 -19.0552 -19.0552 -19.0339 -19.0339 -11.3482 -11.3482 -11.3472 -11.3472 -10.2268 -10.2268 -10.2252 -10.2252 -9.9154 -9.9154 -9.9093 -9.9093 1.3895 1.3895 1.3906 1.3906 2.2311 2.2311 2.2315 2.2315 2.5691 2.5691 2.5701 2.5701 3.5150 3.5150 3.5208 3.5208 4.3858 4.3858 4.3888 4.3888 5.0944 5.0944 5.0995 5.0995 5.2837 5.2837 5.2845 5.2845 6.0543 6.0543 6.0586 6.0586 6.8293 6.8293 6.8322 6.8322 11.5858 11.5858 11.5893 11.5893 11.9711 11.9711 11.9792 11.9792 12.3297 12.3297 12.3439 12.3439 k = 0.5000-0.1551-0.7278 ( 4124 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6300 -19.6300 -19.6062 -19.6062 -19.1630 -19.1630 -19.1574 -19.1574 -19.0547 -19.0547 -19.0331 -19.0331 -11.3504 -11.3504 -11.3493 -11.3493 -10.2238 -10.2238 -10.2224 -10.2224 -9.9161 -9.9161 -9.9097 -9.9097 1.3819 1.3819 1.3831 1.3831 2.2485 2.2485 2.2488 2.2488 2.5538 2.5538 2.5550 2.5550 3.5134 3.5134 3.5190 3.5190 4.3840 4.3840 4.3865 4.3865 5.1079 5.1079 5.1119 5.1119 5.2954 5.2954 5.2979 5.2979 6.0380 6.0380 6.0421 6.0421 6.8225 6.8225 6.8257 6.8257 11.5822 11.5822 11.5856 11.5856 11.9827 11.9827 11.9909 11.9909 12.3266 12.3266 12.3408 12.3408 k = 0.7849-0.0267-0.4323 ( 4124 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6300 -19.6300 -19.6062 -19.6062 -19.1630 -19.1630 -19.1574 -19.1574 -19.0547 -19.0547 -19.0331 -19.0331 -11.3504 -11.3504 -11.3493 -11.3493 -10.2238 -10.2238 -10.2224 -10.2224 -9.9162 -9.9162 -9.9097 -9.9097 1.3819 1.3819 1.3831 1.3831 2.2486 2.2486 2.2488 2.2488 2.5538 2.5538 2.5550 2.5550 3.5134 3.5134 3.5190 3.5190 4.3840 4.3840 4.3864 4.3864 5.1079 5.1079 5.1120 5.1120 5.2954 5.2954 5.2979 5.2979 6.0380 6.0380 6.0421 6.0421 6.8225 6.8225 6.8257 6.8257 11.5822 11.5822 11.5856 11.5856 11.9827 11.9827 11.9909 11.9909 12.3266 12.3266 12.3408 12.3408 k = 0.7774-0.0201-0.4170 ( 4128 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6302 -19.6302 -19.6062 -19.6062 -19.1632 -19.1632 -19.1575 -19.1575 -19.0543 -19.0543 -19.0325 -19.0325 -11.3532 -11.3532 -11.3519 -11.3519 -10.2200 -10.2200 -10.2187 -10.2187 -9.9170 -9.9170 -9.9103 -9.9103 1.3735 1.3735 1.3748 1.3748 2.2656 2.2656 2.2657 2.2657 2.5394 2.5394 2.5407 2.5407 3.5079 3.5079 3.5132 3.5132 4.3862 4.3862 4.3880 4.3880 5.1193 5.1193 5.1225 5.1225 5.3112 5.3112 5.3153 5.3153 6.0210 6.0210 6.0250 6.0250 6.8143 6.8143 6.8178 6.8178 11.5802 11.5802 11.5835 11.5835 11.9947 11.9947 12.0029 12.0029 12.3235 12.3235 12.3377 12.3377 k = 0.7699-0.0134-0.4017 ( 4120 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6303 -19.6303 -19.6062 -19.6062 -19.1633 -19.1633 -19.1576 -19.1576 -19.0540 -19.0540 -19.0320 -19.0320 -11.3564 -11.3564 -11.3551 -11.3551 -10.2154 -10.2154 -10.2142 -10.2142 -9.9181 -9.9181 -9.9110 -9.9110 1.3646 1.3646 1.3660 1.3660 2.2815 2.2815 2.2816 2.2816 2.5263 2.5263 2.5277 2.5277 3.4985 3.4985 3.5035 3.5035 4.3923 4.3923 4.3934 4.3934 5.1290 5.1290 5.1314 5.1314 5.3302 5.3302 5.3357 5.3357 6.0041 6.0041 6.0078 6.0078 6.8049 6.8049 6.8087 6.8087 11.5797 11.5797 11.5830 11.5830 12.0067 12.0067 12.0148 12.0149 12.3204 12.3204 12.3346 12.3346 k = 0.7624-0.0068-0.3865 ( 4120 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6303 -19.6303 -19.6061 -19.6061 -19.1633 -19.1633 -19.1576 -19.1576 -19.0537 -19.0537 -19.0317 -19.0317 -11.3602 -11.3602 -11.3588 -11.3588 -10.2100 -10.2100 -10.2090 -10.2090 -9.9192 -9.9192 -9.9119 -9.9119 1.3552 1.3552 1.3567 1.3567 2.2957 2.2957 2.2958 2.2958 2.5149 2.5149 2.5164 2.5164 3.4854 3.4854 3.4900 3.4900 4.4021 4.4021 4.4026 4.4026 5.1372 5.1372 5.1392 5.1392 5.3516 5.3516 5.3583 5.3583 5.9878 5.9878 5.9912 5.9912 6.7942 6.7942 6.7983 6.7983 11.5807 11.5807 11.5841 11.5841 12.0187 12.0187 12.0268 12.0268 12.3173 12.3173 12.3315 12.3315 k = 0.7549-0.0002-0.3712 ( 4112 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6302 -19.6302 -19.6060 -19.6060 -19.1632 -19.1632 -19.1575 -19.1575 -19.0536 -19.0536 -19.0315 -19.0315 -11.3644 -11.3644 -11.3629 -11.3629 -10.2040 -10.2040 -10.2030 -10.2030 -9.9205 -9.9205 -9.9129 -9.9129 1.3455 1.3455 1.3471 1.3471 2.3074 2.3074 2.3076 2.3076 2.5060 2.5060 2.5074 2.5074 3.4688 3.4688 3.4732 3.4732 4.4152 4.4152 4.4155 4.4155 5.1443 5.1443 5.1461 5.1461 5.3747 5.3747 5.3823 5.3823 5.9725 5.9725 5.9757 5.9757 6.7823 6.7823 6.7867 6.7867 11.5832 11.5832 11.5866 11.5866 12.0307 12.0307 12.0387 12.0387 12.3143 12.3143 12.3285 12.3285 k = 0.7474 0.0065-0.3559 ( 4114 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6301 -19.6301 -19.6059 -19.6059 -19.1630 -19.1630 -19.1574 -19.1574 -19.0536 -19.0536 -19.0315 -19.0315 -11.3692 -11.3692 -11.3675 -11.3675 -10.1973 -10.1973 -10.1964 -10.1964 -9.9218 -9.9218 -9.9140 -9.9140 1.3356 1.3356 1.3373 1.3373 2.3157 2.3157 2.3161 2.3161 2.4999 2.4999 2.5013 2.5013 3.4493 3.4493 3.4534 3.4534 4.4310 4.4310 4.4319 4.4319 5.1504 5.1504 5.1523 5.1523 5.3988 5.3988 5.4071 5.4071 5.9590 5.9590 5.9618 5.9618 6.7692 6.7692 6.7740 6.7740 11.5872 11.5872 11.5906 11.5906 12.0425 12.0425 12.0503 12.0503 12.3113 12.3113 12.3254 12.3254 k = 0.7400 0.0131-0.3407 ( 4112 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6299 -19.6299 -19.6057 -19.6057 -19.1627 -19.1627 -19.1571 -19.1571 -19.0536 -19.0536 -19.0316 -19.0316 -11.3743 -11.3743 -11.3726 -11.3726 -10.1900 -10.1900 -10.1892 -10.1892 -9.9232 -9.9232 -9.9152 -9.9152 1.3256 1.3256 1.3274 1.3274 2.3201 2.3201 2.3208 2.3208 2.4972 2.4972 2.4983 2.4983 3.4275 3.4275 3.4313 3.4313 4.4495 4.4495 4.4509 4.4509 5.1554 5.1554 5.1577 5.1577 5.4235 5.4235 5.4322 5.4322 5.9478 5.9478 5.9501 5.9501 6.7550 6.7550 6.7601 6.7601 11.5927 11.5927 11.5961 11.5961 12.0541 12.0541 12.0617 12.0617 12.3082 12.3082 12.3222 12.3222 k = 0.7325 0.0197-0.3254 ( 4112 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6296 -19.6296 -19.6056 -19.6056 -19.1623 -19.1623 -19.1568 -19.1568 -19.0538 -19.0538 -19.0318 -19.0318 -11.3799 -11.3799 -11.3781 -11.3781 -10.1821 -10.1821 -10.1814 -10.1814 -9.9246 -9.9246 -9.9164 -9.9164 1.3156 1.3156 1.3175 1.3175 2.3204 2.3204 2.3216 2.3216 2.4977 2.4977 2.4984 2.4984 3.4038 3.4038 3.4075 3.4075 4.4702 4.4702 4.4721 4.4721 5.1592 5.1592 5.1619 5.1619 5.4484 5.4484 5.4574 5.4574 5.9393 5.9393 5.9414 5.9414 6.7397 6.7397 6.7451 6.7451 11.5995 11.5995 11.6030 11.6030 12.0654 12.0654 12.0728 12.0728 12.3051 12.3051 12.3190 12.3190 k = 0.7250 0.0263-0.3101 ( 4106 PWs) bands (ev): -40.5838 -40.5838 -40.5837 -40.5837 -19.6292 -19.6292 -19.6053 -19.6053 -19.1618 -19.1618 -19.1563 -19.1563 -19.0540 -19.0540 -19.0322 -19.0322 -11.3858 -11.3858 -11.3839 -11.3839 -10.1737 -10.1737 -10.1731 -10.1731 -9.9260 -9.9260 -9.9177 -9.9177 1.3058 1.3058 1.3077 1.3077 2.3171 2.3171 2.3187 2.3187 2.5006 2.5006 2.5010 2.5010 3.3790 3.3790 3.3825 3.3825 4.4927 4.4927 4.4950 4.4950 5.1614 5.1614 5.1648 5.1648 5.4735 5.4735 5.4825 5.4825 5.9343 5.9343 5.9359 5.9359 6.7235 6.7235 6.7291 6.7291 11.6077 11.6077 11.6113 11.6113 12.0764 12.0764 12.0835 12.0835 12.3019 12.3019 12.3156 12.3156 k = 0.7175 0.0330-0.2949 ( 4104 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6288 -19.6288 -19.6051 -19.6051 -19.1612 -19.1612 -19.1558 -19.1558 -19.0543 -19.0543 -19.0327 -19.0327 -11.3921 -11.3921 -11.3901 -11.3901 -10.1649 -10.1649 -10.1643 -10.1643 -9.9275 -9.9275 -9.9190 -9.9190 1.2961 1.2961 1.2981 1.2981 2.3108 2.3108 2.3128 2.3128 2.5050 2.5050 2.5051 2.5051 3.3536 3.3536 3.3570 3.3570 4.5165 4.5165 4.5192 4.5192 5.1618 5.1618 5.1659 5.1659 5.4985 5.4985 5.5075 5.5075 5.9328 5.9328 5.9342 5.9342 6.7064 6.7064 6.7123 6.7123 11.6172 11.6172 11.6208 11.6208 12.0870 12.0870 12.0939 12.0939 12.2985 12.2985 12.3121 12.3121 k = 0.7100 0.0396-0.2796 ( 4104 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6283 -19.6283 -19.6049 -19.6049 -19.1606 -19.1606 -19.1552 -19.1552 -19.0548 -19.0548 -19.0333 -19.0333 -11.3986 -11.3986 -11.3965 -11.3965 -10.1558 -10.1558 -10.1552 -10.1552 -9.9289 -9.9289 -9.9204 -9.9204 1.2868 1.2868 1.2888 1.2888 2.3024 2.3024 2.3048 2.3048 2.5095 2.5095 2.5099 2.5099 3.3283 3.3283 3.3316 3.3316 4.5411 4.5411 4.5442 4.5442 5.1601 5.1601 5.1649 5.1649 5.5237 5.5237 5.5324 5.5324 5.9352 5.9352 5.9364 5.9364 6.6884 6.6884 6.6946 6.6946 11.6279 11.6279 11.6316 11.6316 12.0973 12.0973 12.1039 12.1039 12.2950 12.2950 12.3085 12.3085 k = 0.7025 0.0462-0.2644 ( 4110 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6277 -19.6277 -19.6046 -19.6046 -19.1598 -19.1598 -19.1545 -19.1545 -19.0553 -19.0553 -19.0341 -19.0341 -11.4054 -11.4054 -11.4032 -11.4032 -10.1463 -10.1463 -10.1457 -10.1457 -9.9303 -9.9303 -9.9218 -9.9218 1.2778 1.2778 1.2799 1.2799 2.2926 2.2926 2.2953 2.2953 2.5133 2.5133 2.5140 2.5140 3.3037 3.3037 3.3069 3.3069 4.5663 4.5663 4.5696 4.5696 5.1561 5.1561 5.1617 5.1617 5.5492 5.5492 5.5575 5.5575 5.9413 5.9413 5.9424 5.9424 6.6698 6.6698 6.6763 6.6763 11.6399 11.6399 11.6437 11.6437 12.1071 12.1071 12.1135 12.1135 12.2913 12.2913 12.3046 12.3046 k = 0.6950 0.0529-0.2491 ( 4106 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6271 -19.6271 -19.6043 -19.6043 -19.1589 -19.1589 -19.1538 -19.1538 -19.0559 -19.0559 -19.0351 -19.0351 -11.4124 -11.4124 -11.4102 -11.4102 -10.1365 -10.1365 -10.1360 -10.1360 -9.9317 -9.9317 -9.9231 -9.9231 1.2693 1.2693 1.2715 1.2715 2.2819 2.2819 2.2849 2.2849 2.5156 2.5156 2.5167 2.5167 3.2804 3.2804 3.2835 3.2835 4.5918 4.5918 4.5953 4.5953 5.1498 5.1498 5.1562 5.1562 5.5752 5.5752 5.5830 5.5830 5.9509 5.9509 5.9520 5.9520 6.6507 6.6507 6.6574 6.6574 11.6530 11.6530 11.6569 11.6569 12.1166 12.1166 12.1226 12.1226 12.2873 12.2873 12.3004 12.3004 k = 0.6875 0.0595-0.2338 ( 4110 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6264 -19.6264 -19.6040 -19.6040 -19.1580 -19.1580 -19.1529 -19.1529 -19.0567 -19.0567 -19.0361 -19.0361 -11.4196 -11.4196 -11.4173 -11.4173 -10.1266 -10.1266 -10.1261 -10.1261 -9.9330 -9.9330 -9.9244 -9.9244 1.2613 1.2613 1.2635 1.2635 2.2708 2.2708 2.2740 2.2740 2.5157 2.5157 2.5170 2.5170 3.2588 3.2588 3.2618 3.2618 4.6171 4.6171 4.6207 4.6207 5.1414 5.1414 5.1485 5.1485 5.6019 5.6019 5.6092 5.6092 5.9636 5.9636 5.9646 5.9646 6.6312 6.6312 6.6382 6.6382 11.6672 11.6672 11.6712 11.6712 12.1256 12.1256 12.1314 12.1314 12.2830 12.2830 12.2960 12.2960 k = 0.6800 0.0661-0.2186 ( 4118 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6257 -19.6257 -19.6037 -19.6037 -19.1569 -19.1569 -19.1520 -19.1520 -19.0575 -19.0575 -19.0373 -19.0373 -11.4269 -11.4269 -11.4245 -11.4245 -10.1166 -10.1166 -10.1161 -10.1161 -9.9342 -9.9342 -9.9257 -9.9257 1.2539 1.2539 1.2561 1.2561 2.2594 2.2594 2.2629 2.2629 2.5131 2.5131 2.5147 2.5147 3.2393 3.2393 3.2424 3.2424 4.6421 4.6421 4.6458 4.6458 5.1310 5.1310 5.1387 5.1387 5.6295 5.6295 5.6362 5.6362 5.9786 5.9786 5.9798 5.9798 6.6115 6.6115 6.6188 6.6188 11.6824 11.6824 11.6865 11.6865 12.1342 12.1342 12.1397 12.1397 12.2784 12.2784 12.2914 12.2914 k = 0.6725 0.0728-0.2033 ( 4116 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6249 -19.6249 -19.6034 -19.6034 -19.1558 -19.1558 -19.1510 -19.1510 -19.0583 -19.0583 -19.0387 -19.0387 -11.4342 -11.4342 -11.4318 -11.4318 -10.1064 -10.1064 -10.1059 -10.1059 -9.9353 -9.9353 -9.9270 -9.9270 1.2471 1.2471 1.2494 1.2494 2.2481 2.2481 2.2517 2.2517 2.5075 2.5075 2.5093 2.5093 3.2223 3.2223 3.2254 3.2254 4.6665 4.6665 4.6703 4.6703 5.1191 5.1191 5.1273 5.1273 5.6580 5.6580 5.6643 5.6643 5.9956 5.9956 5.9968 5.9968 6.5920 6.5920 6.5995 6.5995 11.6987 11.6987 11.7028 11.7028 12.1423 12.1423 12.1475 12.1475 12.2736 12.2736 12.2865 12.2865 k = 0.6650 0.0794-0.1880 ( 4110 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6240 -19.6240 -19.6030 -19.6030 -19.1546 -19.1546 -19.1499 -19.1499 -19.0593 -19.0593 -19.0401 -19.0401 -11.4416 -11.4416 -11.4391 -11.4391 -10.0963 -10.0963 -10.0958 -10.0958 -9.9364 -9.9364 -9.9282 -9.9282 1.2410 1.2410 1.2433 1.2433 2.2370 2.2370 2.2407 2.2407 2.4987 2.4987 2.5008 2.5008 3.2079 3.2079 3.2110 3.2110 4.6903 4.6903 4.6941 4.6941 5.1060 5.1060 5.1146 5.1146 5.6873 5.6873 5.6932 5.6932 6.0137 6.0137 6.0150 6.0150 6.5727 6.5727 6.5804 6.5804 11.7158 11.7158 11.7201 11.7201 12.1499 12.1499 12.1550 12.1550 12.2685 12.2685 12.2813 12.2813 k = 0.6575 0.0860-0.1728 ( 4112 PWs) bands (ev): -40.5838 -40.5838 -40.5838 -40.5838 -19.6231 -19.6231 -19.6027 -19.6027 -19.1532 -19.1532 -19.1487 -19.1487 -19.0604 -19.0604 -19.0416 -19.0416 -11.4489 -11.4489 -11.4465 -11.4465 -10.0862 -10.0862 -10.0856 -10.0856 -9.9374 -9.9374 -9.9293 -9.9293 1.2355 1.2355 1.2379 1.2379 2.2262 2.2262 2.2300 2.2300 2.4867 2.4867 2.4890 2.4890 3.1962 3.1962 3.1992 3.1992 4.7132 4.7132 4.7170 4.7170 5.0922 5.0922 5.1011 5.1011 5.7173 5.7173 5.7229 5.7229 6.0324 6.0324 6.0338 6.0338 6.5541 6.5541 6.5620 6.5620 11.7338 11.7338 11.7381 11.7381 12.1569 12.1569 12.1619 12.1619 12.2631 12.2631 12.2759 12.2759 k = 0.6500 0.0927-0.1575 ( 4110 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6222 -19.6222 -19.6024 -19.6024 -19.1518 -19.1518 -19.1475 -19.1475 -19.0615 -19.0615 -19.0433 -19.0433 -11.4562 -11.4562 -11.4538 -11.4538 -10.0762 -10.0762 -10.0756 -10.0756 -9.9383 -9.9383 -9.9304 -9.9304 1.2308 1.2308 1.2332 1.2332 2.2157 2.2157 2.2196 2.2196 2.4718 2.4718 2.4742 2.4742 3.1870 3.1870 3.1900 3.1900 4.7352 4.7352 4.7389 4.7389 5.0781 5.0781 5.0871 5.0871 5.7478 5.7478 5.7531 5.7531 6.0512 6.0512 6.0525 6.0525 6.5364 6.5364 6.5444 6.5444 11.7525 11.7525 11.7570 11.7570 12.1634 12.1634 12.1684 12.1684 12.2575 12.2575 12.2704 12.2704 k = 0.6425 0.0993-0.1423 ( 4116 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6212 -19.6212 -19.6021 -19.6021 -19.1504 -19.1504 -19.1462 -19.1462 -19.0627 -19.0627 -19.0451 -19.0451 -11.4635 -11.4635 -11.4610 -11.4610 -10.0663 -10.0663 -10.0657 -10.0657 -9.9391 -9.9391 -9.9315 -9.9315 1.2267 1.2267 1.2292 1.2292 2.2056 2.2056 2.2095 2.2095 2.4541 2.4541 2.4567 2.4567 3.1802 3.1802 3.1831 3.1831 4.7563 4.7563 4.7598 4.7598 5.0639 5.0639 5.0731 5.0731 5.7783 5.7783 5.7834 5.7834 6.0695 6.0695 6.0708 6.0708 6.5200 6.5200 6.5281 6.5281 11.7720 11.7720 11.7765 11.7765 12.1692 12.1692 12.1743 12.1743 12.2517 12.2517 12.2648 12.2648 k = 0.6350 0.1059-0.1270 ( 4116 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6202 -19.6202 -19.6018 -19.6018 -19.1488 -19.1488 -19.1448 -19.1448 -19.0639 -19.0639 -19.0470 -19.0470 -11.4706 -11.4706 -11.4682 -11.4682 -10.0566 -10.0566 -10.0560 -10.0560 -9.9398 -9.9398 -9.9325 -9.9325 1.2234 1.2234 1.2259 1.2259 2.1961 2.1961 2.2000 2.2000 2.4341 2.4341 2.4368 2.4368 3.1753 3.1753 3.1782 3.1782 4.7762 4.7762 4.7797 4.7797 5.0502 5.0502 5.0593 5.0593 5.8084 5.8084 5.8135 5.8135 6.0870 6.0870 6.0881 6.0881 6.5053 6.5053 6.5135 6.5135 11.7920 11.7920 11.7967 11.7967 12.1743 12.1743 12.1796 12.1796 12.2458 12.2458 12.2592 12.2592 k = 0.6275 0.1126-0.1117 ( 4112 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6192 -19.6192 -19.6015 -19.6015 -19.1472 -19.1472 -19.1434 -19.1434 -19.0652 -19.0652 -19.0489 -19.0489 -11.4775 -11.4775 -11.4751 -11.4751 -10.0472 -10.0472 -10.0465 -10.0465 -9.9404 -9.9404 -9.9334 -9.9334 1.2208 1.2208 1.2233 1.2233 2.1870 2.1870 2.1909 2.1909 2.4122 2.4122 2.4151 2.4151 3.1721 3.1721 3.1750 3.1750 4.7952 4.7952 4.7984 4.7984 5.0372 5.0372 5.0462 5.0462 5.8375 5.8375 5.8427 5.8427 6.1036 6.1036 6.1042 6.1042 6.4927 6.4927 6.5007 6.5007 11.8126 11.8126 11.8174 11.8174 12.1786 12.1786 12.1843 12.1843 12.2399 12.2399 12.2538 12.2538 k = 0.6200 0.1192-0.0965 ( 4112 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6181 -19.6181 -19.6013 -19.6013 -19.1455 -19.1455 -19.1420 -19.1420 -19.0666 -19.0666 -19.0509 -19.0509 -11.4842 -11.4842 -11.4819 -11.4819 -10.0381 -10.0381 -10.0374 -10.0374 -9.9410 -9.9410 -9.9343 -9.9343 1.2189 1.2189 1.2214 1.2214 2.1784 2.1784 2.1822 2.1822 2.3889 2.3889 2.3918 2.3918 3.1702 3.1702 3.1731 3.1731 4.8130 4.8130 4.8161 4.8161 5.0250 5.0250 5.0338 5.0338 5.8649 5.8649 5.8704 5.8704 6.1192 6.1192 6.1193 6.1193 6.4824 6.4824 6.4902 6.4902 11.8336 11.8336 11.8385 11.8385 12.1819 12.1819 12.1881 12.1881 12.2342 12.2342 12.2486 12.2486 k = 0.6125 0.1258-0.0812 ( 4110 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6170 -19.6170 -19.6010 -19.6010 -19.1437 -19.1437 -19.1404 -19.1404 -19.0680 -19.0680 -19.0530 -19.0530 -11.4907 -11.4907 -11.4884 -11.4884 -10.0293 -10.0293 -10.0285 -10.0285 -9.9414 -9.9414 -9.9351 -9.9351 1.2177 1.2177 1.2202 1.2202 2.1705 2.1705 2.1742 2.1742 2.3646 2.3646 2.3676 2.3676 3.1694 3.1694 3.1722 3.1722 4.8298 4.8298 4.8327 4.8327 5.0139 5.0139 5.0224 5.0224 5.8898 5.8898 5.8955 5.8955 6.1337 6.1337 6.1343 6.1343 6.4746 6.4746 6.4821 6.4821 11.8550 11.8550 11.8599 11.8599 12.1842 12.1842 12.1910 12.1910 12.2287 12.2287 12.2437 12.2437 k = 0.6050 0.1324-0.0659 ( 4114 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6160 -19.6160 -19.6008 -19.6008 -19.1419 -19.1419 -19.1389 -19.1389 -19.0695 -19.0695 -19.0552 -19.0552 -11.4969 -11.4969 -11.4947 -11.4947 -10.0208 -10.0208 -10.0200 -10.0200 -9.9418 -9.9418 -9.9359 -9.9359 1.2171 1.2171 1.2196 1.2196 2.1630 2.1630 2.1666 2.1666 2.3398 2.3398 2.3429 2.3429 3.1692 3.1692 3.1719 3.1719 4.8455 4.8455 4.8481 4.8481 5.0040 5.0040 5.0121 5.0121 5.9112 5.9112 5.9171 5.9171 6.1480 6.1480 6.1493 6.1493 6.4694 6.4694 6.4764 6.4764 11.8765 11.8765 11.8815 11.8815 12.1852 12.1852 12.1926 12.1926 12.2238 12.2238 12.2394 12.2394 k = 0.5975 0.1391-0.0507 ( 4122 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6149 -19.6149 -19.6007 -19.6007 -19.1401 -19.1401 -19.1373 -19.1373 -19.0709 -19.0709 -19.0575 -19.0575 -11.5028 -11.5028 -11.5008 -11.5008 -10.0128 -10.0128 -10.0119 -10.0119 -9.9422 -9.9422 -9.9367 -9.9367 1.2171 1.2171 1.2196 1.2196 2.1561 2.1561 2.1595 2.1595 2.3150 2.3150 2.3180 2.3180 3.1695 3.1695 3.1722 3.1722 4.8602 4.8602 4.8626 4.8626 4.9952 4.9952 5.0030 5.0030 5.9282 5.9282 5.9342 5.9342 6.1631 6.1631 6.1652 6.1652 6.4664 6.4664 6.4728 6.4728 11.8982 11.8982 11.9033 11.9033 12.1850 12.1850 12.1928 12.1928 12.2198 12.2198 12.2357 12.2357 k = 0.5900 0.1457-0.0354 ( 4126 PWs) bands (ev): -40.5839 -40.5839 -40.5839 -40.5839 -19.6139 -19.6139 -19.6006 -19.6006 -19.1382 -19.1382 -19.1357 -19.1357 -19.0724 -19.0724 -19.0598 -19.0598 -11.5084 -11.5084 -11.5065 -11.5065 -10.0052 -10.0052 -10.0042 -10.0042 -9.9425 -9.9425 -9.9375 -9.9375 1.2177 1.2177 1.2201 1.2201 2.1497 2.1497 2.1530 2.1530 2.2903 2.2903 2.2933 2.2933 3.1701 3.1701 3.1726 3.1726 4.8739 4.8739 4.8759 4.8759 4.9878 4.9878 4.9950 4.9950 5.9403 5.9403 5.9462 5.9462 6.1799 6.1799 6.1825 6.1825 6.4652 6.4652 6.4710 6.4710 11.9199 11.9199 11.9250 11.9250 12.1837 12.1837 12.1914 12.1914 12.2167 12.2167 12.2324 12.2324 k = 0.5825 0.1523-0.0201 ( 4124 PWs) bands (ev): -40.5840 -40.5840 -40.5839 -40.5839 -19.6128 -19.6128 -19.6005 -19.6005 -19.1363 -19.1363 -19.1341 -19.1341 -19.0739 -19.0739 -19.0620 -19.0620 -11.5136 -11.5136 -11.5118 -11.5118 -9.9980 -9.9980 -9.9970 -9.9970 -9.9427 -9.9427 -9.9382 -9.9382 1.2187 1.2187 1.2210 1.2210 2.1440 2.1440 2.1471 2.1471 2.2664 2.2664 2.2693 2.2693 3.1708 3.1708 3.1732 3.1732 4.8866 4.8866 4.8883 4.8883 4.9815 4.9815 4.9882 4.9882 5.9474 5.9474 5.9530 5.9530 6.1988 6.1988 6.2017 6.2017 6.4655 6.4655 6.4706 6.4706 11.9415 11.9415 11.9466 11.9466 12.1813 12.1813 12.1885 12.1885 12.2144 12.2144 12.2295 12.2295 k = 0.5750 0.1590-0.0049 ( 4128 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6118 -19.6118 -19.6005 -19.6005 -19.1343 -19.1343 -19.1325 -19.1325 -19.0754 -19.0754 -19.0644 -19.0644 -11.5185 -11.5185 -11.5168 -11.5168 -9.9913 -9.9913 -9.9903 -9.9903 -9.9429 -9.9429 -9.9389 -9.9389 1.2201 1.2201 1.2224 1.2224 2.1388 2.1388 2.1416 2.1416 2.2433 2.2433 2.2461 2.2461 3.1715 3.1715 3.1737 3.1737 4.8983 4.8983 4.8997 4.8997 4.9764 4.9764 4.9825 4.9825 5.9499 5.9499 5.9550 5.9550 6.2197 6.2197 6.2227 6.2227 6.4664 6.4664 6.4709 6.4709 11.9628 11.9628 11.9680 11.9680 12.1782 12.1782 12.1848 12.1848 12.2124 12.2124 12.2267 12.2267 k = 0.5675 0.1656 0.0104 ( 4126 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6108 -19.6108 -19.6005 -19.6005 -19.1324 -19.1324 -19.1309 -19.1309 -19.0768 -19.0768 -19.0667 -19.0667 -11.5230 -11.5230 -11.5214 -11.5214 -9.9852 -9.9852 -9.9840 -9.9840 -9.9431 -9.9431 -9.9396 -9.9396 1.2218 1.2218 1.2240 1.2240 2.1341 2.1341 2.1367 2.1367 2.2216 2.2216 2.2242 2.2242 3.1721 3.1721 3.1742 3.1742 4.9090 4.9090 4.9101 4.9101 4.9725 4.9725 4.9779 4.9779 5.9487 5.9487 5.9532 5.9532 6.2421 6.2421 6.2450 6.2450 6.4676 6.4676 6.4714 6.4714 11.9838 11.9838 11.9889 11.9889 12.1746 12.1746 12.1807 12.1807 12.2101 12.2101 12.2237 12.2237 k = 0.5600 0.1722 0.0256 ( 4134 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6098 -19.6098 -19.6006 -19.6006 -19.1306 -19.1306 -19.1294 -19.1294 -19.0782 -19.0782 -19.0689 -19.0689 -11.5270 -11.5270 -11.5256 -11.5256 -9.9795 -9.9795 -9.9783 -9.9783 -9.9433 -9.9433 -9.9403 -9.9403 1.2238 1.2238 1.2257 1.2257 2.1300 2.1300 2.1323 2.1323 2.2013 2.2013 2.2038 2.2038 3.1727 3.1727 3.1746 3.1746 4.9187 4.9187 4.9195 4.9195 4.9694 4.9694 4.9741 4.9741 5.9449 5.9449 5.9487 5.9487 6.2653 6.2653 6.2680 6.2680 6.4685 6.4685 6.4717 6.4717 12.0043 12.0043 12.0094 12.0094 12.1708 12.1708 12.1765 12.1765 12.2073 12.2073 12.2203 12.2203 k = 0.5525 0.1789 0.0409 ( 4128 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6089 -19.6089 -19.6008 -19.6008 -19.1288 -19.1288 -19.1279 -19.1279 -19.0794 -19.0794 -19.0712 -19.0712 -11.5306 -11.5306 -11.5293 -11.5293 -9.9743 -9.9743 -9.9731 -9.9731 -9.9435 -9.9435 -9.9411 -9.9411 1.2258 1.2258 1.2276 1.2276 2.1264 2.1264 2.1285 2.1285 2.1829 2.1829 2.1851 2.1851 3.1731 3.1731 3.1748 3.1748 4.9275 4.9275 4.9278 4.9278 4.9673 4.9673 4.9712 4.9712 5.9393 5.9393 5.9425 5.9425 6.2888 6.2888 6.2912 6.2912 6.4685 6.4685 6.4712 6.4712 12.0242 12.0242 12.0292 12.0292 12.1670 12.1670 12.1725 12.1725 12.2038 12.2038 12.2163 12.2163 k = 0.5450 0.1855 0.0562 ( 4136 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6080 -19.6080 -19.6010 -19.6010 -19.1271 -19.1271 -19.1265 -19.1265 -19.0806 -19.0806 -19.0733 -19.0733 -11.5337 -11.5337 -11.5326 -11.5326 -9.9697 -9.9697 -9.9685 -9.9685 -9.9438 -9.9438 -9.9419 -9.9419 1.2279 1.2279 1.2295 1.2295 2.1233 2.1233 2.1251 2.1251 2.1664 2.1664 2.1684 2.1684 3.1734 3.1734 3.1749 3.1749 4.9351 4.9351 4.9351 4.9351 4.9659 4.9659 4.9690 4.9690 5.9329 5.9329 5.9355 5.9355 6.3118 6.3118 6.3139 6.3139 6.4675 6.4675 6.4697 6.4697 12.0433 12.0433 12.0481 12.0481 12.1632 12.1632 12.1687 12.1687 12.1995 12.1995 12.2116 12.2116 k = 0.5375 0.1921 0.0714 ( 4138 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6071 -19.6071 -19.6012 -19.6012 -19.1256 -19.1256 -19.1252 -19.1252 -19.0816 -19.0816 -19.0754 -19.0754 -11.5364 -11.5364 -11.5354 -11.5354 -9.9656 -9.9656 -9.9644 -9.9644 -9.9442 -9.9442 -9.9427 -9.9427 1.2299 1.2299 1.2313 1.2313 2.1207 2.1207 2.1221 2.1221 2.1522 2.1522 2.1538 2.1538 3.1737 3.1737 3.1749 3.1749 4.9412 4.9412 4.9416 4.9416 4.9652 4.9652 4.9674 4.9674 5.9263 5.9263 5.9284 5.9284 6.3340 6.3340 6.3359 6.3359 6.4650 6.4650 6.4667 6.4667 12.0616 12.0616 12.0662 12.0662 12.1595 12.1595 12.1652 12.1652 12.1944 12.1944 12.2061 12.2061 k = 0.5300 0.1988 0.0867 ( 4132 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6063 -19.6063 -19.6016 -19.6016 -19.1242 -19.1242 -19.1240 -19.1240 -19.0823 -19.0823 -19.0772 -19.0772 -11.5385 -11.5385 -11.5378 -11.5378 -9.9620 -9.9620 -9.9608 -9.9608 -9.9446 -9.9446 -9.9436 -9.9436 1.2317 1.2317 1.2329 1.2329 2.1186 2.1186 2.1197 2.1197 2.1404 2.1404 2.1417 2.1417 3.1738 3.1738 3.1748 3.1748 4.9462 4.9462 4.9469 4.9469 4.9650 4.9650 4.9664 4.9664 5.9202 5.9202 5.9218 5.9218 6.3551 6.3551 6.3566 6.3566 6.4609 6.4609 6.4622 6.4622 12.0789 12.0789 12.0830 12.0830 12.1559 12.1559 12.1619 12.1619 12.1888 12.1888 12.2000 12.2000 k = 0.5225 0.2054 0.1020 ( 4130 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6055 -19.6055 -19.6019 -19.6019 -19.1231 -19.1231 -19.1230 -19.1230 -19.0828 -19.0828 -19.0789 -19.0789 -11.5402 -11.5402 -11.5396 -11.5396 -9.9589 -9.9589 -9.9578 -9.9578 -9.9451 -9.9451 -9.9445 -9.9445 1.2333 1.2333 1.2341 1.2341 2.1169 2.1169 2.1176 2.1176 2.1313 2.1313 2.1321 2.1321 3.1740 3.1740 3.1747 3.1747 4.9499 4.9499 4.9508 4.9508 4.9652 4.9652 4.9659 4.9659 5.9150 5.9150 5.9162 5.9162 6.3746 6.3746 6.3757 6.3757 6.4551 6.4551 6.4560 6.4560 12.0951 12.0951 12.0985 12.0985 12.1523 12.1523 12.1584 12.1584 12.1831 12.1831 12.1935 12.1935 k = 0.5150 0.2120 0.1172 ( 4124 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6047 -19.6047 -19.6024 -19.6024 -19.1223 -19.1223 -19.1222 -19.1222 -19.0830 -19.0830 -19.0804 -19.0804 -11.5414 -11.5414 -11.5410 -11.5410 -9.9564 -9.9564 -9.9555 -9.9555 -9.9457 -9.9457 -9.9455 -9.9455 1.2345 1.2345 1.2351 1.2351 2.1156 2.1156 2.1159 2.1159 2.1249 2.1249 2.1253 2.1253 3.1741 3.1741 3.1746 3.1746 4.9525 4.9525 4.9533 4.9533 4.9656 4.9656 4.9659 4.9659 5.9111 5.9111 5.9119 5.9119 6.3922 6.3922 6.3931 6.3931 6.4475 6.4475 6.4480 6.4480 12.1099 12.1099 12.1123 12.1123 12.1483 12.1483 12.1538 12.1538 12.1784 12.1784 12.1870 12.1870 k = 0.5075 0.2187 0.1325 ( 4116 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6040 -19.6040 -19.6028 -19.6028 -19.1218 -19.1218 -19.1217 -19.1217 -19.0828 -19.0828 -19.0815 -19.0815 -11.5420 -11.5420 -11.5418 -11.5418 -9.9545 -9.9545 -9.9540 -9.9540 -9.9463 -9.9463 -9.9463 -9.9463 1.2353 1.2353 1.2356 1.2356 2.1145 2.1145 2.1146 2.1146 2.1213 2.1213 2.1214 2.1214 3.1742 3.1742 3.1744 3.1744 4.9541 4.9541 4.9546 4.9546 4.9661 4.9661 4.9661 4.9661 5.9088 5.9088 5.9091 5.9091 6.4074 6.4074 6.4079 6.4079 6.4386 6.4386 6.4388 6.4388 12.1228 12.1228 12.1238 12.1238 12.1437 12.1437 12.1473 12.1473 12.1763 12.1763 12.1812 12.1812 k = 0.5000 0.2253 0.1478 ( 4114 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6034 -19.6034 -19.6034 -19.6034 -19.1216 -19.1216 -19.1216 -19.1216 -19.0824 -19.0824 -19.0823 -19.0823 -11.5422 -11.5422 -11.5422 -11.5422 -9.9537 -9.9537 -9.9537 -9.9537 -9.9466 -9.9466 -9.9466 -9.9466 1.2357 1.2357 1.2357 1.2357 2.1141 2.1141 2.1141 2.1141 2.1202 2.1202 2.1202 2.1202 3.1743 3.1743 3.1743 3.1743 4.9548 4.9548 4.9548 4.9548 4.9662 4.9662 4.9662 4.9662 5.9081 5.9081 5.9081 5.9081 6.4159 6.4159 6.4159 6.4159 6.4324 6.4324 6.4324 6.4324 12.1301 12.1301 12.1301 12.1301 12.1410 12.1410 12.1410 12.1410 12.1774 12.1774 12.1774 12.1774 k = 0.5000 0.2253 0.1478 ( 4114 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6034 -19.6034 -19.6034 -19.6034 -19.1216 -19.1216 -19.1216 -19.1216 -19.0824 -19.0824 -19.0823 -19.0823 -11.5422 -11.5422 -11.5422 -11.5422 -9.9537 -9.9537 -9.9537 -9.9537 -9.9466 -9.9466 -9.9466 -9.9466 1.2357 1.2357 1.2357 1.2357 2.1141 2.1141 2.1141 2.1141 2.1202 2.1202 2.1202 2.1202 3.1743 3.1743 3.1743 3.1743 4.9548 4.9548 4.9548 4.9548 4.9662 4.9662 4.9662 4.9662 5.9081 5.9081 5.9081 5.9081 6.4159 6.4159 6.4159 6.4159 6.4324 6.4324 6.4324 6.4324 12.1301 12.1301 12.1301 12.1301 12.1410 12.1410 12.1410 12.1410 12.1774 12.1774 12.1774 12.1774 k = 0.4839 0.2180 0.1430 ( 4114 PWs) bands (ev): -40.5844 -40.5844 -40.5836 -40.5836 -19.6062 -19.6062 -19.6006 -19.6006 -19.1244 -19.1244 -19.1188 -19.1188 -19.0867 -19.0867 -19.0780 -19.0780 -11.5663 -11.5663 -11.5180 -11.5180 -9.9673 -9.9673 -9.9606 -9.9606 -9.9400 -9.9400 -9.9325 -9.9325 1.2287 1.2287 1.2432 1.2432 2.0987 2.0987 2.1052 2.1052 2.1294 2.1294 2.1351 2.1351 3.0930 3.0930 3.2560 3.2560 4.9201 4.9201 4.9311 4.9311 4.9899 4.9899 5.0017 5.0017 5.8888 5.8888 5.9274 5.9274 6.3951 6.3951 6.4118 6.4118 6.4368 6.4368 6.4532 6.4532 12.1251 12.1251 12.1342 12.1342 12.1366 12.1366 12.1418 12.1418 12.1619 12.1619 12.1963 12.1963 k = 0.4677 0.2108 0.1382 ( 4111 PWs) bands (ev): -40.5848 -40.5848 -40.5832 -40.5832 -19.6091 -19.6091 -19.5977 -19.5977 -19.1271 -19.1271 -19.1160 -19.1160 -19.0909 -19.0909 -19.0736 -19.0736 -11.5903 -11.5903 -11.4938 -11.4938 -9.9810 -9.9810 -9.9746 -9.9746 -9.9263 -9.9263 -9.9185 -9.9185 1.2223 1.2223 1.2513 1.2513 2.0834 2.0834 2.0902 2.0902 2.1446 2.1446 2.1500 2.1500 3.0122 3.0122 3.3379 3.3379 4.8858 4.8858 4.8964 4.8964 5.0253 5.0253 5.0375 5.0375 5.8695 5.8695 5.9467 5.9467 6.3746 6.3746 6.3914 6.3914 6.4579 6.4579 6.4741 6.4741 12.1193 12.1193 12.1305 12.1305 12.1328 12.1328 12.1374 12.1374 12.1564 12.1564 12.2166 12.2166 k = 0.4516 0.2035 0.1335 ( 4111 PWs) bands (ev): -40.5852 -40.5852 -40.5828 -40.5828 -19.6119 -19.6119 -19.5949 -19.5949 -19.1299 -19.1299 -19.1132 -19.1132 -19.0951 -19.0951 -19.0692 -19.0692 -11.6142 -11.6142 -11.4697 -11.4697 -9.9945 -9.9945 -9.9885 -9.9885 -9.9126 -9.9126 -9.9045 -9.9045 1.2165 1.2165 1.2599 1.2599 2.0680 2.0680 2.0752 2.0752 2.1596 2.1596 2.1646 2.1646 2.9322 2.9322 3.4196 3.4196 4.8521 4.8521 4.8623 4.8623 5.0610 5.0610 5.0735 5.0735 5.8502 5.8502 5.9660 5.9660 6.3542 6.3542 6.3712 6.3712 6.4790 6.4790 6.4950 6.4950 12.1126 12.1126 12.1169 12.1169 12.1242 12.1242 12.1398 12.1398 12.1570 12.1570 12.2378 12.2378 k = 0.4355 0.1962 0.1287 ( 4117 PWs) bands (ev): -40.5856 -40.5856 -40.5824 -40.5824 -19.6147 -19.6147 -19.5921 -19.5921 -19.1326 -19.1326 -19.1105 -19.1105 -19.0993 -19.0993 -19.0649 -19.0649 -11.6378 -11.6378 -11.4458 -11.4458 -10.0079 -10.0079 -10.0022 -10.0022 -9.8991 -9.8991 -9.8906 -9.8906 1.2114 1.2114 1.2689 1.2689 2.0527 2.0527 2.0602 2.0602 2.1745 2.1745 2.1791 2.1791 2.8532 2.8532 3.5011 3.5011 4.8189 4.8189 4.8288 4.8288 5.0967 5.0967 5.1097 5.1097 5.8309 5.8309 5.9854 5.9854 6.3341 6.3341 6.3512 6.3512 6.5002 6.5002 6.5161 6.5161 12.1009 12.1009 12.1052 12.1052 12.1164 12.1164 12.1412 12.1412 12.1582 12.1582 12.2596 12.2596 k = 0.4194 0.1890 0.1239 ( 4129 PWs) bands (ev): -40.5860 -40.5860 -40.5821 -40.5821 -19.6175 -19.6175 -19.5894 -19.5894 -19.1353 -19.1353 -19.1078 -19.1078 -19.1034 -19.1034 -19.0605 -19.0605 -11.6612 -11.6612 -11.4220 -11.4220 -10.0212 -10.0212 -10.0159 -10.0159 -9.8856 -9.8856 -9.8768 -9.8768 1.2068 1.2068 1.2784 1.2784 2.0374 2.0374 2.0452 2.0452 2.1892 2.1892 2.1935 2.1935 2.7754 2.7754 3.5819 3.5819 4.7865 4.7865 4.7960 4.7960 5.1325 5.1325 5.1458 5.1458 5.8116 5.8116 6.0050 6.0050 6.3142 6.3142 6.3315 6.3315 6.5214 6.5214 6.5371 6.5371 12.0855 12.0855 12.0970 12.0970 12.1079 12.1079 12.1418 12.1418 12.1588 12.1588 12.2820 12.2820 k = 0.4032 0.1817 0.1192 ( 4138 PWs) bands (ev): -40.5863 -40.5863 -40.5817 -40.5817 -19.6203 -19.6203 -19.5867 -19.5867 -19.1380 -19.1380 -19.1073 -19.1073 -19.1051 -19.1051 -19.0562 -19.0562 -11.6842 -11.6842 -11.3985 -11.3985 -10.0342 -10.0342 -10.0292 -10.0292 -9.8723 -9.8723 -9.8632 -9.8632 1.2030 1.2030 1.2882 1.2882 2.0222 2.0222 2.0303 2.0303 2.2037 2.2037 2.2075 2.2075 2.6988 2.6988 3.6619 3.6619 4.7548 4.7548 4.7639 4.7639 5.1682 5.1682 5.1819 5.1819 5.7923 5.7923 6.0247 6.0247 6.2946 6.2946 6.3120 6.3120 6.5426 6.5426 6.5581 6.5581 12.0707 12.0707 12.0882 12.0882 12.0988 12.0988 12.1415 12.1415 12.1587 12.1587 12.3049 12.3049 k = 0.3871 0.1744 0.1144 ( 4138 PWs) bands (ev): -40.5867 -40.5867 -40.5813 -40.5813 -19.6229 -19.6229 -19.5841 -19.5841 -19.1405 -19.1405 -19.1112 -19.1112 -19.1025 -19.1025 -19.0519 -19.0519 -11.7068 -11.7068 -11.3753 -11.3753 -10.0471 -10.0471 -10.0424 -10.0424 -9.8593 -9.8593 -9.8498 -9.8498 1.1998 1.1998 1.2984 1.2984 2.0072 2.0072 2.0156 2.0156 2.2179 2.2179 2.2214 2.2214 2.6237 2.6237 3.7409 3.7409 4.7239 4.7239 4.7326 4.7326 5.2038 5.2038 5.2179 5.2179 5.7732 5.7732 6.0446 6.0446 6.2754 6.2754 6.2929 6.2929 6.5637 6.5637 6.5790 6.5790 12.0569 12.0569 12.0788 12.0788 12.0890 12.0890 12.1403 12.1403 12.1579 12.1579 12.3282 12.3282 k = 0.3710 0.1672 0.1096 ( 4138 PWs) bands (ev): -40.5871 -40.5871 -40.5809 -40.5809 -19.6256 -19.6256 -19.5815 -19.5815 -19.1431 -19.1431 -19.1150 -19.1150 -19.0998 -19.0998 -19.0477 -19.0477 -11.7289 -11.7289 -11.3525 -11.3525 -10.0597 -10.0597 -10.0553 -10.0553 -9.8464 -9.8464 -9.8366 -9.8366 1.1972 1.1972 1.3089 1.3089 1.9924 1.9924 2.0011 2.0011 2.2318 2.2318 2.2349 2.2349 2.5502 2.5502 3.8184 3.8184 4.6939 4.6939 4.7023 4.7023 5.2392 5.2392 5.2536 5.2536 5.7541 5.7541 6.0648 6.0648 6.2565 6.2565 6.2742 6.2742 6.5847 6.5847 6.5998 6.5998 12.0439 12.0439 12.0688 12.0688 12.0788 12.0788 12.1384 12.1384 12.1563 12.1563 12.3517 12.3517 k = 0.3548 0.1599 0.1049 ( 4126 PWs) bands (ev): -40.5874 -40.5874 -40.5806 -40.5806 -19.6282 -19.6282 -19.5789 -19.5789 -19.1456 -19.1456 -19.1186 -19.1186 -19.0972 -19.0972 -19.0434 -19.0434 -11.7506 -11.7506 -11.3301 -11.3301 -10.0719 -10.0719 -10.0679 -10.0679 -9.8337 -9.8337 -9.8236 -9.8236 1.1954 1.1954 1.3196 1.3196 1.9779 1.9779 1.9868 1.9868 2.2454 2.2454 2.2482 2.2482 2.4786 2.4786 3.8942 3.8942 4.6649 4.6649 4.6728 4.6728 5.2742 5.2742 5.2889 5.2889 5.7352 5.7352 6.0853 6.0853 6.2379 6.2379 6.2557 6.2557 6.6055 6.6055 6.6204 6.6204 12.0318 12.0318 12.0584 12.0584 12.0680 12.0680 12.1357 12.1357 12.1539 12.1539 12.3754 12.3754 k = 0.3387 0.1526 0.1001 ( 4135 PWs) bands (ev): -40.5878 -40.5878 -40.5802 -40.5802 -19.6307 -19.6307 -19.5764 -19.5764 -19.1480 -19.1480 -19.1222 -19.1222 -19.0947 -19.0947 -19.0393 -19.0393 -11.7716 -11.7716 -11.3083 -11.3083 -10.0839 -10.0839 -10.0802 -10.0802 -9.8214 -9.8214 -9.8110 -9.8110 1.1942 1.1942 1.3305 1.3305 1.9636 1.9636 1.9728 1.9728 2.2587 2.2587 2.2611 2.2611 2.4088 2.4088 3.9681 3.9681 4.6367 4.6367 4.6443 4.6443 5.3088 5.3088 5.3238 5.3238 5.7165 5.7165 6.1062 6.1062 6.2196 6.2196 6.2377 6.2377 6.6261 6.6261 6.6408 6.6408 12.0206 12.0206 12.0476 12.0476 12.0569 12.0569 12.1324 12.1324 12.1509 12.1509 12.3991 12.3991 k = 0.3226 0.1453 0.0953 ( 4129 PWs) bands (ev): -40.5881 -40.5881 -40.5799 -40.5799 -19.6332 -19.6332 -19.5739 -19.5739 -19.1503 -19.1503 -19.1257 -19.1257 -19.0922 -19.0922 -19.0353 -19.0353 -11.7921 -11.7921 -11.2870 -11.2870 -10.0955 -10.0955 -10.0921 -10.0921 -9.8094 -9.8094 -9.7987 -9.7987 1.1937 1.1937 1.3415 1.3415 1.9497 1.9497 1.9592 1.9592 2.2716 2.2716 2.2735 2.2735 2.3409 2.3409 4.0398 4.0398 4.6097 4.6097 4.6169 4.6169 5.3428 5.3428 5.3582 5.3582 5.6981 5.6981 6.1276 6.1276 6.2018 6.2018 6.2200 6.2200 6.6465 6.6465 6.6610 6.6610 12.0103 12.0103 12.0365 12.0365 12.0454 12.0454 12.1284 12.1284 12.1473 12.1473 12.4228 12.4228 k = 0.3065 0.1381 0.0906 ( 4138 PWs) bands (ev): -40.5885 -40.5885 -40.5796 -40.5796 -19.6356 -19.6356 -19.5716 -19.5716 -19.1526 -19.1526 -19.1290 -19.1290 -19.0899 -19.0899 -19.0313 -19.0313 -11.8119 -11.8119 -11.2663 -11.2663 -10.1068 -10.1068 -10.1037 -10.1037 -9.7978 -9.7978 -9.7867 -9.7867 1.1939 1.1939 1.3525 1.3525 1.9361 1.9361 1.9458 1.9458 2.2744 2.2744 2.2841 2.2841 2.2864 2.2864 4.1089 4.1089 4.5837 4.5837 4.5905 4.5905 5.3763 5.3763 5.3920 5.3920 5.6799 5.6799 6.1494 6.1494 6.1843 6.1843 6.2027 6.2027 6.6665 6.6665 6.6808 6.6808 12.0009 12.0009 12.0251 12.0251 12.0338 12.0338 12.1239 12.1239 12.1431 12.1431 12.4464 12.4464 k = 0.2903 0.1308 0.0858 ( 4141 PWs) bands (ev): -40.5888 -40.5888 -40.5792 -40.5792 -19.6379 -19.6379 -19.5694 -19.5694 -19.1548 -19.1548 -19.1322 -19.1322 -19.0876 -19.0876 -19.0275 -19.0275 -11.8310 -11.8310 -11.2463 -11.2463 -10.1176 -10.1176 -10.1148 -10.1148 -9.7865 -9.7865 -9.7752 -9.7752 1.1947 1.1947 1.3636 1.3636 1.9229 1.9229 1.9328 1.9328 2.2114 2.2114 2.2962 2.2962 2.2976 2.2976 4.1752 4.1752 4.5587 4.5587 4.5653 4.5653 5.4090 5.4090 5.4250 5.4250 5.6622 5.6622 6.1671 6.1671 6.1718 6.1718 6.1857 6.1857 6.6862 6.6862 6.7003 6.7003 11.9922 11.9922 12.0136 12.0136 12.0220 12.0220 12.1189 12.1189 12.1384 12.1384 12.4697 12.4697 k = 0.2742 0.1235 0.0810 ( 4141 PWs) bands (ev): -40.5891 -40.5891 -40.5789 -40.5789 -19.6401 -19.6401 -19.5672 -19.5672 -19.1569 -19.1569 -19.1352 -19.1352 -19.0854 -19.0854 -19.0239 -19.0239 -11.8493 -11.8493 -11.2270 -11.2270 -10.1280 -10.1280 -10.1255 -10.1255 -9.7757 -9.7757 -9.7641 -9.7641 1.1962 1.1962 1.3745 1.3745 1.9101 1.9101 1.9202 1.9202 2.1503 2.1503 2.3078 2.3078 2.3088 2.3088 4.2386 4.2386 4.5350 4.5350 4.5412 4.5412 5.4410 5.4410 5.4573 5.4573 5.6450 5.6450 6.1505 6.1505 6.1692 6.1692 6.1946 6.1946 6.7054 6.7054 6.7193 6.7193 11.9844 11.9844 12.0020 12.0020 12.0102 12.0102 12.1135 12.1135 12.1333 12.1333 12.4926 12.4926 k = 0.2581 0.1163 0.0763 ( 4129 PWs) bands (ev): -40.5894 -40.5894 -40.5786 -40.5786 -19.6422 -19.6422 -19.5651 -19.5651 -19.1589 -19.1589 -19.1380 -19.1380 -19.0832 -19.0832 -19.0202 -19.0202 -11.8668 -11.8668 -11.2085 -11.2085 -10.1380 -10.1380 -10.1357 -10.1357 -9.7653 -9.7653 -9.7534 -9.7534 1.1984 1.1984 1.3854 1.3854 1.8979 1.8979 1.9082 1.9082 2.0914 2.0914 2.3189 2.3189 2.3196 2.3196 4.2986 4.2986 4.5124 4.5124 4.5183 4.5183 5.4722 5.4722 5.4887 5.4887 5.6283 5.6283 6.1342 6.1342 6.1531 6.1531 6.2178 6.2178 6.7241 6.7241 6.7378 6.7378 11.9773 11.9773 11.9904 11.9904 11.9984 11.9984 12.1078 12.1078 12.1279 12.1279 12.5151 12.5151 k = 0.2419 0.1090 0.0715 ( 4135 PWs) bands (ev): -40.5897 -40.5897 -40.5784 -40.5784 -19.6442 -19.6442 -19.5631 -19.5631 -19.1608 -19.1608 -19.1408 -19.1408 -19.0812 -19.0812 -19.0168 -19.0168 -11.8835 -11.8835 -11.1908 -11.1908 -10.1475 -10.1475 -10.1454 -10.1454 -9.7553 -9.7553 -9.7432 -9.7432 1.2013 1.2013 1.3960 1.3960 1.8861 1.8861 1.8966 1.8966 2.0350 2.0350 2.3296 2.3296 2.3299 2.3299 4.3552 4.3552 4.4910 4.4910 4.4966 4.4966 5.5023 5.5023 5.5191 5.5191 5.6122 5.6122 6.1182 6.1182 6.1373 6.1373 6.2414 6.2414 6.7422 6.7422 6.7557 6.7557 11.9709 11.9709 11.9790 11.9790 11.9868 11.9868 12.1019 12.1019 12.1222 12.1222 12.5369 12.5369 k = 0.2258 0.1017 0.0667 ( 4117 PWs) bands (ev): -40.5899 -40.5899 -40.5781 -40.5781 -19.6461 -19.6461 -19.5612 -19.5612 -19.1626 -19.1626 -19.1433 -19.1433 -19.0792 -19.0792 -19.0135 -19.0135 -11.8993 -11.8993 -11.1740 -11.1740 -10.1564 -10.1564 -10.1546 -10.1546 -9.7459 -9.7459 -9.7336 -9.7336 1.2047 1.2047 1.4063 1.4063 1.8749 1.8749 1.8856 1.8856 1.9812 1.9812 2.3397 2.3397 2.3397 2.3397 4.4082 4.4082 4.4709 4.4709 4.4762 4.4762 5.5315 5.5315 5.5486 5.5486 5.5968 5.5968 6.1026 6.1026 6.1219 6.1219 6.2654 6.2654 6.7596 6.7596 6.7729 6.7729 11.9651 11.9651 11.9678 11.9678 11.9754 11.9754 12.0958 12.0958 12.1164 12.1164 12.5580 12.5580 k = 0.2097 0.0945 0.0620 ( 4111 PWs) bands (ev): -40.5902 -40.5902 -40.5778 -40.5778 -19.6479 -19.6479 -19.5595 -19.5595 -19.1643 -19.1643 -19.1457 -19.1457 -19.0774 -19.0774 -19.0104 -19.0104 -11.9142 -11.9142 -11.1582 -11.1582 -10.1649 -10.1649 -10.1633 -10.1633 -9.7370 -9.7370 -9.7245 -9.7245 1.2089 1.2089 1.4163 1.4163 1.8643 1.8643 1.8751 1.8751 1.9299 1.9299 2.3489 2.3489 2.3492 2.3492 4.4519 4.4519 4.4570 4.4570 4.4577 4.4577 5.5594 5.5594 5.5769 5.5769 5.5824 5.5824 6.0874 6.0874 6.1069 6.1069 6.2894 6.2894 6.7763 6.7763 6.7894 6.7894 11.9568 11.9568 11.9598 11.9598 11.9645 11.9645 12.0898 12.0898 12.1105 12.1105 12.5782 12.5782 k = 0.1935 0.0872 0.0572 ( 4099 PWs) bands (ev): -40.5904 -40.5904 -40.5776 -40.5776 -19.6495 -19.6495 -19.5579 -19.5579 -19.1658 -19.1658 -19.1478 -19.1478 -19.0757 -19.0757 -19.0076 -19.0076 -11.9281 -11.9281 -11.1433 -11.1433 -10.1727 -10.1727 -10.1714 -10.1714 -9.7287 -9.7287 -9.7159 -9.7159 1.2136 1.2136 1.4259 1.4259 1.8543 1.8543 1.8652 1.8652 1.8815 1.8815 2.3576 2.3576 2.3582 2.3582 4.4345 4.4345 4.4392 4.4392 4.5029 4.5029 5.5673 5.5673 5.5877 5.5877 5.6042 5.6042 6.0725 6.0725 6.0923 6.0923 6.3133 6.3133 6.7922 6.7922 6.8052 6.8052 11.9463 11.9463 11.9529 11.9530 11.9561 11.9561 12.0837 12.0837 12.1047 12.1047 12.5975 12.5975 k = 0.1774 0.0799 0.0524 ( 4096 PWs) bands (ev): -40.5906 -40.5906 -40.5774 -40.5774 -19.6511 -19.6511 -19.5563 -19.5563 -19.1673 -19.1673 -19.1499 -19.1499 -19.0741 -19.0741 -19.0048 -19.0048 -11.9411 -11.9411 -11.1294 -11.1294 -10.1801 -10.1801 -10.1789 -10.1789 -9.7209 -9.7209 -9.7080 -9.7080 1.2189 1.2189 1.4350 1.4350 1.8355 1.8355 1.8450 1.8450 1.8562 1.8562 2.3657 2.3657 2.3666 2.3666 4.4182 4.4182 4.4227 4.4227 4.5444 4.5444 5.5545 5.5545 5.6133 5.6133 5.6303 5.6303 6.0580 6.0580 6.0781 6.0781 6.3370 6.3370 6.8073 6.8073 6.8200 6.8200 11.9362 11.9362 11.9431 11.9431 11.9516 11.9516 12.0778 12.0778 12.0990 12.0990 12.6157 12.6157 k = 0.1613 0.0727 0.0477 ( 4090 PWs) bands (ev): -40.5908 -40.5908 -40.5772 -40.5772 -19.6525 -19.6525 -19.5550 -19.5550 -19.1686 -19.1686 -19.1517 -19.1517 -19.0726 -19.0726 -19.0024 -19.0024 -11.9530 -11.9530 -11.1166 -11.1166 -10.1868 -10.1868 -10.1859 -10.1859 -9.7138 -9.7138 -9.7006 -9.7006 1.2248 1.2248 1.4436 1.4436 1.7927 1.7927 1.8363 1.8363 1.8476 1.8476 2.3732 2.3732 2.3743 2.3743 4.4033 4.4033 4.4075 4.4075 4.5820 4.5820 5.5424 5.5424 5.6380 5.6380 5.6551 5.6551 6.0438 6.0438 6.0642 6.0642 6.3600 6.3600 6.8213 6.8213 6.8339 6.8339 11.9266 11.9266 11.9335 11.9335 11.9480 11.9480 12.0721 12.0721 12.0934 12.0934 12.6327 12.6327 k = 0.1452 0.0654 0.0429 ( 4096 PWs) bands (ev): -40.5910 -40.5910 -40.5770 -40.5770 -19.6538 -19.6538 -19.5537 -19.5537 -19.1699 -19.1699 -19.1534 -19.1534 -19.0713 -19.0713 -19.0001 -19.0001 -11.9639 -11.9639 -11.1049 -11.1049 -10.1930 -10.1930 -10.1922 -10.1922 -9.7072 -9.7072 -9.6939 -9.6939 1.2312 1.2312 1.4515 1.4515 1.7527 1.7527 1.8284 1.8284 1.8398 1.8398 2.3800 2.3800 2.3813 2.3813 4.3897 4.3897 4.3937 4.3937 4.6157 4.6157 5.5312 5.5312 5.6616 5.6616 5.6787 5.6787 6.0300 6.0300 6.0507 6.0507 6.3823 6.3823 6.8343 6.8343 6.8467 6.8467 11.9177 11.9177 11.9245 11.9245 11.9448 11.9448 12.0667 12.0667 12.0882 12.0882 12.6485 12.6485 k = 0.1290 0.0581 0.0381 ( 4102 PWs) bands (ev): -40.5912 -40.5912 -40.5768 -40.5768 -19.6550 -19.6550 -19.5526 -19.5526 -19.1710 -19.1710 -19.1550 -19.1550 -19.0701 -19.0701 -18.9980 -18.9980 -11.9737 -11.9737 -11.0944 -11.0944 -10.1986 -10.1986 -10.1979 -10.1979 -9.7013 -9.7013 -9.6879 -9.6879 1.2379 1.2379 1.4588 1.4588 1.7158 1.7158 1.8212 1.8212 1.8327 1.8327 2.3861 2.3861 2.3877 2.3877 4.3775 4.3775 4.3813 4.3813 4.6456 4.6456 5.5209 5.5209 5.6838 5.6838 5.7008 5.7008 6.0167 6.0167 6.0377 6.0377 6.4033 6.4033 6.8461 6.8461 6.8584 6.8584 11.9095 11.9095 11.9162 11.9162 11.9420 11.9420 12.0617 12.0617 12.0833 12.0833 12.6628 12.6628 k = 0.1129 0.0509 0.0334 ( 4102 PWs) bands (ev): -40.5913 -40.5913 -40.5767 -40.5767 -19.6560 -19.6560 -19.5516 -19.5516 -19.1720 -19.1720 -19.1563 -19.1563 -19.0690 -19.0690 -18.9962 -18.9962 -11.9824 -11.9824 -11.0850 -11.0850 -10.2035 -10.2035 -10.2030 -10.2030 -9.6961 -9.6961 -9.6825 -9.6825 1.2450 1.2450 1.4654 1.4654 1.6820 1.6820 1.8148 1.8148 1.8264 1.8264 2.3916 2.3916 2.3933 2.3933 4.3667 4.3667 4.3703 4.3703 4.6717 4.6717 5.5118 5.5118 5.7046 5.7046 5.7215 5.7215 6.0037 6.0037 6.0251 6.0251 6.4229 6.4229 6.8568 6.8568 6.8689 6.8689 11.9021 11.9021 11.9087 11.9087 11.9396 11.9396 12.0571 12.0571 12.0788 12.0788 12.6757 12.6757 k = 0.0968 0.0436 0.0286 ( 4108 PWs) bands (ev): -40.5915 -40.5915 -40.5766 -40.5766 -19.6570 -19.6570 -19.5507 -19.5507 -19.1729 -19.1729 -19.1575 -19.1575 -19.0681 -19.0681 -18.9946 -18.9946 -11.9900 -11.9900 -11.0768 -11.0768 -10.2078 -10.2078 -10.2074 -10.2074 -9.6915 -9.6915 -9.6778 -9.6778 1.2522 1.2522 1.4712 1.4712 1.6517 1.6517 1.8092 1.8092 1.8208 1.8208 2.3964 2.3964 2.3983 2.3983 4.3572 4.3572 4.3607 4.3607 4.6940 4.6940 5.5038 5.5038 5.7238 5.7238 5.7405 5.7405 5.9913 5.9913 6.0132 6.0132 6.4406 6.4406 6.8662 6.8662 6.8782 6.8782 11.8955 11.8955 11.9020 11.9020 11.9375 11.9375 12.0529 12.0529 12.0747 12.0747 12.6871 12.6871 k = 0.0806 0.0363 0.0238 ( 4126 PWs) bands (ev): -40.5916 -40.5916 -40.5765 -40.5765 -19.6578 -19.6578 -19.5500 -19.5500 -19.1736 -19.1736 -19.1586 -19.1586 -19.0674 -19.0674 -18.9933 -18.9933 -11.9965 -11.9965 -11.0698 -11.0698 -10.2115 -10.2115 -10.2112 -10.2112 -9.6876 -9.6876 -9.6739 -9.6739 1.2593 1.2593 1.4761 1.4761 1.6248 1.6248 1.8044 1.8044 1.8161 1.8161 2.4005 2.4005 2.4025 2.4025 4.3492 4.3492 4.3526 4.3526 4.7128 4.7128 5.4969 5.4969 5.7413 5.7413 5.7578 5.7578 5.9797 5.9797 6.0019 6.0019 6.4563 6.4563 6.8743 6.8743 6.8862 6.8862 11.8898 11.8898 11.8963 11.8963 11.9358 11.9358 12.0494 12.0494 12.0712 12.0712 12.6968 12.6968 k = 0.0645 0.0291 0.0191 ( 4128 PWs) bands (ev): -40.5917 -40.5917 -40.5764 -40.5764 -19.6584 -19.6584 -19.5494 -19.5494 -19.1742 -19.1742 -19.1594 -19.1594 -19.0667 -19.0667 -18.9921 -18.9921 -12.0018 -12.0018 -11.0641 -11.0641 -10.2146 -10.2146 -10.2143 -10.2143 -9.6844 -9.6844 -9.6706 -9.6706 1.2661 1.2661 1.4803 1.4803 1.6020 1.6020 1.8005 1.8005 1.8122 1.8122 2.4038 2.4038 2.4059 2.4059 4.3427 4.3427 4.3459 4.3459 4.7279 4.7279 5.4912 5.4912 5.7568 5.7568 5.7729 5.7729 5.9690 5.9690 5.9917 5.9917 6.4695 6.4695 6.8809 6.8809 6.8928 6.8928 11.8851 11.8851 11.8915 11.8915 11.9343 11.9343 12.0464 12.0464 12.0683 12.0683 12.7049 12.7049 k = 0.0484 0.0218 0.0143 ( 4134 PWs) bands (ev): -40.5917 -40.5917 -40.5763 -40.5763 -19.6589 -19.6589 -19.5489 -19.5489 -19.1747 -19.1747 -19.1600 -19.1600 -19.0662 -19.0662 -18.9913 -18.9913 -12.0059 -12.0059 -11.0596 -11.0596 -10.2169 -10.2169 -10.2167 -10.2167 -9.6819 -9.6819 -9.6680 -9.6680 1.2720 1.2720 1.4835 1.4835 1.5835 1.5835 1.7974 1.7974 1.8091 1.8091 2.4064 2.4064 2.4087 2.4087 4.3376 4.3376 4.3407 4.3407 4.7396 4.7396 5.4868 5.4868 5.7699 5.7699 5.7856 5.7856 5.9597 5.9597 5.9829 5.9829 6.4801 6.4801 6.8862 6.8862 6.8980 6.8980 11.8814 11.8814 11.8878 11.8878 11.9332 11.9332 12.0440 12.0440 12.0660 12.0660 12.7112 12.7112 k = 0.0323 0.0145 0.0095 ( 4131 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6593 -19.6593 -19.5485 -19.5485 -19.1750 -19.1750 -19.1605 -19.1605 -19.0658 -19.0658 -18.9906 -18.9906 -12.0089 -12.0089 -11.0564 -11.0564 -10.2186 -10.2186 -10.2185 -10.2185 -9.6802 -9.6802 -9.6662 -9.6662 1.2768 1.2768 1.4859 1.4859 1.5699 1.5699 1.7952 1.7952 1.8070 1.8070 2.4083 2.4083 2.4106 2.4106 4.3339 4.3339 4.3370 4.3370 4.7480 4.7480 5.4836 5.4836 5.7800 5.7800 5.7954 5.7954 5.9523 5.9523 5.9760 5.9760 6.4878 6.4878 6.8900 6.8900 6.9017 6.9017 11.8787 11.8787 11.8851 11.8851 11.9324 11.9324 12.0423 12.0423 12.0643 12.0643 12.7158 12.7158 k = 0.0161 0.0073 0.0048 ( 4128 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6595 -19.6595 -19.5483 -19.5483 -19.1752 -19.1752 -19.1608 -19.1608 -19.0656 -19.0656 -18.9903 -18.9903 -12.0106 -12.0106 -11.0545 -11.0545 -10.2196 -10.2196 -10.2195 -10.2195 -9.6791 -9.6791 -9.6651 -9.6651 1.2798 1.2798 1.4872 1.4872 1.5614 1.5614 1.7938 1.7938 1.8056 1.8056 2.4094 2.4094 2.4118 2.4118 4.3318 4.3318 4.3348 4.3348 4.7529 4.7529 5.4817 5.4817 5.7865 5.7865 5.8016 5.8016 5.9475 5.9475 5.9715 5.9715 6.4925 6.4925 6.8922 6.8922 6.9040 6.9040 11.8771 11.8771 11.8834 11.8834 11.9319 11.9319 12.0412 12.0412 12.0633 12.0633 12.7185 12.7185 k = 0.0000 0.0000 0.0000 ( 4113 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6596 -19.6596 -19.5482 -19.5482 -19.1753 -19.1753 -19.1608 -19.1608 -19.0655 -19.0655 -18.9901 -18.9901 -12.0112 -12.0112 -11.0538 -11.0538 -10.2199 -10.2199 -10.2198 -10.2198 -9.6787 -9.6787 -9.6647 -9.6647 1.2809 1.2809 1.4877 1.4877 1.5586 1.5586 1.7935 1.7935 1.8053 1.8053 2.4098 2.4098 2.4122 2.4122 4.3311 4.3311 4.3341 4.3341 4.7546 4.7546 5.4810 5.4810 5.7887 5.7887 5.8037 5.8037 5.9458 5.9458 5.9700 5.9700 6.4940 6.4940 6.8930 6.8930 6.9047 6.9047 11.8765 11.8765 11.8829 11.8829 11.9318 11.9318 12.0409 12.0409 12.0629 12.0629 12.7194 12.7194 k = 0.0000 0.0000 0.0000 ( 4113 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6596 -19.6596 -19.5482 -19.5482 -19.1753 -19.1753 -19.1608 -19.1608 -19.0655 -19.0655 -18.9901 -18.9901 -12.0112 -12.0112 -11.0538 -11.0538 -10.2199 -10.2199 -10.2198 -10.2198 -9.6787 -9.6787 -9.6647 -9.6647 1.2809 1.2809 1.4877 1.4877 1.5586 1.5586 1.7935 1.7935 1.8053 1.8053 2.4098 2.4098 2.4122 2.4122 4.3311 4.3311 4.3341 4.3341 4.7546 4.7546 5.4810 5.4810 5.7887 5.7887 5.8037 5.8037 5.9458 5.9458 5.9700 5.9700 6.4940 6.4940 6.8930 6.8930 6.9047 6.9047 11.8765 11.8765 11.8829 11.8829 11.9318 11.9318 12.0409 12.0409 12.0629 12.0629 12.7194 12.7194 k = 0.0074-0.0066-0.0152 ( 4123 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6595 -19.6595 -19.5483 -19.5483 -19.1753 -19.1753 -19.1608 -19.1608 -19.0656 -19.0656 -18.9902 -18.9902 -12.0105 -12.0105 -11.0545 -11.0545 -10.2197 -10.2197 -10.2192 -10.2192 -9.6792 -9.6792 -9.6652 -9.6652 1.2796 1.2796 1.4879 1.4879 1.5596 1.5596 1.7949 1.7949 1.8068 1.8068 2.4094 2.4094 2.4125 2.4125 4.3272 4.3272 4.3338 4.3338 4.7586 4.7586 5.4825 5.4825 5.7879 5.7879 5.8027 5.8027 5.9452 5.9452 5.9692 5.9692 6.4943 6.4943 6.8917 6.8917 6.9035 6.9035 11.8764 11.8764 11.8828 11.8828 11.9320 11.9320 12.0405 12.0405 12.0625 12.0625 12.7189 12.7189 k = 0.0149-0.0132-0.0303 ( 4117 PWs) bands (ev): -40.5918 -40.5918 -40.5762 -40.5762 -19.6594 -19.6594 -19.5484 -19.5484 -19.1752 -19.1752 -19.1606 -19.1606 -19.0658 -19.0658 -18.9904 -18.9904 -12.0084 -12.0084 -11.0564 -11.0564 -10.2191 -10.2191 -10.2174 -10.2174 -9.6808 -9.6808 -9.6667 -9.6667 1.2758 1.2758 1.4885 1.4885 1.5626 1.5626 1.7989 1.7989 1.8124 1.8124 2.4067 2.4067 2.4151 2.4151 4.3129 4.3129 4.3362 4.3362 4.7702 4.7702 5.4867 5.4867 5.7846 5.7846 5.8004 5.8004 5.9432 5.9432 5.9670 5.9670 6.4951 6.4951 6.8873 6.8873 6.9004 6.9004 11.8762 11.8762 11.8826 11.8826 11.9326 11.9326 12.0393 12.0393 12.0613 12.0613 12.7175 12.7175 k = 0.0223-0.0198-0.0455 ( 4115 PWs) bands (ev): -40.5918 -40.5918 -40.5763 -40.5763 -19.6592 -19.6592 -19.5487 -19.5487 -19.1751 -19.1751 -19.1603 -19.1603 -19.0661 -19.0661 -18.9907 -18.9907 -12.0049 -12.0049 -11.0596 -11.0596 -10.2182 -10.2182 -10.2143 -10.2143 -9.6834 -9.6834 -9.6692 -9.6692 1.2697 1.2697 1.4895 1.4895 1.5677 1.5677 1.8042 1.8042 1.8227 1.8227 2.4016 2.4016 2.4199 2.4199 4.2905 4.2905 4.3406 4.3406 4.7876 4.7876 5.4937 5.4937 5.7777 5.7777 5.7981 5.7981 5.9395 5.9395 5.9638 5.9638 6.4965 6.4965 6.8789 6.8789 6.8964 6.8964 11.8756 11.8756 11.8822 11.8822 11.9336 11.9336 12.0375 12.0375 12.0594 12.0594 12.7152 12.7152 k = 0.0298-0.0263-0.0606 ( 4109 PWs) bands (ev): -40.5917 -40.5917 -40.5763 -40.5763 -19.6590 -19.6590 -19.5490 -19.5490 -19.1750 -19.1750 -19.1599 -19.1599 -19.0665 -19.0665 -18.9911 -18.9911 -12.0000 -12.0000 -11.0641 -11.0641 -10.2169 -10.2169 -10.2101 -10.2101 -9.6872 -9.6872 -9.6724 -9.6724 1.2617 1.2617 1.4908 1.4908 1.5748 1.5748 1.8103 1.8103 1.8379 1.8379 2.3945 2.3945 2.4266 2.4266 4.2620 4.2620 4.3468 4.3468 4.8092 4.8092 5.5033 5.5033 5.7665 5.7665 5.7964 5.7964 5.9334 5.9334 5.9603 5.9603 6.4983 6.4983 6.8661 6.8661 6.8921 6.8921 11.8747 11.8747 11.8814 11.8814 11.9350 11.9350 12.0352 12.0352 12.0570 12.0570 12.7119 12.7119 k = 0.0372-0.0329-0.0758 ( 4113 PWs) bands (ev): -40.5917 -40.5917 -40.5763 -40.5763 -19.6587 -19.6587 -19.5495 -19.5495 -19.1749 -19.1749 -19.1594 -19.1594 -19.0671 -19.0671 -18.9917 -18.9917 -11.9937 -11.9937 -11.0697 -11.0697 -10.2153 -10.2153 -10.2048 -10.2048 -9.6923 -9.6923 -9.6763 -9.6763 1.2522 1.2522 1.4924 1.4924 1.5838 1.5838 1.8175 1.8175 1.8573 1.8573 2.3857 2.3857 2.4352 2.4352 4.2290 4.2290 4.3546 4.3546 4.8332 4.8332 5.5152 5.5152 5.7513 5.7513 5.7949 5.7949 5.9243 5.9243 5.9571 5.9571 6.5007 6.5007 6.8496 6.8496 6.8873 6.8873 11.8732 11.8732 11.8801 11.8801 11.9368 11.9368 12.0327 12.0327 12.0542 12.0542 12.7076 12.7076 k = 0.0447-0.0395-0.0910 ( 4115 PWs) bands (ev): -40.5916 -40.5916 -40.5764 -40.5764 -19.6583 -19.6583 -19.5501 -19.5501 -19.1747 -19.1747 -19.1587 -19.1587 -19.0678 -19.0678 -18.9924 -18.9924 -11.9861 -11.9861 -11.0763 -11.0763 -10.2133 -10.2133 -10.1986 -10.1986 -9.6988 -9.6988 -9.6808 -9.6808 1.2415 1.2415 1.4941 1.4941 1.5948 1.5948 1.8260 1.8260 1.8805 1.8805 2.3752 2.3752 2.4454 2.4454 4.1927 4.1927 4.3641 4.3641 4.8582 4.8582 5.5291 5.5291 5.7326 5.7326 5.7935 5.7935 5.9120 5.9120 5.9547 5.9547 6.5035 6.5035 6.8296 6.8296 6.8819 6.8819 11.8708 11.8708 11.8783 11.8783 11.9388 11.9388 12.0302 12.0302 12.0513 12.0513 12.7025 12.7025 k = 0.0521-0.0461-0.1061 ( 4121 PWs) bands (ev): -40.5915 -40.5915 -40.5765 -40.5765 -19.6579 -19.6579 -19.5507 -19.5507 -19.1745 -19.1745 -19.1580 -19.1580 -19.0686 -19.0686 -18.9933 -18.9933 -11.9772 -11.9772 -11.0840 -11.0840 -10.2109 -10.2109 -10.1915 -10.1915 -9.7066 -9.7066 -9.6858 -9.6858 1.2301 1.2301 1.4961 1.4961 1.6075 1.6075 1.8358 1.8358 1.9070 1.9070 2.3634 2.3634 2.4572 2.4572 4.1544 4.1544 4.3753 4.3753 4.8833 4.8833 5.5446 5.5446 5.7105 5.7105 5.7918 5.7918 5.8965 5.8965 5.9532 5.9532 6.5068 6.5068 6.8066 6.8066 6.8759 6.8759 11.8670 11.8670 11.8759 11.8759 11.9411 11.9411 12.0281 12.0281 12.0487 12.0487 12.6963 12.6963 k = 0.0596-0.0527-0.1213 ( 4121 PWs) bands (ev): -40.5914 -40.5914 -40.5765 -40.5765 -19.6574 -19.6574 -19.5515 -19.5515 -19.1743 -19.1743 -19.1570 -19.1570 -19.0696 -19.0696 -18.9942 -18.9942 -11.9669 -11.9669 -11.0924 -11.0924 -10.2082 -10.2082 -10.1836 -10.1836 -9.7157 -9.7157 -9.6913 -9.6913 1.2183 1.2183 1.4982 1.4982 1.6221 1.6221 1.8468 1.8468 1.9365 1.9365 2.3505 2.3505 2.4705 2.4705 4.1147 4.1147 4.3881 4.3881 4.9077 4.9077 5.5613 5.5613 5.6852 5.6852 5.7898 5.7898 5.8781 5.8781 5.9525 5.9525 6.5104 6.5104 6.7811 6.7811 6.8693 6.8693 11.8613 11.8613 11.8733 11.8733 11.9435 11.9435 12.0264 12.0264 12.0469 12.0469 12.6893 12.6893 k = 0.0670-0.0593-0.1365 ( 4121 PWs) bands (ev): -40.5913 -40.5913 -40.5766 -40.5766 -19.6569 -19.6569 -19.5523 -19.5523 -19.1741 -19.1741 -19.1560 -19.1560 -19.0707 -19.0707 -18.9952 -18.9952 -11.9553 -11.9553 -11.1017 -11.1017 -10.2052 -10.2052 -10.1750 -10.1750 -9.7260 -9.7260 -9.6974 -9.6974 1.2065 1.2065 1.5005 1.5005 1.6383 1.6383 1.8591 1.8591 1.9686 1.9686 2.3368 2.3368 2.4851 2.4851 4.0741 4.0741 4.4023 4.4023 4.9306 4.9306 5.5783 5.5783 5.6569 5.6569 5.7876 5.7876 5.8570 5.8570 5.9530 5.9530 6.5143 6.5143 6.7534 6.7534 6.8624 6.8624 11.8535 11.8535 11.8704 11.8704 11.9459 11.9459 12.0250 12.0250 12.0463 12.0463 12.6813 12.6813 k = 0.0745-0.0659-0.1516 ( 4119 PWs) bands (ev): -40.5912 -40.5912 -40.5767 -40.5767 -19.6563 -19.6563 -19.5532 -19.5532 -19.1738 -19.1738 -19.1548 -19.1548 -19.0719 -19.0719 -18.9964 -18.9964 -11.9425 -11.9425 -11.1116 -11.1116 -10.2018 -10.2018 -10.1660 -10.1660 -9.7374 -9.7374 -9.7039 -9.7039 1.1947 1.1947 1.5029 1.5029 1.6559 1.6559 1.8726 1.8726 2.0032 2.0032 2.3225 2.3225 2.5008 2.5008 4.0332 4.0332 4.4179 4.4179 4.9518 4.9518 5.5946 5.5946 5.6258 5.6258 5.7854 5.7854 5.8335 5.8335 5.9546 5.9546 6.5185 6.5185 6.7239 6.7239 6.8552 6.8552 11.8438 11.8438 11.8671 11.8671 11.9481 11.9481 12.0237 12.0237 12.0476 12.0476 12.6724 12.6724 k = 0.0819-0.0725-0.1668 ( 4115 PWs) bands (ev): -40.5911 -40.5911 -40.5768 -40.5768 -19.6556 -19.6556 -19.5543 -19.5543 -19.1735 -19.1735 -19.1534 -19.1534 -19.0732 -19.0732 -18.9976 -18.9976 -11.9285 -11.9285 -11.1221 -11.1221 -10.1982 -10.1982 -10.1567 -10.1567 -9.7498 -9.7498 -9.7110 -9.7110 1.1834 1.1834 1.5054 1.5054 1.6750 1.6750 1.8872 1.8872 2.0399 2.0399 2.3081 2.3081 2.5174 2.5174 3.9924 3.9924 4.4349 4.4349 4.9707 4.9707 5.5890 5.5890 5.6114 5.6114 5.7832 5.7832 5.8090 5.8090 5.9574 5.9574 6.5229 6.5229 6.6930 6.6930 6.8479 6.8479 11.8323 11.8323 11.8634 11.8634 11.9499 11.9499 12.0228 12.0228 12.0509 12.0509 12.6625 12.6625 k = 0.0894-0.0790-0.1819 ( 4121 PWs) bands (ev): -40.5910 -40.5910 -40.5769 -40.5769 -19.6549 -19.6549 -19.5554 -19.5554 -19.1733 -19.1733 -19.1520 -19.1520 -19.0747 -19.0747 -18.9990 -18.9990 -11.9134 -11.9134 -11.1330 -11.1330 -10.1943 -10.1943 -10.1471 -10.1471 -9.7630 -9.7630 -9.7186 -9.7186 1.1726 1.1726 1.5080 1.5080 1.6951 1.6951 1.9028 1.9028 2.0786 2.0786 2.2940 2.2940 2.5349 2.5349 3.9519 3.9519 4.4531 4.4531 4.9872 4.9872 5.5520 5.5520 5.6218 5.6218 5.7724 5.7724 5.7937 5.7937 5.9613 5.9613 6.5273 6.5273 6.6610 6.6610 6.8408 6.8408 11.8194 11.8194 11.8592 11.8592 11.9510 11.9510 12.0223 12.0223 12.0559 12.0559 12.6518 12.6518 k = 0.0968-0.0856-0.1971 ( 4123 PWs) bands (ev): -40.5908 -40.5908 -40.5771 -40.5771 -19.6541 -19.6541 -19.5566 -19.5566 -19.1730 -19.1730 -19.1504 -19.1504 -19.0762 -19.0762 -19.0004 -19.0004 -11.8971 -11.8971 -11.1442 -11.1442 -10.1902 -10.1902 -10.1375 -10.1375 -9.7771 -9.7771 -9.7268 -9.7268 1.1624 1.1624 1.5107 1.5107 1.7160 1.7160 1.9194 1.9194 2.1192 2.1192 2.2805 2.2805 2.5529 2.5529 3.9121 3.9121 4.4724 4.4724 5.0011 5.0011 5.5112 5.5112 5.6274 5.6274 5.7453 5.7453 5.7973 5.7973 5.9660 5.9660 6.5318 6.5318 6.6283 6.6283 6.8340 6.8340 11.8056 11.8056 11.8544 11.8544 11.9513 11.9513 12.0228 12.0228 12.0624 12.0624 12.6403 12.6403 k = 0.1043-0.0922-0.2123 ( 4120 PWs) bands (ev): -40.5907 -40.5907 -40.5772 -40.5772 -19.6532 -19.6532 -19.5579 -19.5579 -19.1727 -19.1727 -19.1487 -19.1487 -19.0779 -19.0779 -19.0018 -19.0018 -11.8798 -11.8798 -11.1557 -11.1557 -10.1858 -10.1858 -10.1280 -10.1280 -9.7917 -9.7917 -9.7354 -9.7354 1.1531 1.1531 1.5135 1.5135 1.7374 1.7374 1.9370 1.9370 2.1613 2.1613 2.2683 2.2683 2.5713 2.5713 3.8733 3.8733 4.4926 4.4926 5.0122 5.0122 5.4673 5.4673 5.6263 5.6263 5.7144 5.7144 5.8086 5.8086 5.9714 5.9714 6.5363 6.5363 6.5952 6.5952 6.8278 6.8278 11.7913 11.7913 11.8491 11.8491 11.9506 11.9506 12.0244 12.0244 12.0700 12.0700 12.6281 12.6281 k = 0.1117-0.0988-0.2274 ( 4120 PWs) bands (ev): -40.5905 -40.5905 -40.5773 -40.5773 -19.6523 -19.6523 -19.5593 -19.5593 -19.1724 -19.1724 -19.1468 -19.1468 -19.0797 -19.0797 -19.0034 -19.0034 -11.8614 -11.8614 -11.1674 -11.1674 -10.1812 -10.1812 -10.1187 -10.1187 -9.8068 -9.8068 -9.7445 -9.7445 1.1447 1.1447 1.5164 1.5164 1.7588 1.7588 1.9554 1.9554 2.2049 2.2049 2.2578 2.2578 2.5899 2.5899 3.8354 3.8354 4.5135 4.5135 5.0206 5.0206 5.4203 5.4203 5.6187 5.6187 5.6822 5.6822 5.8254 5.8254 5.9768 5.9768 6.5405 6.5405 6.5620 6.5620 6.8224 6.8224 11.7768 11.7768 11.8432 11.8432 11.9490 11.9490 12.0272 12.0272 12.0782 12.0782 12.6152 12.6152 k = 0.1192-0.1054-0.2426 ( 4120 PWs) bands (ev): -40.5903 -40.5903 -40.5775 -40.5775 -19.6514 -19.6514 -19.5607 -19.5607 -19.1720 -19.1720 -19.1448 -19.1448 -19.0816 -19.0816 -19.0050 -19.0050 -11.8422 -11.8422 -11.1791 -11.1791 -10.1764 -10.1764 -10.1100 -10.1100 -9.8221 -9.8221 -9.7541 -9.7541 1.1374 1.1374 1.5193 1.5193 1.7795 1.7795 1.9747 1.9747 2.2466 2.2466 2.2529 2.2529 2.6084 2.6084 3.7990 3.7990 4.5350 4.5350 5.0263 5.0263 5.3707 5.3707 5.6055 5.6055 5.6492 5.6492 5.8461 5.8461 5.9821 5.9821 6.5280 6.5280 6.5455 6.5455 6.8179 6.8179 11.7626 11.7626 11.8369 11.8369 11.9465 11.9465 12.0312 12.0312 12.0868 12.0868 12.6019 12.6019 k = 0.1266-0.1120-0.2577 ( 4126 PWs) bands (ev): -40.5901 -40.5901 -40.5777 -40.5777 -19.6504 -19.6504 -19.5622 -19.5622 -19.1717 -19.1717 -19.1427 -19.1427 -19.0836 -19.0836 -19.0066 -19.0066 -11.8220 -11.8220 -11.1908 -11.1908 -10.1714 -10.1714 -10.1021 -10.1021 -9.8375 -9.8375 -9.7642 -9.7642 1.1310 1.1310 1.5223 1.5223 1.7991 1.7991 1.9947 1.9947 2.2443 2.2443 2.2961 2.2961 2.6266 2.6266 3.7641 3.7641 4.5567 4.5567 5.0293 5.0293 5.3186 5.3186 5.5878 5.5878 5.6160 5.6160 5.8694 5.8694 5.9866 5.9866 6.4951 6.4951 6.5496 6.5496 6.8146 6.8146 11.7490 11.7490 11.8300 11.8300 11.9432 11.9432 12.0362 12.0362 12.0953 12.0953 12.5884 12.5884 k = 0.1341-0.1186-0.2729 ( 4122 PWs) bands (ev): -40.5900 -40.5900 -40.5778 -40.5778 -19.6494 -19.6494 -19.5638 -19.5638 -19.1714 -19.1714 -19.1404 -19.1404 -19.0856 -19.0856 -19.0083 -19.0083 -11.8011 -11.8011 -11.2023 -11.2023 -10.1664 -10.1664 -10.0951 -10.0951 -9.8525 -9.8525 -9.7746 -9.7746 1.1259 1.1259 1.5253 1.5253 1.8166 1.8166 2.0156 2.0156 2.2432 2.2432 2.3429 2.3429 2.6444 2.6444 3.7310 3.7310 4.5784 4.5784 5.0299 5.0299 5.2645 5.2645 5.5664 5.5664 5.5830 5.5830 5.8938 5.8938 5.9904 5.9904 6.4623 6.4623 6.5540 6.5540 6.8127 6.8127 11.7363 11.7363 11.8228 11.8228 11.9394 11.9394 12.0419 12.0419 12.1034 12.1034 12.5749 12.5749 k = 0.1415-0.1252-0.2881 ( 4130 PWs) bands (ev): -40.5898 -40.5898 -40.5780 -40.5780 -19.6484 -19.6484 -19.5655 -19.5655 -19.1710 -19.1710 -19.1381 -19.1381 -19.0878 -19.0878 -19.0100 -19.0100 -11.7794 -11.7794 -11.2138 -11.2138 -10.1612 -10.1612 -10.0896 -10.0896 -9.8668 -9.8668 -9.7854 -9.7854 1.1218 1.1218 1.5283 1.5283 1.8316 1.8316 2.0370 2.0370 2.2465 2.2465 2.3904 2.3904 2.6615 2.6615 3.6997 3.6997 4.5995 4.5995 5.0281 5.0281 5.2091 5.2091 5.5420 5.5420 5.5507 5.5507 5.9179 5.9179 5.9934 5.9934 6.4300 6.4300 6.5585 6.5585 6.8122 6.8122 11.7247 11.7247 11.8152 11.8152 11.9349 11.9349 12.0484 12.0484 12.1107 12.1107 12.5617 12.5617 k = 0.1490-0.1317-0.3032 ( 4132 PWs) bands (ev): -40.5895 -40.5895 -40.5782 -40.5782 -19.6473 -19.6473 -19.5672 -19.5672 -19.1706 -19.1706 -19.1357 -19.1357 -19.0901 -19.0901 -19.0117 -19.0117 -11.7571 -11.7571 -11.2250 -11.2250 -10.1560 -10.1560 -10.0857 -10.0857 -9.8800 -9.8800 -9.7964 -9.7964 1.1190 1.1190 1.5314 1.5314 1.8436 1.8436 2.0589 2.0589 2.2550 2.2550 2.4382 2.4382 2.6777 2.6777 3.6705 3.6705 4.6195 4.6195 5.0241 5.0241 5.1533 5.1533 5.5142 5.5142 5.5201 5.5201 5.9393 5.9393 5.9970 5.9970 6.3982 6.3982 6.5634 6.5634 6.8132 6.8132 11.7145 11.7145 11.8075 11.8075 11.9300 11.9300 12.0553 12.0553 12.1169 12.1169 12.5491 12.5491 k = 0.1564-0.1383-0.3184 ( 4138 PWs) bands (ev): -40.5893 -40.5893 -40.5784 -40.5784 -19.6462 -19.6462 -19.5689 -19.5689 -19.1702 -19.1702 -19.1332 -19.1332 -19.0924 -19.0924 -19.0135 -19.0135 -11.7342 -11.7342 -11.2360 -11.2360 -10.1507 -10.1507 -10.0841 -10.0841 -9.8917 -9.8917 -9.8078 -9.8078 1.1175 1.1175 1.5344 1.5344 1.8525 1.8525 2.0807 2.0807 2.2691 2.2691 2.4862 2.4862 2.6927 2.6927 3.6435 3.6435 4.6376 4.6376 5.0179 5.0179 5.0982 5.0982 5.4844 5.4844 5.4906 5.4906 5.9537 5.9537 6.0048 6.0048 6.3671 6.3671 6.5687 6.5687 6.8157 6.8157 11.7058 11.7058 11.7995 11.7995 11.9247 11.9247 12.0627 12.0627 12.1216 12.1216 12.5376 12.5376 k = 0.1639-0.1449-0.3336 ( 4140 PWs) bands (ev): -40.5891 -40.5891 -40.5786 -40.5786 -19.6451 -19.6451 -19.5707 -19.5707 -19.1698 -19.1698 -19.1305 -19.1305 -19.0948 -19.0948 -19.0152 -19.0152 -11.7109 -11.7109 -11.2466 -11.2466 -10.1455 -10.1455 -10.0849 -10.0849 -9.9014 -9.9014 -9.8194 -9.8194 1.1172 1.1172 1.5374 1.5374 1.8584 1.8584 2.1021 2.1021 2.2890 2.2890 2.5339 2.5339 2.7065 2.7065 3.6188 3.6188 4.6525 4.6525 5.0096 5.0096 5.0457 5.0457 5.4546 5.4546 5.4606 5.4606 5.9570 5.9570 6.0200 6.0200 6.3367 6.3367 6.5745 6.5745 6.8197 6.8197 11.6988 11.6988 11.7915 11.7915 11.9189 11.9189 12.0703 12.0703 12.1244 12.1244 12.5273 12.5273 k = 0.1713-0.1515-0.3487 ( 4136 PWs) bands (ev): -40.5889 -40.5889 -40.5788 -40.5788 -19.6439 -19.6439 -19.5725 -19.5725 -19.1694 -19.1694 -19.1278 -19.1278 -19.0972 -19.0972 -19.0169 -19.0169 -11.6872 -11.6872 -11.2568 -11.2568 -10.1404 -10.1404 -10.0886 -10.0886 -9.9088 -9.9088 -9.8311 -9.8311 1.1182 1.1182 1.5404 1.5404 1.8618 1.8618 2.1226 2.1226 2.3146 2.3146 2.5810 2.5810 2.7187 2.7187 3.5967 3.5967 4.6623 4.6623 4.9929 4.9929 5.0046 5.0046 5.4257 5.4257 5.4297 5.4297 5.9517 5.9517 6.0397 6.0397 6.3073 6.3073 6.5811 6.5811 6.8251 6.8251 11.6934 11.6934 11.7835 11.7835 11.9126 11.9126 12.0782 12.0782 12.1251 12.1251 12.5187 12.5187 k = 0.1788-0.1581-0.3639 ( 4138 PWs) bands (ev): -40.5887 -40.5887 -40.5790 -40.5790 -19.6428 -19.6428 -19.5744 -19.5744 -19.1689 -19.1689 -19.1250 -19.1250 -19.0997 -19.0997 -19.0187 -19.0187 -11.6633 -11.6633 -11.2667 -11.2667 -10.1355 -10.1355 -10.0950 -10.0950 -9.9137 -9.9137 -9.8428 -9.8428 1.1204 1.1204 1.5432 1.5432 1.8632 1.8632 2.1418 2.1418 2.3456 2.3456 2.6271 2.6271 2.7292 2.7292 3.5770 3.5770 4.6644 4.6644 4.9551 4.9551 4.9905 4.9905 5.3956 5.3956 5.4004 5.4004 5.9411 5.9411 6.0604 6.0604 6.2788 6.2788 6.5884 6.5884 6.8317 6.8317 11.6899 11.6899 11.7755 11.7755 11.9058 11.9058 12.0863 12.0863 12.1234 12.1234 12.5119 12.5119 k = 0.1862-0.1647-0.3790 ( 4134 PWs) bands (ev): -40.5884 -40.5884 -40.5792 -40.5792 -19.6415 -19.6415 -19.5763 -19.5763 -19.1684 -19.1684 -19.1222 -19.1222 -19.1022 -19.1022 -19.0204 -19.0204 -11.6392 -11.6392 -11.2760 -11.2760 -10.1309 -10.1309 -10.1040 -10.1040 -9.9165 -9.9165 -9.8546 -9.8546 1.1240 1.1240 1.5459 1.5459 1.8633 1.8633 2.1598 2.1598 2.3811 2.3811 2.6714 2.6714 2.7380 2.7380 3.5600 3.5600 4.6560 4.6560 4.9256 4.9256 4.9775 4.9775 5.3628 5.3628 5.3746 5.3746 5.9266 5.9266 6.0803 6.0803 6.2515 6.2515 6.5966 6.5966 6.8393 6.8393 11.6880 11.6880 11.7677 11.7677 11.8985 11.8985 12.0945 12.0945 12.1194 12.1194 12.5071 12.5071 k = 0.1937-0.1713-0.3942 ( 4126 PWs) bands (ev): -40.5882 -40.5882 -40.5794 -40.5794 -19.6403 -19.6403 -19.5782 -19.5782 -19.1679 -19.1679 -19.1195 -19.1195 -19.1046 -19.1046 -19.0220 -19.0220 -11.6152 -11.6152 -11.2849 -11.2849 -10.1266 -10.1266 -10.1149 -10.1149 -9.9174 -9.9174 -9.8662 -9.8662 1.1288 1.1288 1.5484 1.5484 1.8628 1.8628 2.1765 2.1765 2.4207 2.4207 2.7127 2.7127 2.7458 2.7458 3.5457 3.5457 4.6362 4.6362 4.9082 4.9082 4.9634 4.9634 5.3288 5.3288 5.3513 5.3513 5.9089 5.9089 6.0987 6.0987 6.2255 6.2255 6.6057 6.6057 6.8478 6.8478 11.6880 11.6880 11.7601 11.7601 11.8906 11.8906 12.1026 12.1026 12.1132 12.1132 12.5040 12.5040 k = 0.2011-0.1779-0.4094 ( 4136 PWs) bands (ev): -40.5880 -40.5880 -40.5796 -40.5796 -19.6392 -19.6392 -19.5802 -19.5802 -19.1674 -19.1674 -19.1171 -19.1171 -19.1067 -19.1067 -19.0237 -19.0237 -11.5914 -11.5914 -11.2932 -11.2932 -10.1279 -10.1279 -10.1223 -10.1223 -9.9169 -9.9169 -9.8775 -9.8775 1.1348 1.1348 1.5506 1.5506 1.8620 1.8620 2.1918 2.1918 2.4636 2.4636 2.7403 2.7403 2.7623 2.7623 3.5340 3.5340 4.6073 4.6073 4.9014 4.9014 4.9480 4.9480 5.2942 5.2942 5.3301 5.3301 5.8885 5.8885 6.1152 6.1152 6.2008 6.2008 6.6157 6.6157 6.8567 6.8567 11.6896 11.6896 11.7528 11.7528 11.8821 11.8821 12.1040 12.1040 12.1118 12.1118 12.5027 12.5027 k = 0.2086-0.1844-0.4245 ( 4134 PWs) bands (ev): -40.5877 -40.5877 -40.5798 -40.5798 -19.6379 -19.6379 -19.5822 -19.5822 -19.1668 -19.1668 -19.1157 -19.1157 -19.1076 -19.1076 -19.0253 -19.0253 -11.5678 -11.5678 -11.3010 -11.3010 -10.1411 -10.1411 -10.1192 -10.1192 -9.9155 -9.9155 -9.8883 -9.8883 1.1421 1.1421 1.5525 1.5525 1.8614 1.8614 2.2058 2.2058 2.5093 2.5093 2.7454 2.7454 2.7960 2.7960 3.5250 3.5250 4.5734 4.5734 4.9012 4.9012 4.9316 4.9316 5.2592 5.2592 5.3113 5.3113 5.8656 5.8656 6.1295 6.1295 6.1777 6.1777 6.6268 6.6268 6.8660 6.8660 11.6927 11.6927 11.7457 11.7457 11.8729 11.8729 12.0940 12.0940 12.1200 12.1200 12.5026 12.5026 k = 0.2160-0.1910-0.4397 ( 4134 PWs) bands (ev): -40.5875 -40.5875 -40.5801 -40.5801 -19.6367 -19.6367 -19.5841 -19.5841 -19.1663 -19.1663 -19.1164 -19.1164 -19.1066 -19.1066 -19.0269 -19.0269 -11.5446 -11.5446 -11.3082 -11.3082 -10.1549 -10.1549 -10.1167 -10.1167 -9.9138 -9.9138 -9.8984 -9.8984 1.1506 1.1506 1.5540 1.5540 1.8615 1.8615 2.2186 2.2186 2.5572 2.5572 2.7445 2.7445 2.8292 2.8292 3.5185 3.5185 4.5386 4.5386 4.9026 4.9026 4.9161 4.9161 5.2242 5.2242 5.2948 5.2948 5.8405 5.8405 6.1415 6.1415 6.1565 6.1565 6.6389 6.6389 6.8752 6.8752 11.6973 11.6973 11.7391 11.7391 11.8632 11.8632 12.0824 12.0824 12.1285 12.1285 12.5035 12.5035 k = 0.2235-0.1976-0.4549 ( 4130 PWs) bands (ev): -40.5872 -40.5872 -40.5803 -40.5803 -19.6356 -19.6356 -19.5861 -19.5861 -19.1657 -19.1657 -19.1184 -19.1184 -19.1041 -19.1041 -19.0284 -19.0284 -11.5221 -11.5221 -11.3149 -11.3149 -10.1688 -10.1688 -10.1152 -10.1152 -9.9130 -9.9130 -9.9064 -9.9064 1.1603 1.1603 1.5550 1.5550 1.8624 1.8624 2.2302 2.2302 2.6070 2.6070 2.7402 2.7402 2.8589 2.8589 3.5146 3.5146 4.5057 4.5057 4.8908 4.8908 4.9140 4.9140 5.1894 5.1894 5.2807 5.2807 5.8136 5.8136 6.1361 6.1361 6.1522 6.1522 6.6519 6.6519 6.8840 6.8840 11.7031 11.7031 11.7329 11.7329 11.8527 11.8527 12.0699 12.0699 12.1371 12.1371 12.5048 12.5048 k = 0.2309-0.2042-0.4700 ( 4138 PWs) bands (ev): -40.5870 -40.5870 -40.5805 -40.5805 -19.6345 -19.6345 -19.5880 -19.5880 -19.1651 -19.1651 -19.1209 -19.1209 -19.1012 -19.1012 -19.0299 -19.0299 -11.5003 -11.5003 -11.3209 -11.3209 -10.1822 -10.1822 -10.1147 -10.1147 -9.9184 -9.9184 -9.9073 -9.9073 1.1712 1.1712 1.5555 1.5555 1.8645 1.8645 2.2407 2.2407 2.6583 2.6583 2.7327 2.7327 2.8841 2.8841 3.5128 3.5128 4.4767 4.4767 4.8706 4.8706 4.9189 4.9189 5.1551 5.1551 5.2688 5.2688 5.7852 5.7852 6.1186 6.1186 6.1599 6.1599 6.6657 6.6657 6.8921 6.8921 11.7096 11.7096 11.7277 11.7277 11.8417 11.8417 12.0568 12.0568 12.1458 12.1458 12.5063 12.5063 k = 0.2384-0.2108-0.4852 ( 4142 PWs) bands (ev): -40.5867 -40.5867 -40.5808 -40.5808 -19.6333 -19.6333 -19.5899 -19.5899 -19.1645 -19.1645 -19.1236 -19.1236 -19.0981 -19.0981 -19.0313 -19.0313 -11.4794 -11.4794 -11.3264 -11.3264 -10.1950 -10.1950 -10.1156 -10.1156 -9.9254 -9.9254 -9.9054 -9.9054 1.1831 1.1831 1.5552 1.5552 1.8678 1.8678 2.2501 2.2501 2.7101 2.7101 2.7226 2.7226 2.9046 2.9046 3.5132 3.5132 4.4529 4.4529 4.8481 4.8481 4.9240 4.9240 5.1218 5.1218 5.2591 5.2591 5.7555 5.7555 6.1030 6.1030 6.1658 6.1658 6.6803 6.6803 6.8993 6.8993 11.7142 11.7142 11.7256 11.7256 11.8300 11.8300 12.0437 12.0437 12.1546 12.1546 12.5075 12.5075 k = 0.2458-0.2174-0.5003 ( 4140 PWs) bands (ev): -40.5865 -40.5865 -40.5810 -40.5810 -19.6323 -19.6323 -19.5918 -19.5918 -19.1639 -19.1639 -19.1264 -19.1264 -19.0948 -19.0948 -19.0326 -19.0326 -11.4595 -11.4595 -11.3312 -11.3312 -10.2067 -10.2067 -10.1179 -10.1179 -9.9313 -9.9313 -9.9035 -9.9035 1.1961 1.1961 1.5540 1.5540 1.8726 1.8726 2.2586 2.2586 2.7076 2.7076 2.7646 2.7646 2.9200 2.9200 3.5153 3.5153 4.4352 4.4352 4.8236 4.8236 4.9286 4.9286 5.0899 5.0899 5.2512 5.2512 5.7248 5.7248 6.0895 6.0895 6.1700 6.1700 6.6955 6.6955 6.9053 6.9053 11.7124 11.7124 11.7310 11.7310 11.8177 11.8177 12.0309 12.0309 12.1635 12.1635 12.5080 12.5080 k = 0.2532-0.2240-0.5155 ( 4134 PWs) bands (ev): -40.5862 -40.5862 -40.5812 -40.5812 -19.6312 -19.6312 -19.5936 -19.5936 -19.1632 -19.1632 -19.1292 -19.1292 -19.0915 -19.0915 -19.0339 -19.0339 -11.4409 -11.4409 -11.3354 -11.3354 -10.2173 -10.2173 -10.1218 -10.1218 -9.9359 -9.9359 -9.9017 -9.9017 1.2102 1.2102 1.5519 1.5519 1.8790 1.8790 2.2663 2.2663 2.6906 2.6906 2.8185 2.8185 2.9303 2.9303 3.5190 3.5190 4.4239 4.4239 4.7971 4.7971 4.9326 4.9326 5.0598 5.0598 5.2449 5.2449 5.6935 5.6935 6.0782 6.0782 6.1727 6.1727 6.7111 6.7111 6.9098 6.9098 11.7081 11.7081 11.7397 11.7397 11.8050 11.8050 12.0188 12.0188 12.1725 12.1725 12.5075 12.5075 k = 0.2607-0.2306-0.5307 ( 4134 PWs) bands (ev): -40.5860 -40.5860 -40.5815 -40.5815 -19.6302 -19.6302 -19.5954 -19.5954 -19.1625 -19.1625 -19.1321 -19.1321 -19.0881 -19.0881 -19.0351 -19.0351 -11.4237 -11.4237 -11.3390 -11.3390 -10.2264 -10.2264 -10.1273 -10.1273 -9.9390 -9.9390 -9.9003 -9.9003 1.2252 1.2252 1.5486 1.5486 1.8870 1.8870 2.2733 2.2733 2.6705 2.6705 2.8728 2.8728 2.9359 2.9359 3.5238 3.5238 4.4188 4.4188 4.7685 4.7685 4.9362 4.9362 5.0319 5.0319 5.2399 5.2399 5.6616 5.6616 6.0690 6.0690 6.1742 6.1742 6.7269 6.7269 6.9126 6.9126 11.7034 11.7034 11.7491 11.7491 11.7921 11.7921 12.0079 12.0079 12.1816 12.1816 12.5058 12.5058 k = 0.2681-0.2371-0.5458 ( 4130 PWs) bands (ev): -40.5857 -40.5857 -40.5817 -40.5817 -19.6293 -19.6293 -19.5971 -19.5971 -19.1618 -19.1618 -19.1349 -19.1349 -19.0847 -19.0847 -19.0362 -19.0362 -11.4080 -11.4080 -11.3419 -11.3419 -10.2340 -10.2340 -10.1343 -10.1343 -9.9407 -9.9407 -9.8994 -9.8994 1.2412 1.2412 1.5439 1.5439 1.8967 1.8967 2.2797 2.2797 2.6476 2.6476 2.9270 2.9270 2.9371 2.9371 3.5295 3.5295 4.4195 4.4195 4.7379 4.7379 4.9399 4.9399 5.0064 5.0064 5.2358 5.2358 5.6297 5.6297 6.0618 6.0618 6.1747 6.1747 6.7428 6.7428 6.9136 6.9136 11.6986 11.6986 11.7575 11.7575 11.7801 11.7801 11.9984 11.9984 12.1908 12.1908 12.5026 12.5026 k = 0.2756-0.2437-0.5610 ( 4124 PWs) bands (ev): -40.5855 -40.5855 -40.5819 -40.5819 -19.6285 -19.6285 -19.5986 -19.5986 -19.1612 -19.1612 -19.1376 -19.1376 -19.0814 -19.0814 -19.0372 -19.0372 -11.3940 -11.3940 -11.3443 -11.3443 -10.2398 -10.2398 -10.1426 -10.1426 -9.9411 -9.9411 -9.8988 -9.8988 1.2580 1.2580 1.5376 1.5376 1.9082 1.9082 2.2859 2.2859 2.6222 2.6222 2.9339 2.9339 2.9814 2.9814 3.5357 3.5357 4.4251 4.4251 4.7052 4.7052 4.9440 4.9440 4.9837 4.9837 5.2325 5.2325 5.5978 5.5978 6.0566 6.0566 6.1745 6.1745 6.7586 6.7586 6.9125 6.9125 11.6935 11.6935 11.7586 11.7586 11.7751 11.7751 11.9908 11.9908 12.2003 12.2003 12.4979 12.4979 k = 0.2830-0.2503-0.5761 ( 4132 PWs) bands (ev): -40.5852 -40.5852 -40.5822 -40.5822 -19.6278 -19.6278 -19.6001 -19.6001 -19.1605 -19.1605 -19.1404 -19.1404 -19.0782 -19.0782 -19.0381 -19.0381 -11.3817 -11.3817 -11.3461 -11.3461 -10.2438 -10.2438 -10.1521 -10.1521 -9.9403 -9.9403 -9.8987 -9.8987 1.2756 1.2756 1.5296 1.5296 1.9214 1.9214 2.2918 2.2918 2.5948 2.5948 2.9276 2.9276 3.0348 3.0348 3.5419 3.5419 4.4347 4.4347 4.6707 4.6707 4.9486 4.9486 4.9642 4.9642 5.2297 5.2297 5.5663 5.5663 6.0533 6.0533 6.1737 6.1737 6.7742 6.7742 6.9094 6.9094 11.6875 11.6875 11.7487 11.7487 11.7809 11.7809 11.9854 11.9854 12.2099 12.2099 12.4915 12.4915 k = 0.2905-0.2569-0.5913 ( 4138 PWs) bands (ev): -40.5850 -40.5850 -40.5824 -40.5824 -19.6273 -19.6273 -19.6015 -19.6015 -19.1599 -19.1599 -19.1431 -19.1431 -19.0750 -19.0750 -19.0390 -19.0390 -11.3713 -11.3713 -11.3472 -11.3472 -10.2460 -10.2460 -10.1626 -10.1626 -9.9386 -9.9386 -9.8990 -9.8990 1.2939 1.2939 1.5197 1.5197 1.9365 1.9365 2.2977 2.2977 2.5658 2.5658 2.9187 2.9187 3.0873 3.0873 3.5479 3.5479 4.4471 4.4471 4.6348 4.6348 4.9447 4.9447 4.9578 4.9578 5.2274 5.2274 5.5355 5.5355 6.0515 6.0515 6.1726 6.1726 6.7893 6.7893 6.9041 6.9041 11.6801 11.6801 11.7378 11.7378 11.7879 11.7879 11.9827 11.9827 12.2197 12.2197 12.4833 12.4833 k = 0.2979-0.2635-0.6065 ( 4136 PWs) bands (ev): -40.5848 -40.5848 -40.5826 -40.5826 -19.6268 -19.6268 -19.6027 -19.6027 -19.1594 -19.1594 -19.1456 -19.1456 -19.0718 -19.0718 -19.0396 -19.0396 -11.3628 -11.3628 -11.3477 -11.3477 -10.2461 -10.2461 -10.1739 -10.1739 -9.9361 -9.9361 -9.8997 -9.8997 1.3130 1.3130 1.5076 1.5076 1.9534 1.9534 2.3037 2.3037 2.5358 2.5358 2.9076 2.9076 3.1385 3.1385 3.5532 3.5532 4.4608 4.4608 4.5977 4.5977 4.9310 4.9310 4.9662 4.9662 5.2255 5.2255 5.5055 5.5055 6.0511 6.0511 6.1713 6.1713 6.8038 6.8038 6.8968 6.8968 11.6704 11.6704 11.7287 11.7287 11.7938 11.7938 11.9828 11.9828 12.2296 12.2296 12.4734 12.4734 k = 0.3054-0.2701-0.6216 ( 4136 PWs) bands (ev): -40.5845 -40.5845 -40.5829 -40.5829 -19.6266 -19.6266 -19.6037 -19.6037 -19.1589 -19.1589 -19.1480 -19.1480 -19.0689 -19.0689 -19.0401 -19.0401 -11.3562 -11.3562 -11.3475 -11.3475 -10.2444 -10.2444 -10.1857 -10.1857 -9.9330 -9.9330 -9.9009 -9.9009 1.3326 1.3326 1.4933 1.4933 1.9720 1.9720 2.3101 2.3101 2.5054 2.5054 2.8950 2.8950 3.1879 3.1879 3.5575 3.5575 4.4745 4.4745 4.5600 4.5600 4.9193 4.9193 4.9780 4.9780 5.2241 5.2241 5.4767 5.4767 6.0519 6.0519 6.1700 6.1700 6.8174 6.8174 6.8875 6.8875 11.6579 11.6579 11.7221 11.7221 11.7980 11.7980 11.9859 11.9859 12.2398 12.2398 12.4619 12.4619 k = 0.3128-0.2767-0.6368 ( 4136 PWs) bands (ev): -40.5843 -40.5843 -40.5831 -40.5831 -19.6265 -19.6265 -19.6046 -19.6046 -19.1587 -19.1587 -19.1501 -19.1501 -19.0661 -19.0661 -19.0405 -19.0405 -11.3517 -11.3517 -11.3466 -11.3466 -10.2408 -10.2408 -10.1979 -10.1979 -9.9295 -9.9295 -9.9025 -9.9025 1.3529 1.3529 1.4766 1.4766 1.9924 1.9924 2.3170 2.3170 2.4750 2.4750 2.8814 2.8814 3.2351 3.2351 3.5605 3.5605 4.4870 4.4870 4.5223 4.5223 4.9104 4.9104 4.9933 4.9933 5.2231 5.2231 5.4493 5.4493 6.0537 6.0537 6.1689 6.1689 6.8294 6.8294 6.8770 6.8770 11.6430 11.6430 11.7180 11.7180 11.8005 11.8005 11.9919 11.9919 12.2501 12.2501 12.4488 12.4488 k = 0.3203-0.2833-0.6520 ( 4124 PWs) bands (ev): -40.5841 -40.5841 -40.5833 -40.5833 -19.6266 -19.6266 -19.6052 -19.6052 -19.1590 -19.1590 -19.1516 -19.1516 -19.0635 -19.0635 -19.0405 -19.0405 -11.3490 -11.3490 -11.3451 -11.3451 -10.2355 -10.2355 -10.2104 -10.2104 -9.9256 -9.9256 -9.9045 -9.9045 1.3736 1.3736 1.4574 1.4574 2.0146 2.0146 2.3244 2.3244 2.4452 2.4452 2.8672 2.8672 3.2795 3.2795 3.5619 3.5619 4.4829 4.4829 4.4991 4.4991 4.9042 4.9042 5.0123 5.0123 5.2227 5.2227 5.4236 5.4236 6.0561 6.0561 6.1680 6.1680 6.8370 6.8370 6.8680 6.8680 11.6262 11.6262 11.7157 11.7157 11.8012 11.8012 12.0004 12.0004 12.2606 12.2606 12.4344 12.4344 k = 0.3277-0.2898-0.6671 ( 4122 PWs) bands (ev): -40.5839 -40.5839 -40.5835 -40.5835 -19.6269 -19.6269 -19.6056 -19.6056 -19.1599 -19.1599 -19.1523 -19.1523 -19.0612 -19.0612 -19.0402 -19.0402 -11.3470 -11.3470 -11.3442 -11.3442 -10.2287 -10.2287 -10.2227 -10.2227 -9.9215 -9.9215 -9.9067 -9.9067 1.3948 1.3948 1.4358 1.4358 2.0383 2.0383 2.3327 2.3327 2.4162 2.4162 2.8527 2.8527 3.3204 3.3204 3.5615 3.5615 4.4463 4.4463 4.5062 4.5062 4.9007 4.9007 5.0349 5.0349 5.2229 5.2229 5.3997 5.3997 6.0590 6.0590 6.1674 6.1674 6.8325 6.8325 6.8681 6.8681 11.6080 11.6080 11.7148 11.7148 11.8005 11.8005 12.0108 12.0108 12.2712 12.2712 12.4190 12.4190 k = 0.3352-0.2964-0.6823 ( 4120 PWs) bands (ev): -40.5837 -40.5837 -40.5836 -40.5836 -19.6274 -19.6274 -19.6058 -19.6058 -19.1615 -19.1615 -19.1524 -19.1524 -19.0594 -19.0594 -19.0396 -19.0396 -11.3454 -11.3454 -11.3440 -11.3440 -10.2358 -10.2358 -10.2198 -10.2198 -9.9175 -9.9175 -9.9090 -9.9090 1.4116 1.4116 1.4165 1.4165 2.0637 2.0637 2.3417 2.3417 2.3885 2.3885 2.8384 2.8384 3.3572 3.3572 3.5595 3.5595 4.4100 4.4100 4.5109 4.5109 4.9001 4.9001 5.0611 5.0611 5.2237 5.2237 5.3777 5.3777 6.0623 6.0623 6.1671 6.1671 6.8174 6.8174 6.8760 6.8760 11.5889 11.5889 11.7150 11.7150 11.7986 11.7986 12.0227 12.0227 12.2819 12.2819 12.4028 12.4028 k = 0.3426-0.3030-0.6974 ( 4124 PWs) bands (ev): -40.5839 -40.5839 -40.5834 -40.5834 -19.6281 -19.6281 -19.6059 -19.6059 -19.1634 -19.1634 -19.1522 -19.1522 -19.0579 -19.0579 -19.0386 -19.0386 -11.3461 -11.3461 -11.3424 -11.3424 -10.2483 -10.2483 -10.2101 -10.2101 -9.9148 -9.9148 -9.9102 -9.9102 1.3855 1.3855 1.4382 1.4382 2.0905 2.0905 2.3507 2.3507 2.3632 2.3632 2.8244 2.8244 3.3889 3.3889 3.5559 3.5559 4.3750 4.3750 4.5125 4.5125 4.9023 4.9023 5.0900 5.0900 5.2254 5.2254 5.3580 5.3580 6.0656 6.0656 6.1673 6.1673 6.7980 6.7980 6.8856 6.8856 11.5692 11.5692 11.7161 11.7161 11.7956 11.7956 12.0355 12.0355 12.2926 12.2926 12.3863 12.3863 k = 0.3501-0.3096-0.7126 ( 4122 PWs) bands (ev): -40.5841 -40.5841 -40.5832 -40.5832 -19.6288 -19.6288 -19.6058 -19.6058 -19.1653 -19.1653 -19.1517 -19.1517 -19.0569 -19.0569 -19.0372 -19.0372 -11.3486 -11.3486 -11.3399 -11.3399 -10.2608 -10.2608 -10.1993 -10.1993 -9.9163 -9.9163 -9.9073 -9.9073 1.3573 1.3573 1.4603 1.4603 2.1187 2.1187 2.3358 2.3358 2.3644 2.3644 2.8112 2.8112 3.4141 3.4141 3.5515 3.5515 4.3415 4.3415 4.5112 4.5112 4.9076 4.9076 5.1209 5.1209 5.2285 5.2285 5.3405 5.3405 6.0690 6.0690 6.1679 6.1679 6.7761 6.7761 6.8950 6.8950 11.5490 11.5490 11.7178 11.7178 11.7919 11.7919 12.0484 12.0484 12.3032 12.3032 12.3700 12.3700 k = 0.3575-0.3162-0.7278 ( 4124 PWs) bands (ev): -40.5843 -40.5843 -40.5830 -40.5830 -19.6297 -19.6297 -19.6056 -19.6056 -19.1674 -19.1674 -19.1511 -19.1511 -19.0562 -19.0562 -19.0355 -19.0355 -11.3522 -11.3522 -11.3371 -11.3371 -10.2730 -10.2730 -10.1877 -10.1877 -9.9193 -9.9193 -9.9031 -9.9031 1.3274 1.3274 1.4826 1.4826 2.1482 2.1482 2.3122 2.3122 2.3768 2.3768 2.7987 2.7987 3.4312 3.4312 3.5473 3.5473 4.3100 4.3100 4.5073 4.5073 4.9160 4.9160 5.1521 5.1521 5.2337 5.2337 5.3253 5.3253 6.0723 6.0723 6.1689 6.1689 6.7522 6.7522 6.9041 6.9041 11.5286 11.5286 11.7200 11.7200 11.7875 11.7875 12.0608 12.0608 12.3136 12.3136 12.3547 12.3547 k = 0.6425-0.0909-0.5800 ( 4124 PWs) bands (ev): -40.5843 -40.5843 -40.5830 -40.5830 -19.6297 -19.6297 -19.6056 -19.6056 -19.1674 -19.1674 -19.1511 -19.1511 -19.0562 -19.0562 -19.0355 -19.0355 -11.3522 -11.3522 -11.3371 -11.3371 -10.2730 -10.2730 -10.1877 -10.1877 -9.9193 -9.9193 -9.9031 -9.9031 1.3274 1.3274 1.4826 1.4826 2.1482 2.1482 2.3122 2.3122 2.3768 2.3768 2.7987 2.7987 3.4312 3.4312 3.5474 3.5474 4.3100 4.3100 4.5073 4.5073 4.9160 4.9160 5.1521 5.1521 5.2338 5.2338 5.3253 5.3253 6.0723 6.0723 6.1689 6.1689 6.7522 6.7522 6.9041 6.9041 11.5286 11.5286 11.7200 11.7200 11.7875 11.7875 12.0608 12.0608 12.3136 12.3136 12.3547 12.3547 k = 0.6350-0.0743-0.5800 ( 4118 PWs) bands (ev): -40.5845 -40.5845 -40.5829 -40.5829 -19.6306 -19.6306 -19.6054 -19.6054 -19.1693 -19.1693 -19.1505 -19.1505 -19.0557 -19.0557 -19.0336 -19.0336 -11.3567 -11.3567 -11.3340 -11.3340 -10.2850 -10.2850 -10.1753 -10.1753 -9.9225 -9.9225 -9.8987 -9.8987 1.2960 1.2960 1.5052 1.5052 2.1789 2.1789 2.2894 2.2894 2.3911 2.3911 2.7873 2.7873 3.4385 3.4385 3.5449 3.5449 4.2805 4.2805 4.5012 4.5012 4.9275 4.9275 5.1804 5.1804 5.2440 5.2440 5.3124 5.3124 6.0754 6.0754 6.1703 6.1703 6.7265 6.7265 6.9125 6.9125 11.5080 11.5080 11.7226 11.7226 11.7823 11.7823 12.0722 12.0722 12.3227 12.3227 12.3418 12.3418 k = 0.6275-0.0576-0.5800 ( 4116 PWs) bands (ev): -40.5847 -40.5847 -40.5827 -40.5827 -19.6315 -19.6315 -19.6050 -19.6050 -19.1713 -19.1713 -19.1499 -19.1499 -19.0555 -19.0555 -19.0315 -19.0315 -11.3619 -11.3619 -11.3307 -11.3307 -10.2966 -10.2966 -10.1625 -10.1625 -9.9258 -9.9258 -9.8944 -9.8944 1.2637 1.2637 1.5279 1.5279 2.2105 2.2105 2.2676 2.2676 2.4070 2.4070 2.7770 2.7770 3.4353 3.4353 3.5443 3.5443 4.2533 4.2533 4.4933 4.4933 4.9422 4.9422 5.2004 5.2004 5.2633 5.2633 5.3020 5.3020 6.0783 6.0783 6.1721 6.1721 6.6994 6.6994 6.9203 6.9203 11.4874 11.4874 11.7256 11.7256 11.7766 11.7766 12.0817 12.0817 12.3232 12.3232 12.3397 12.3397 k = 0.6200-0.0410-0.5800 ( 4120 PWs) bands (ev): -40.5849 -40.5849 -40.5825 -40.5825 -19.6325 -19.6325 -19.6047 -19.6047 -19.1731 -19.1731 -19.1492 -19.1492 -19.0554 -19.0554 -19.0294 -19.0294 -11.3678 -11.3678 -11.3272 -11.3272 -10.3079 -10.3079 -10.1496 -10.1496 -9.9290 -9.9290 -9.8902 -9.8902 1.2308 1.2308 1.5507 1.5507 2.2416 2.2416 2.2477 2.2477 2.4248 2.4248 2.7681 2.7681 3.4232 3.4232 3.5441 3.5441 4.2287 4.2287 4.4840 4.4840 4.9600 4.9600 5.2114 5.2114 5.2881 5.2881 5.2979 5.2979 6.0809 6.0809 6.1742 6.1742 6.6712 6.6712 6.9274 6.9274 11.4671 11.4671 11.7288 11.7288 11.7704 11.7704 12.0885 12.0885 12.3159 12.3159 12.3481 12.3481 k = 0.6125-0.0243-0.5800 ( 4118 PWs) bands (ev): -40.5851 -40.5851 -40.5823 -40.5823 -19.6334 -19.6334 -19.6043 -19.6043 -19.1749 -19.1749 -19.1486 -19.1486 -19.0554 -19.0554 -19.0272 -19.0272 -11.3740 -11.3740 -11.3236 -11.3236 -10.3187 -10.3187 -10.1368 -10.1368 -9.9320 -9.9320 -9.8861 -9.8861 1.1978 1.1978 1.5735 1.5735 2.2259 2.2259 2.2757 2.2757 2.4446 2.4446 2.7604 2.7604 3.4044 3.4044 3.5420 3.5420 4.2065 4.2065 4.4737 4.4737 4.9806 4.9806 5.2177 5.2177 5.2859 5.2859 5.3274 5.3274 6.0832 6.0832 6.1766 6.1766 6.6420 6.6420 6.9339 6.9339 11.4471 11.4471 11.7321 11.7321 11.7636 11.7636 12.0921 12.0921 12.3107 12.3107 12.3579 12.3579 k = 0.6050-0.0077-0.5800 ( 4112 PWs) bands (ev): -40.5852 -40.5852 -40.5822 -40.5822 -19.6344 -19.6344 -19.6039 -19.6039 -19.1765 -19.1765 -19.1480 -19.1480 -19.0555 -19.0555 -19.0251 -19.0251 -11.3805 -11.3805 -11.3198 -11.3198 -10.3290 -10.3290 -10.1243 -10.1243 -9.9347 -9.9347 -9.8822 -9.8822 1.1650 1.1650 1.5963 1.5963 2.2059 2.2059 2.3084 2.3084 2.4666 2.4666 2.7541 2.7541 3.3811 3.3811 3.5366 3.5366 4.1869 4.1869 4.4627 4.4627 5.0039 5.0039 5.2220 5.2220 5.2816 5.2816 5.3622 5.3622 6.0853 6.0853 6.1791 6.1791 6.6122 6.6122 6.9398 6.9398 11.4276 11.4276 11.7350 11.7350 11.7567 11.7567 12.0923 12.0923 12.3090 12.3090 12.3676 12.3676 k = 0.5975 0.0089-0.5800 ( 4112 PWs) bands (ev): -40.5854 -40.5854 -40.5820 -40.5820 -19.6353 -19.6353 -19.6035 -19.6035 -19.1781 -19.1781 -19.1474 -19.1474 -19.0556 -19.0556 -19.0230 -19.0230 -11.3871 -11.3871 -11.3161 -11.3161 -10.3388 -10.3388 -10.1124 -10.1124 -9.9371 -9.9371 -9.8785 -9.8785 1.1330 1.1330 1.6191 1.6191 2.1862 2.1862 2.3409 2.3409 2.4909 2.4909 2.7492 2.7492 3.3543 3.3543 3.5272 3.5272 4.1695 4.1695 4.4514 4.4514 5.0294 5.0294 5.2253 5.2253 5.2788 5.2788 5.3970 5.3970 6.0870 6.0870 6.1817 6.1817 6.5820 6.5820 6.9451 6.9451 11.4086 11.4086 11.7365 11.7365 11.7508 11.7508 12.0895 12.0895 12.3109 12.3109 12.3770 12.3770 k = 0.5900 0.0256-0.5800 ( 4120 PWs) bands (ev): -40.5855 -40.5855 -40.5819 -40.5819 -19.6362 -19.6362 -19.6032 -19.6032 -19.1796 -19.1796 -19.1468 -19.1468 -19.0557 -19.0557 -19.0210 -19.0210 -11.3937 -11.3937 -11.3124 -11.3124 -10.3480 -10.3480 -10.1014 -10.1014 -9.9390 -9.9390 -9.8750 -9.8750 1.1019 1.1019 1.6417 1.6417 2.1665 2.1665 2.3728 2.3728 2.5176 2.5176 2.7454 2.7454 3.3251 3.3251 3.5136 3.5136 4.1542 4.1542 4.4400 4.4400 5.0567 5.0567 5.2280 5.2280 5.2774 5.2774 5.4309 5.4309 6.0885 6.0885 6.1843 6.1843 6.5517 6.5517 6.9499 6.9499 11.3905 11.3905 11.7334 11.7334 11.7489 11.7489 12.0843 12.0843 12.3156 12.3156 12.3860 12.3860 k = 0.5825 0.0422-0.5800 ( 4124 PWs) bands (ev): -40.5856 -40.5856 -40.5818 -40.5818 -19.6370 -19.6370 -19.6029 -19.6029 -19.1810 -19.1810 -19.1463 -19.1463 -19.0558 -19.0558 -19.0192 -19.0192 -11.4002 -11.4002 -11.3088 -11.3088 -10.3567 -10.3567 -10.0913 -10.0913 -9.9403 -9.9403 -9.8717 -9.8717 1.0722 1.0722 1.6642 1.6642 2.1469 2.1469 2.4041 2.4041 2.5466 2.5466 2.7428 2.7428 3.2941 3.2941 3.4960 3.4960 4.1409 4.1409 4.4288 4.4288 5.0854 5.0854 5.2303 5.2303 5.2773 5.2773 5.4633 5.4633 6.0898 6.0898 6.1868 6.1868 6.5217 6.5217 6.9542 6.9542 11.3732 11.3732 11.7261 11.7261 11.7508 11.7508 12.0774 12.0774 12.3225 12.3225 12.3946 12.3946 k = 0.5750 0.0589-0.5800 ( 4124 PWs) bands (ev): -40.5857 -40.5857 -40.5817 -40.5817 -19.6378 -19.6378 -19.6025 -19.6025 -19.1822 -19.1822 -19.1458 -19.1458 -19.0560 -19.0560 -19.0175 -19.0175 -11.4064 -11.4064 -11.3052 -11.3052 -10.3646 -10.3646 -10.0823 -10.0823 -9.9409 -9.9409 -9.8686 -9.8686 1.0441 1.0441 1.6866 1.6866 2.1272 2.1272 2.4345 2.4345 2.5777 2.5777 2.7412 2.7412 3.2621 3.2621 3.4748 3.4748 4.1294 4.1294 4.4179 4.4179 5.1149 5.1149 5.2324 5.2324 5.2782 5.2782 5.4938 5.4938 6.0909 6.0909 6.1890 6.1890 6.4922 6.4922 6.9580 6.9580 11.3569 11.3569 11.7172 11.7172 11.7538 11.7538 12.0698 12.0698 12.3308 12.3308 12.4026 12.4026 k = 0.5675 0.0755-0.5800 ( 4124 PWs) bands (ev): -40.5859 -40.5859 -40.5816 -40.5816 -19.6385 -19.6385 -19.6022 -19.6022 -19.1833 -19.1833 -19.1453 -19.1453 -19.0561 -19.0561 -19.0158 -19.0158 -11.4123 -11.4123 -11.3019 -11.3019 -10.3719 -10.3719 -10.0746 -10.0746 -9.9408 -9.9408 -9.8658 -9.8658 1.0179 1.0179 1.7089 1.7089 2.1075 2.1075 2.4640 2.4640 2.6104 2.6104 2.7404 2.7404 3.2296 3.2296 3.4504 3.4504 4.1194 4.1194 4.4076 4.4076 5.1444 5.1444 5.2341 5.2341 5.2800 5.2800 5.5221 5.5221 6.0919 6.0919 6.1909 6.1909 6.4636 6.4636 6.9614 6.9614 11.3417 11.3417 11.7079 11.7079 11.7570 11.7570 12.0621 12.0621 12.3396 12.3396 12.4101 12.4101 k = 0.5600 0.0922-0.5800 ( 4120 PWs) bands (ev): -40.5859 -40.5859 -40.5815 -40.5815 -19.6391 -19.6391 -19.6019 -19.6019 -19.1843 -19.1843 -19.1449 -19.1449 -19.0562 -19.0562 -19.0144 -19.0144 -11.4178 -11.4178 -11.2987 -11.2987 -10.3785 -10.3785 -10.0683 -10.0683 -9.9401 -9.9401 -9.8633 -9.8633 0.9939 0.9939 1.7309 1.7309 2.0877 2.0877 2.4928 2.4928 2.6442 2.6442 2.7403 2.7403 3.1974 3.1974 3.4234 3.4234 4.1108 4.1108 4.3979 4.3979 5.1732 5.1732 5.2356 5.2356 5.2826 5.2826 5.5480 5.5480 6.0928 6.0928 6.1924 6.1924 6.4364 6.4364 6.9644 6.9644 11.3278 11.3278 11.6986 11.6986 11.7601 11.7601 12.0546 12.0546 12.3485 12.3485 12.4169 12.4169 k = 0.5525 0.1088-0.5800 ( 4114 PWs) bands (ev): -40.5860 -40.5860 -40.5814 -40.5814 -19.6396 -19.6396 -19.6017 -19.6017 -19.1852 -19.1852 -19.1445 -19.1445 -19.0562 -19.0562 -19.0131 -19.0131 -11.4228 -11.4228 -11.2959 -11.2959 -10.3844 -10.3844 -10.0631 -10.0631 -9.9388 -9.9388 -9.8610 -9.8610 0.9723 0.9723 1.7527 1.7527 2.0679 2.0679 2.5207 2.5207 2.6781 2.6781 2.7407 2.7407 3.1661 3.1661 3.3944 3.3944 4.1035 4.1035 4.3891 4.3891 5.2005 5.2005 5.2369 5.2369 5.2860 5.2860 5.5712 5.5712 6.0935 6.0935 6.1933 6.1933 6.4111 6.4111 6.9670 6.9670 11.3152 11.3152 11.6896 11.6896 11.7630 11.7630 12.0477 12.0477 12.3571 12.3571 12.4230 12.4230 k = 0.5450 0.1254-0.5800 ( 4114 PWs) bands (ev): -40.5861 -40.5861 -40.5813 -40.5813 -19.6402 -19.6402 -19.6015 -19.6015 -19.1860 -19.1860 -19.1442 -19.1442 -19.0563 -19.0563 -19.0119 -19.0119 -11.4273 -11.4273 -11.2933 -11.2933 -10.3895 -10.3895 -10.0592 -10.0592 -9.9371 -9.9371 -9.8590 -9.8590 0.9532 0.9532 1.7741 1.7741 2.0481 2.0481 2.5476 2.5476 2.7110 2.7110 2.7418 2.7418 3.1368 3.1368 3.3640 3.3640 4.0972 4.0972 4.3813 4.3813 5.2249 5.2249 5.2380 5.2380 5.2906 5.2906 5.5916 5.5916 6.0941 6.0941 6.1937 6.1937 6.3881 6.3881 6.9693 6.9693 11.3041 11.3041 11.6812 11.6812 11.7656 11.7656 12.0416 12.0416 12.3651 12.3651 12.4284 12.4284 k = 0.5375 0.1421-0.5800 ( 4116 PWs) bands (ev): -40.5862 -40.5862 -40.5813 -40.5813 -19.6406 -19.6406 -19.6013 -19.6013 -19.1867 -19.1867 -19.1439 -19.1439 -19.0564 -19.0564 -19.0110 -19.0110 -11.4312 -11.4312 -11.2910 -11.2910 -10.3939 -10.3939 -10.0563 -10.0563 -9.9352 -9.9352 -9.8573 -9.8573 0.9367 0.9367 1.7951 1.7951 2.0285 2.0285 2.5732 2.5732 2.7377 2.7377 2.7472 2.7472 3.1104 3.1104 3.3332 3.3332 4.0921 4.0921 4.3745 4.3745 5.2385 5.2385 5.2456 5.2456 5.2968 5.2968 5.6090 5.6090 6.0947 6.0947 6.1933 6.1933 6.3679 6.3679 6.9712 6.9712 11.2945 11.2945 11.6735 11.6735 11.7679 11.7679 12.0364 12.0364 12.3721 12.3721 12.4330 12.4330 k = 0.5300 0.1587-0.5800 ( 4114 PWs) bands (ev): -40.5862 -40.5862 -40.5812 -40.5812 -19.6409 -19.6409 -19.6011 -19.6011 -19.1872 -19.1872 -19.1437 -19.1437 -19.0564 -19.0564 -19.0102 -19.0102 -11.4344 -11.4344 -11.2891 -11.2891 -10.3975 -10.3975 -10.0542 -10.0542 -9.9333 -9.9333 -9.8559 -9.8559 0.9232 0.9232 1.8153 1.8153 2.0094 2.0094 2.5970 2.5970 2.7420 2.7420 2.7715 2.7715 3.0885 3.0885 3.3030 3.3030 4.0879 4.0879 4.3688 4.3688 5.2393 5.2393 5.2602 5.2602 5.3052 5.3052 5.6234 5.6234 6.0952 6.0952 6.1925 6.1925 6.3510 6.3510 6.9727 6.9727 11.2865 11.2865 11.6669 11.6669 11.7698 11.7698 12.0321 12.0321 12.3780 12.3780 12.4369 12.4369 k = 0.5225 0.1754-0.5800 ( 4108 PWs) bands (ev): -40.5863 -40.5863 -40.5812 -40.5812 -19.6412 -19.6412 -19.6010 -19.6010 -19.1876 -19.1876 -19.1435 -19.1435 -19.0565 -19.0565 -19.0095 -19.0095 -11.4370 -11.4370 -11.2876 -11.2876 -10.4003 -10.4003 -10.0527 -10.0527 -9.9316 -9.9316 -9.8548 -9.8548 0.9125 0.9125 1.8345 1.8345 1.9910 1.9910 2.6181 2.6181 2.7432 2.7432 2.7935 2.7935 3.0723 3.0723 3.2750 3.2750 4.0847 4.0847 4.3643 4.3643 5.2398 5.2398 5.2693 5.2693 5.3152 5.3152 5.6346 5.6346 6.0956 6.0956 6.1912 6.1912 6.3378 6.3378 6.9740 6.9740 11.2803 11.2803 11.6616 11.6616 11.7713 11.7713 12.0287 12.0287 12.3828 12.3828 12.4399 12.4399 k = 0.5150 0.1920-0.5800 ( 4104 PWs) bands (ev): -40.5863 -40.5863 -40.5811 -40.5811 -19.6414 -19.6414 -19.6009 -19.6009 -19.1879 -19.1879 -19.1434 -19.1434 -19.0565 -19.0565 -19.0091 -19.0091 -11.4388 -11.4388 -11.2865 -11.2865 -10.4023 -10.4023 -10.0518 -10.0518 -9.9303 -9.9303 -9.8540 -9.8540 0.9048 0.9048 1.8516 1.8516 1.9745 1.9745 2.6350 2.6350 2.7440 2.7440 2.8091 2.8091 3.0627 3.0627 3.2512 3.2512 4.0825 4.0825 4.3610 4.3610 5.2402 5.2402 5.2744 5.2744 5.3243 5.3243 5.6427 5.6427 6.0959 6.0959 6.1899 6.1899 6.3283 6.3283 6.9748 6.9748 11.2758 11.2758 11.6576 11.6576 11.7725 11.7725 12.0264 12.0264 12.3862 12.3862 12.4420 12.4421 k = 0.5075 0.2086-0.5800 ( 4104 PWs) bands (ev): -40.5863 -40.5863 -40.5811 -40.5811 -19.6415 -19.6415 -19.6008 -19.6008 -19.1881 -19.1881 -19.1433 -19.1433 -19.0565 -19.0565 -19.0088 -19.0088 -11.4399 -11.4399 -11.2859 -11.2859 -10.4035 -10.4035 -10.0513 -10.0513 -9.9294 -9.9294 -9.8535 -9.8535 0.9001 0.9001 1.8646 1.8646 1.9619 1.9619 2.6463 2.6463 2.7444 2.7444 2.8178 2.8178 3.0587 3.0587 3.2348 3.2348 4.0811 4.0811 4.3591 4.3591 5.2404 5.2404 5.2770 5.2770 5.3305 5.3305 5.6476 5.6476 6.0960 6.0960 6.1889 6.1889 6.3226 6.3226 6.9754 6.9754 11.2731 11.2731 11.6552 11.6552 11.7731 11.7731 12.0249 12.0249 12.3883 12.3883 12.4434 12.4434 k = 0.5000 0.2253-0.5800 ( 4106 PWs) bands (ev): -40.5863 -40.5863 -40.5811 -40.5811 -19.6415 -19.6415 -19.6008 -19.6008 -19.1881 -19.1881 -19.1433 -19.1433 -19.0565 -19.0565 -19.0087 -19.0087 -11.4403 -11.4403 -11.2856 -11.2856 -10.4039 -10.4039 -10.0512 -10.0512 -9.9291 -9.9291 -9.8534 -9.8534 0.8986 0.8986 1.8697 1.8697 1.9568 1.9568 2.6502 2.6502 2.7446 2.7446 2.8206 2.8206 3.0578 3.0578 3.2288 3.2288 4.0806 4.0806 4.3584 4.3584 5.2404 5.2404 5.2777 5.2777 5.3327 5.3327 5.6492 5.6492 6.0961 6.0961 6.1886 6.1886 6.3208 6.3208 6.9755 6.9755 11.2722 11.2722 11.6544 11.6544 11.7734 11.7734 12.0245 12.0245 12.3890 12.3890 12.4438 12.4438 k = 0.5000 0.2253-0.5800 ( 4106 PWs) bands (ev): -40.5863 -40.5863 -40.5811 -40.5811 -19.6415 -19.6415 -19.6008 -19.6008 -19.1881 -19.1881 -19.1433 -19.1433 -19.0565 -19.0565 -19.0087 -19.0087 -11.4403 -11.4403 -11.2856 -11.2856 -10.4039 -10.4039 -10.0512 -10.0512 -9.9291 -9.9291 -9.8534 -9.8534 0.8986 0.8986 1.8697 1.8697 1.9568 1.9568 2.6502 2.6502 2.7446 2.7446 2.8206 2.8206 3.0578 3.0578 3.2288 3.2288 4.0806 4.0806 4.3584 4.3584 5.2404 5.2404 5.2777 5.2777 5.3327 5.3327 5.6492 5.6492 6.0961 6.0961 6.1886 6.1886 6.3208 6.3208 6.9755 6.9755 11.2722 11.2722 11.6544 11.6544 11.7734 11.7734 12.0245 12.0245 12.3890 12.3890 12.4438 12.4438 k = 0.5119 0.2306-0.5677 ( 4110 PWs) bands (ev): -40.5863 -40.5863 -40.5811 -40.5811 -19.6415 -19.6415 -19.6009 -19.6009 -19.1880 -19.1880 -19.1433 -19.1433 -19.0565 -19.0565 -19.0089 -19.0089 -11.4404 -11.4404 -11.2857 -11.2857 -10.4034 -10.4034 -10.0513 -10.0513 -9.9291 -9.9291 -9.8537 -9.8537 0.8990 0.8990 1.8687 1.8687 1.9572 1.9572 2.6504 2.6504 2.7414 2.7414 2.8214 2.8214 3.0586 3.0586 3.2287 3.2287 4.0831 4.0831 4.3589 4.3589 5.2365 5.2365 5.2829 5.2829 5.3326 5.3326 5.6486 5.6486 6.0883 6.0883 6.1882 6.1882 6.3272 6.3272 6.9744 6.9744 11.2731 11.2731 11.6556 11.6556 11.7738 11.7738 12.0249 12.0249 12.3887 12.3887 12.4438 12.4438 k = 0.5237 0.2360-0.5554 ( 4104 PWs) bands (ev): -40.5863 -40.5863 -40.5812 -40.5812 -19.6413 -19.6413 -19.6009 -19.6009 -19.1877 -19.1877 -19.1434 -19.1434 -19.0565 -19.0565 -19.0092 -19.0092 -11.4406 -11.4406 -11.2858 -11.2858 -10.4018 -10.4018 -10.0516 -10.0516 -9.9290 -9.9290 -9.8547 -9.8547 0.9004 0.9004 1.8655 1.8655 1.9584 1.9584 2.6511 2.6511 2.7322 2.7322 2.8241 2.8241 3.0608 3.0608 3.2285 3.2285 4.0904 4.0904 4.3604 4.3604 5.2283 5.2283 5.2946 5.2946 5.3325 5.3325 5.6469 5.6469 6.0673 6.0673 6.1872 6.1872 6.3444 6.3444 6.9708 6.9708 11.2759 11.2759 11.6591 11.6591 11.7750 11.7750 12.0262 12.0262 12.3878 12.3878 12.4439 12.4439 k = 0.5356 0.2413-0.5431 ( 4100 PWs) bands (ev): -40.5863 -40.5863 -40.5812 -40.5812 -19.6409 -19.6409 -19.6010 -19.6010 -19.1872 -19.1872 -19.1435 -19.1435 -19.0566 -19.0566 -19.0098 -19.0098 -11.4411 -11.4411 -11.2859 -11.2859 -10.3993 -10.3993 -10.0520 -10.0520 -9.9288 -9.9288 -9.8563 -9.8563 0.9026 0.9026 1.8603 1.8603 1.9605 1.9605 2.6521 2.6521 2.7174 2.7174 2.8285 2.8285 3.0642 3.0642 3.2281 3.2281 4.1023 4.1023 4.3630 4.3630 5.2194 5.2194 5.3087 5.3087 5.3328 5.3328 5.6438 5.6438 6.0378 6.0378 6.1854 6.1854 6.3677 6.3677 6.9650 6.9650 11.2805 11.2805 11.6649 11.6649 11.7771 11.7771 12.0283 12.0283 12.3862 12.3862 12.4440 12.4440 k = 0.5475 0.2467-0.5308 ( 4102 PWs) bands (ev): -40.5862 -40.5862 -40.5812 -40.5812 -19.6405 -19.6405 -19.6011 -19.6011 -19.1865 -19.1865 -19.1437 -19.1437 -19.0566 -19.0566 -19.0107 -19.0107 -11.4417 -11.4417 -11.2861 -11.2861 -10.3957 -10.3957 -10.0527 -10.0527 -9.9285 -9.9285 -9.8586 -9.8586 0.9057 0.9057 1.8530 1.8530 1.9633 1.9633 2.6534 2.6534 2.6977 2.6977 2.8345 2.8345 3.0681 3.0681 3.2276 3.2276 4.1185 4.1185 4.3665 4.3665 5.2111 5.2111 5.3210 5.3210 5.3367 5.3367 5.6389 5.6389 6.0040 6.0040 6.1827 6.1827 6.3938 6.3938 6.9569 6.9569 11.2869 11.2869 11.6730 11.6730 11.7800 11.7800 12.0313 12.0313 12.3839 12.3839 12.4441 12.4441 k = 0.5594 0.2520-0.5184 ( 4112 PWs) bands (ev): -40.5861 -40.5861 -40.5813 -40.5813 -19.6399 -19.6399 -19.6013 -19.6013 -19.1855 -19.1855 -19.1440 -19.1440 -19.0567 -19.0567 -19.0118 -19.0118 -11.4426 -11.4426 -11.2863 -11.2863 -10.3911 -10.3911 -10.0535 -10.0535 -9.9281 -9.9281 -9.8615 -9.8615 0.9096 0.9096 1.8438 1.8438 1.9669 1.9669 2.6548 2.6548 2.6742 2.6742 2.8420 2.8420 3.0721 3.0721 3.2271 3.2271 4.1386 4.1386 4.3711 4.3711 5.2038 5.2038 5.3246 5.3246 5.3504 5.3504 5.6317 5.6317 5.9685 5.9685 6.1791 6.1791 6.4208 6.4208 6.9466 6.9466 11.2950 11.2950 11.6832 11.6832 11.7837 11.7837 12.0352 12.0352 12.3810 12.3810 12.4441 12.4441 k = 0.5712 0.2574-0.5061 ( 4118 PWs) bands (ev): -40.5860 -40.5860 -40.5814 -40.5814 -19.6392 -19.6392 -19.6016 -19.6016 -19.1844 -19.1844 -19.1443 -19.1443 -19.0567 -19.0567 -19.0131 -19.0131 -11.4437 -11.4437 -11.2865 -11.2865 -10.3856 -10.3856 -10.0545 -10.0545 -9.9277 -9.9277 -9.8650 -9.8650 0.9143 0.9143 1.8327 1.8327 1.9713 1.9713 2.6459 2.6459 2.6578 2.6578 2.8508 2.8508 3.0758 3.0758 3.2266 3.2266 4.1622 4.1622 4.3767 4.3767 5.1976 5.1976 5.3242 5.3242 5.3691 5.3691 5.6215 5.6215 5.9336 5.9336 6.1746 6.1746 6.4474 6.4474 6.9343 6.9343 11.3049 11.3049 11.6953 11.6953 11.7880 11.7880 12.0398 12.0398 12.3774 12.3774 12.4440 12.4440 k = 0.5831 0.2627-0.4938 ( 4122 PWs) bands (ev): -40.5859 -40.5859 -40.5815 -40.5815 -19.6384 -19.6384 -19.6018 -19.6018 -19.1831 -19.1831 -19.1446 -19.1446 -19.0568 -19.0568 -19.0147 -19.0147 -11.4451 -11.4451 -11.2868 -11.2868 -10.3792 -10.3792 -10.0555 -10.0555 -9.9271 -9.9271 -9.8690 -9.8690 0.9199 0.9199 1.8199 1.8199 1.9765 1.9765 2.6169 2.6169 2.6591 2.6591 2.8606 2.8606 3.0789 3.0789 3.2264 3.2264 4.1887 4.1887 4.3834 4.3834 5.1927 5.1927 5.3228 5.3228 5.3898 5.3898 5.6074 5.6074 5.9011 5.9011 6.1692 6.1692 6.4730 6.4730 6.9201 6.9201 11.3164 11.3164 11.7093 11.7093 11.7930 11.7930 12.0453 12.0453 12.3731 12.3731 12.4435 12.4435 k = 0.5950 0.2681-0.4815 ( 4128 PWs) bands (ev): -40.5858 -40.5858 -40.5816 -40.5816 -19.6375 -19.6375 -19.6021 -19.6021 -19.1816 -19.1816 -19.1450 -19.1450 -19.0569 -19.0569 -19.0164 -19.0164 -11.4467 -11.4467 -11.2870 -11.2870 -10.3718 -10.3718 -10.0567 -10.0567 -9.9266 -9.9266 -9.8736 -9.8736 0.9264 0.9264 1.8054 1.8054 1.9826 1.9826 2.5855 2.5855 2.6608 2.6608 2.8713 2.8713 3.0811 3.0811 3.2265 3.2265 4.2176 4.2176 4.3911 4.3911 5.1891 5.1891 5.3212 5.3212 5.4117 5.4117 5.5884 5.5884 5.8726 5.8726 6.1628 6.1628 6.4974 6.4974 6.9041 6.9041 11.3295 11.3295 11.7249 11.7249 11.7986 11.7986 12.0516 12.0516 12.3682 12.3682 12.4426 12.4426 k = 0.6069 0.2734-0.4692 ( 4127 PWs) bands (ev): -40.5857 -40.5857 -40.5818 -40.5818 -19.6365 -19.6365 -19.6024 -19.6024 -19.1799 -19.1799 -19.1454 -19.1454 -19.0570 -19.0570 -19.0184 -19.0184 -11.4487 -11.4487 -11.2873 -11.2873 -10.3637 -10.3637 -10.0579 -10.0579 -9.9259 -9.9259 -9.8787 -9.8787 0.9336 0.9336 1.7895 1.7895 1.9894 1.9894 2.5526 2.5526 2.6624 2.6624 2.8824 2.8824 3.0822 3.0822 3.2272 3.2272 4.2484 4.2484 4.4000 4.4000 5.1867 5.1867 5.3194 5.3194 5.4347 5.4347 5.5642 5.5642 5.8494 5.8494 6.1554 6.1554 6.5205 6.5205 6.8866 6.8866 11.3442 11.3442 11.7419 11.7419 11.8047 11.8047 12.0587 12.0587 12.3626 12.3626 12.4412 12.4412 k = 0.6187 0.2788-0.4569 ( 4133 PWs) bands (ev): -40.5856 -40.5856 -40.5819 -40.5819 -19.6354 -19.6354 -19.6028 -19.6028 -19.1780 -19.1780 -19.1459 -19.1459 -19.0571 -19.0571 -19.0205 -19.0205 -11.4510 -11.4510 -11.2875 -11.2875 -10.3547 -10.3547 -10.0592 -10.0592 -9.9252 -9.9252 -9.8842 -9.8842 0.9416 0.9416 1.7721 1.7721 1.9971 1.9971 2.5188 2.5188 2.6637 2.6637 2.8935 2.8935 3.0821 3.0821 3.2288 3.2288 4.2805 4.2805 4.4099 4.4099 5.1855 5.1855 5.3176 5.3176 5.4585 5.4585 5.5348 5.5348 5.8317 5.8317 6.1469 6.1469 6.5420 6.5420 6.8677 6.8677 11.3602 11.3602 11.7600 11.7600 11.8112 11.8112 12.0666 12.0666 12.3562 12.3562 12.4392 12.4392 k = 0.6306 0.2841-0.4446 ( 4129 PWs) bands (ev): -40.5854 -40.5854 -40.5820 -40.5820 -19.6342 -19.6342 -19.6031 -19.6031 -19.1759 -19.1759 -19.1464 -19.1464 -19.0572 -19.0572 -19.0228 -19.0228 -11.4536 -11.4536 -11.2876 -11.2876 -10.3451 -10.3451 -10.0604 -10.0604 -9.9244 -9.9244 -9.8901 -9.8901 0.9503 0.9503 1.7534 1.7534 2.0055 2.0055 2.4845 2.4845 2.6646 2.6646 2.9041 2.9041 3.0806 3.0806 3.2316 3.2316 4.3134 4.3134 4.4210 4.4210 5.1852 5.1852 5.3161 5.3161 5.4821 5.4821 5.5022 5.5022 5.8192 5.8192 6.1373 6.1373 6.5622 6.5622 6.8476 6.8476 11.3775 11.3775 11.7791 11.7791 11.8183 11.8183 12.0752 12.0752 12.3492 12.3492 12.4363 12.4363 k = 0.6425 0.2895-0.4323 ( 4131 PWs) bands (ev): -40.5853 -40.5853 -40.5822 -40.5822 -19.6329 -19.6329 -19.6035 -19.6035 -19.1737 -19.1737 -19.1470 -19.1470 -19.0574 -19.0574 -19.0253 -19.0253 -11.4567 -11.4567 -11.2877 -11.2877 -10.3347 -10.3347 -10.0616 -10.0616 -9.9237 -9.9237 -9.8962 -9.8962 0.9598 0.9598 1.7336 1.7336 2.0146 2.0146 2.4500 2.4500 2.6650 2.6650 2.9138 2.9138 3.0776 3.0776 3.2358 3.2358 4.3466 4.3466 4.4333 4.4333 5.1859 5.1859 5.3152 5.3152 5.4634 5.4634 5.5098 5.5098 5.8112 5.8112 6.1266 6.1266 6.5809 6.5809 6.8266 6.8266 11.3960 11.3960 11.7986 11.7986 11.8259 11.8259 12.0845 12.0845 12.3415 12.3415 12.4325 12.4325 k = 0.6425 0.2895-0.4323 ( 4131 PWs) bands (ev): -40.5853 -40.5853 -40.5822 -40.5822 -19.6329 -19.6329 -19.6035 -19.6035 -19.1737 -19.1737 -19.1470 -19.1470 -19.0574 -19.0574 -19.0253 -19.0253 -11.4567 -11.4567 -11.2877 -11.2877 -10.3347 -10.3347 -10.0616 -10.0616 -9.9237 -9.9237 -9.8962 -9.8962 0.9598 0.9598 1.7336 1.7336 2.0146 2.0146 2.4500 2.4500 2.6650 2.6650 2.9138 2.9138 3.0776 3.0776 3.2358 3.2358 4.3466 4.3466 4.4333 4.4333 5.1859 5.1859 5.3152 5.3152 5.4634 5.4634 5.5098 5.5098 5.8112 5.8112 6.1266 6.1266 6.5809 6.5809 6.8266 6.8266 11.3960 11.3960 11.7986 11.7986 11.8259 11.8259 12.0845 12.0845 12.3415 12.3415 12.4325 12.4325 k = 0.6382 0.2875-0.4147 ( 4129 PWs) bands (ev): -40.5851 -40.5851 -40.5823 -40.5823 -19.6322 -19.6322 -19.6037 -19.6037 -19.1726 -19.1726 -19.1475 -19.1475 -19.0568 -19.0568 -19.0264 -19.0264 -11.4597 -11.4597 -11.2918 -11.2918 -10.3233 -10.3233 -10.0637 -10.0637 -9.9220 -9.9220 -9.8990 -9.8990 0.9643 0.9643 1.7172 1.7172 2.0266 2.0266 2.4292 2.4292 2.6560 2.6560 2.9073 2.9073 3.0689 3.0689 3.2412 3.2412 4.3872 4.3872 4.4367 4.4367 5.2091 5.2091 5.3166 5.3166 5.4325 5.4325 5.5130 5.5130 5.8091 5.8091 6.1310 6.1310 6.5851 6.5851 6.8046 6.8046 11.4062 11.4062 11.8158 11.8158 11.8306 11.8306 12.0881 12.0881 12.3387 12.3387 12.4302 12.4302 k = 0.6338 0.2856-0.3971 ( 4117 PWs) bands (ev): -40.5850 -40.5850 -40.5825 -40.5825 -19.6315 -19.6315 -19.6039 -19.6039 -19.1714 -19.1714 -19.1479 -19.1479 -19.0563 -19.0563 -19.0275 -19.0275 -11.4625 -11.4625 -11.2976 -11.2976 -10.3101 -10.3101 -10.0655 -10.0655 -9.9207 -9.9207 -9.9018 -9.9018 0.9695 0.9695 1.6983 1.6983 2.0386 2.0386 2.4080 2.4080 2.6460 2.6460 2.8967 2.8967 3.0631 3.0631 3.2440 3.2440 4.4278 4.4278 4.4447 4.4447 5.2282 5.2282 5.3221 5.3221 5.3998 5.3998 5.5196 5.5196 5.8104 5.8104 6.1368 6.1368 6.5877 6.5877 6.7809 6.7809 11.4182 11.4182 11.8273 11.8273 11.8420 11.8420 12.0916 12.0916 12.3356 12.3356 12.4274 12.4274 k = 0.6295 0.2837-0.3795 ( 4123 PWs) bands (ev): -40.5849 -40.5849 -40.5826 -40.5826 -19.6309 -19.6309 -19.6040 -19.6040 -19.1702 -19.1702 -19.1482 -19.1482 -19.0561 -19.0561 -19.0287 -19.0287 -11.4652 -11.4652 -11.3051 -11.3051 -10.2954 -10.2954 -10.0667 -10.0667 -9.9199 -9.9199 -9.9044 -9.9044 0.9755 0.9755 1.6774 1.6774 2.0503 2.0503 2.3867 2.3867 2.6348 2.6348 2.8822 2.8822 3.0602 3.0602 3.2443 3.2443 4.4566 4.4566 4.4682 4.4682 5.2387 5.2387 5.3355 5.3355 5.3667 5.3667 5.5293 5.5293 5.8147 5.8147 6.1437 6.1437 6.5888 6.5888 6.7556 6.7556 11.4321 11.4321 11.8332 11.8332 11.8600 11.8600 12.0952 12.0952 12.3321 12.3321 12.4238 12.4238 k = 0.6252 0.2817-0.3620 ( 4119 PWs) bands (ev): -40.5848 -40.5848 -40.5827 -40.5827 -19.6301 -19.6301 -19.6040 -19.6040 -19.1688 -19.1688 -19.1484 -19.1484 -19.0559 -19.0559 -19.0299 -19.0299 -11.4678 -11.4678 -11.3138 -11.3138 -10.2793 -10.2793 -10.0675 -10.0675 -9.9198 -9.9198 -9.9065 -9.9065 0.9822 0.9822 1.6545 1.6545 2.0617 2.0617 2.3660 2.3660 2.6223 2.6223 2.8642 2.8642 3.0599 3.0599 3.2425 3.2425 4.4726 4.4726 4.5074 4.5074 5.2395 5.2395 5.3295 5.3295 5.3625 5.3625 5.5418 5.5418 5.8218 5.8218 6.1516 6.1516 6.5885 6.5885 6.7290 6.7290 11.4476 11.4476 11.8385 11.8385 11.8796 11.8796 12.0987 12.0987 12.3283 12.3283 12.4195 12.4195 k = 0.6209 0.2798-0.3444 ( 4117 PWs) bands (ev): -40.5848 -40.5848 -40.5828 -40.5828 -19.6294 -19.6294 -19.6040 -19.6040 -19.1674 -19.1674 -19.1484 -19.1484 -19.0560 -19.0560 -19.0312 -19.0312 -11.4704 -11.4704 -11.3236 -11.3236 -10.2622 -10.2622 -10.0679 -10.0679 -9.9208 -9.9208 -9.9080 -9.9080 0.9896 0.9896 1.6300 1.6300 2.0726 2.0726 2.3460 2.3460 2.6085 2.6085 2.8431 2.8431 3.0620 3.0620 3.2388 3.2388 4.4919 4.4919 4.5451 4.5451 5.2337 5.2337 5.2963 5.2963 5.3926 5.3926 5.5567 5.5567 5.8315 5.8315 6.1602 6.1602 6.5868 6.5868 6.7015 6.7015 11.4649 11.4649 11.8440 11.8440 11.8997 11.8997 12.1022 12.1022 12.3243 12.3243 12.4143 12.4143 k = 0.6166 0.2778-0.3268 ( 4117 PWs) bands (ev): -40.5847 -40.5847 -40.5829 -40.5829 -19.6286 -19.6286 -19.6039 -19.6039 -19.1660 -19.1660 -19.1484 -19.1484 -19.0562 -19.0562 -19.0324 -19.0324 -11.4729 -11.4729 -11.3343 -11.3343 -10.2442 -10.2442 -10.0677 -10.0677 -9.9227 -9.9227 -9.9088 -9.9088 0.9977 0.9977 1.6043 1.6043 2.0827 2.0827 2.3271 2.3271 2.5934 2.5934 2.8192 2.8192 3.0660 3.0660 3.2337 3.2337 4.5139 4.5139 4.5810 4.5810 5.2239 5.2239 5.2630 5.2630 5.4276 5.4276 5.5738 5.5738 5.8438 5.8438 6.1693 6.1693 6.5839 6.5839 6.6731 6.6731 11.4836 11.4836 11.8501 11.8501 11.9199 11.9199 12.1057 12.1057 12.3200 12.3200 12.4082 12.4082 k = 0.6122 0.2759-0.3092 ( 4109 PWs) bands (ev): -40.5846 -40.5846 -40.5830 -40.5830 -19.6278 -19.6278 -19.6037 -19.6037 -19.1645 -19.1645 -19.1482 -19.1482 -19.0566 -19.0566 -19.0338 -19.0338 -11.4754 -11.4754 -11.3456 -11.3456 -10.2257 -10.2257 -10.0669 -10.0669 -9.9253 -9.9253 -9.9091 -9.9091 1.0064 1.0064 1.5776 1.5776 2.0922 2.0922 2.3093 2.3093 2.5770 2.5770 2.7928 2.7928 3.0716 3.0716 3.2276 3.2276 4.5381 4.5381 4.6147 4.6147 5.2113 5.2113 5.2310 5.2310 5.4653 5.4653 5.5929 5.5929 5.8584 5.8584 6.1787 6.1787 6.5798 6.5798 6.6443 6.6443 11.5038 11.5038 11.8566 11.8566 11.9401 11.9401 12.1091 12.1091 12.3154 12.3154 12.4013 12.4013 k = 0.6079 0.2739-0.2916 ( 4100 PWs) bands (ev): -40.5845 -40.5845 -40.5831 -40.5831 -19.6269 -19.6269 -19.6035 -19.6035 -19.1629 -19.1629 -19.1479 -19.1479 -19.0570 -19.0570 -19.0352 -19.0352 -11.4778 -11.4778 -11.3574 -11.3574 -10.2068 -10.2068 -10.0657 -10.0657 -9.9282 -9.9282 -9.9093 -9.9093 1.0158 1.0158 1.5504 1.5504 2.1007 2.1007 2.2927 2.2927 2.5594 2.5594 2.7641 2.7641 3.0784 3.0784 3.2210 3.2210 4.5640 4.5640 4.6462 4.6462 5.1940 5.1940 5.2035 5.2035 5.5048 5.5048 5.6139 5.6139 5.8752 5.8752 6.1883 6.1883 6.5747 6.5747 6.6153 6.6153 11.5253 11.5253 11.8638 11.8638 11.9602 11.9602 12.1126 12.1126 12.3106 12.3106 12.3935 12.3935 k = 0.6036 0.2720-0.2741 ( 4100 PWs) bands (ev): -40.5845 -40.5845 -40.5832 -40.5832 -19.6260 -19.6260 -19.6033 -19.6033 -19.1613 -19.1613 -19.1475 -19.1475 -19.0577 -19.0577 -19.0367 -19.0367 -11.4803 -11.4803 -11.3696 -11.3696 -10.1877 -10.1877 -10.0639 -10.0639 -9.9313 -9.9313 -9.9095 -9.9095 1.0258 1.0258 1.5230 1.5230 2.1083 2.1083 2.2772 2.2772 2.5408 2.5408 2.7335 2.7335 3.0862 3.0862 3.2141 3.2141 4.5910 4.5910 4.6751 4.6751 5.1673 5.1673 5.1858 5.1858 5.5454 5.5454 5.6368 5.6368 5.8936 5.8936 6.1980 6.1980 6.5682 6.5682 6.5869 6.5869 11.5480 11.5480 11.8715 11.8715 11.9799 11.9799 12.1161 12.1161 12.3056 12.3056 12.3849 12.3849 k = 0.5993 0.2700-0.2565 ( 4102 PWs) bands (ev): -40.5844 -40.5844 -40.5833 -40.5833 -19.6251 -19.6251 -19.6031 -19.6031 -19.1596 -19.1596 -19.1471 -19.1471 -19.0584 -19.0584 -19.0382 -19.0382 -11.4830 -11.4830 -11.3819 -11.3819 -10.1687 -10.1687 -10.0616 -10.0616 -9.9345 -9.9345 -9.9098 -9.9098 1.0363 1.0363 1.4957 1.4957 2.1148 2.1148 2.2629 2.2629 2.5213 2.5213 2.7012 2.7012 3.0945 3.0945 3.2074 3.2074 4.6186 4.6186 4.7016 4.7016 5.1397 5.1397 5.1700 5.1700 5.5865 5.5865 5.6614 5.6614 5.9133 5.9133 6.2077 6.2077 6.5538 6.5538 6.5660 6.5660 11.5718 11.5718 11.8797 11.8797 11.9991 11.9991 12.1196 12.1196 12.3004 12.3004 12.3755 12.3755 k = 0.5950 0.2681-0.2389 ( 4103 PWs) bands (ev): -40.5843 -40.5843 -40.5833 -40.5833 -19.6242 -19.6242 -19.6028 -19.6028 -19.1579 -19.1579 -19.1464 -19.1464 -19.0593 -19.0593 -19.0399 -19.0399 -11.4856 -11.4856 -11.3942 -11.3942 -10.1499 -10.1499 -10.0588 -10.0588 -9.9376 -9.9376 -9.9102 -9.9102 1.0474 1.0474 1.4689 1.4689 2.1203 2.1203 2.2496 2.2496 2.5010 2.5010 2.6675 2.6675 3.1031 3.1031 3.2010 3.2010 4.6465 4.6465 4.7256 4.7256 5.1137 5.1137 5.1541 5.1541 5.6276 5.6276 5.6881 5.6881 5.9336 5.9336 6.2174 6.2174 6.5268 6.5268 6.5578 6.5578 11.5967 11.5967 11.8885 11.8885 12.0176 12.0176 12.1232 12.1232 12.2951 12.2951 12.3656 12.3656 k = 0.5907 0.2661-0.2213 ( 4105 PWs) bands (ev): -40.5843 -40.5843 -40.5834 -40.5834 -19.6232 -19.6232 -19.6025 -19.6025 -19.1561 -19.1561 -19.1457 -19.1457 -19.0603 -19.0603 -19.0415 -19.0415 -11.4884 -11.4884 -11.4064 -11.4064 -10.1314 -10.1314 -10.0556 -10.0556 -9.9406 -9.9406 -9.9108 -9.9108 1.0588 1.0588 1.4429 1.4429 2.1247 2.1247 2.2374 2.2374 2.4800 2.4800 2.6327 2.6327 3.1118 3.1118 3.1951 3.1951 4.6742 4.6742 4.7474 4.7474 5.0897 5.0897 5.1380 5.1380 5.6674 5.6674 5.7174 5.7174 5.9538 5.9538 6.2274 6.2274 6.4989 6.4989 6.5510 6.5510 11.6223 11.6223 11.8978 11.8978 12.0352 12.0352 12.1271 12.1271 12.2896 12.2896 12.3550 12.3550 k = 0.5863 0.2642-0.2038 ( 4114 PWs) bands (ev): -40.5842 -40.5842 -40.5835 -40.5835 -19.6223 -19.6223 -19.6023 -19.6023 -19.1543 -19.1543 -19.1450 -19.1450 -19.0614 -19.0614 -19.0433 -19.0433 -11.4912 -11.4912 -11.4184 -11.4184 -10.1134 -10.1134 -10.0518 -10.0518 -9.9434 -9.9434 -9.9116 -9.9116 1.0707 1.0707 1.4178 1.4178 2.1281 2.1281 2.2261 2.2261 2.4584 2.4584 2.5971 2.5971 3.1202 3.1202 3.1900 3.1900 4.7014 4.7014 4.7671 4.7671 5.0677 5.0677 5.1219 5.1219 5.7047 5.7047 5.7503 5.7503 5.9729 5.9729 6.2379 6.2379 6.4717 6.4717 6.5446 6.5446 11.6488 11.6488 11.9076 11.9076 12.0516 12.0516 12.1314 12.1314 12.2839 12.2839 12.3441 12.3441 k = 0.5820 0.2623-0.1862 ( 4112 PWs) bands (ev): -40.5842 -40.5842 -40.5835 -40.5835 -19.6212 -19.6212 -19.6020 -19.6020 -19.1524 -19.1524 -19.1440 -19.1440 -19.0626 -19.0626 -19.0452 -19.0452 -11.4942 -11.4942 -11.4301 -11.4301 -10.0960 -10.0960 -10.0476 -10.0476 -9.9461 -9.9461 -9.9126 -9.9126 1.0828 1.0828 1.3940 1.3940 2.1304 2.1304 2.2156 2.2156 2.4364 2.4364 2.5609 2.5609 3.1283 3.1283 3.1856 3.1856 4.7278 4.7278 4.7850 4.7850 5.0479 5.0479 5.1060 5.1060 5.7383 5.7383 5.7873 5.7873 5.9900 5.9900 6.2493 6.2493 6.4454 6.4454 6.5387 6.5387 11.6759 11.6759 11.9179 11.9179 12.0665 12.0665 12.1363 12.1363 12.2782 12.2782 12.3328 12.3328 k = 0.5777 0.2603-0.1686 ( 4112 PWs) bands (ev): -40.5842 -40.5842 -40.5836 -40.5836 -19.6202 -19.6202 -19.6017 -19.6017 -19.1505 -19.1505 -19.1430 -19.1430 -19.0638 -19.0638 -19.0471 -19.0471 -11.4972 -11.4972 -11.4414 -11.4414 -10.0793 -10.0793 -10.0430 -10.0430 -9.9486 -9.9486 -9.9137 -9.9137 1.0952 1.0952 1.3716 1.3716 2.1319 2.1319 2.2059 2.2059 2.4141 2.4141 2.5244 2.5244 3.1359 3.1359 3.1820 3.1820 4.7532 4.7532 4.8012 4.8012 5.0304 5.0304 5.0904 5.0904 5.7687 5.7687 5.8276 5.8276 6.0042 6.0042 6.2621 6.2621 6.4204 6.4204 6.5332 6.5332 11.7035 11.7035 11.9286 11.9286 12.0797 12.0797 12.1419 12.1419 12.2723 12.2723 12.3214 12.3214 k = 0.5734 0.2584-0.1510 ( 4104 PWs) bands (ev): -40.5841 -40.5841 -40.5836 -40.5836 -19.6191 -19.6191 -19.6014 -19.6014 -19.1485 -19.1485 -19.1419 -19.1419 -19.0651 -19.0651 -19.0490 -19.0490 -11.5004 -11.5004 -11.4523 -11.4523 -10.0633 -10.0633 -10.0380 -10.0380 -9.9508 -9.9508 -9.9150 -9.9150 1.1077 1.1077 1.3507 1.3507 2.1325 2.1325 2.1970 2.1970 2.3916 2.3916 2.4879 2.4879 3.1428 3.1428 3.1792 3.1792 4.7775 4.7775 4.8160 4.8160 5.0151 5.0151 5.0754 5.0754 5.7968 5.7968 5.8696 5.8696 6.0145 6.0145 6.2764 6.2764 6.3969 6.3969 6.5284 6.5284 11.7315 11.7315 11.9397 11.9397 12.0907 12.0907 12.1486 12.1486 12.2662 12.2662 12.3099 12.3099 k = 0.5691 0.2564-0.1335 ( 4103 PWs) bands (ev): -40.5841 -40.5841 -40.5837 -40.5837 -19.6181 -19.6181 -19.6012 -19.6012 -19.1466 -19.1466 -19.1407 -19.1407 -19.0665 -19.0665 -19.0511 -19.0511 -11.5036 -11.5036 -11.4627 -11.4627 -10.0483 -10.0483 -10.0326 -10.0326 -9.9528 -9.9528 -9.9165 -9.9165 1.1202 1.1202 1.3316 1.3316 2.1324 2.1324 2.1887 2.1887 2.3691 2.3691 2.4516 2.4516 3.1490 3.1490 3.1771 3.1771 4.8003 4.8003 4.8296 4.8296 5.0018 5.0018 5.0611 5.0611 5.8230 5.8230 5.9122 5.9122 6.0207 6.0207 6.2926 6.2926 6.3754 6.3754 6.5243 6.5243 11.7598 11.7598 11.9511 11.9511 12.0997 12.0997 12.1562 12.1562 12.2601 12.2601 12.2985 12.2985 k = 0.5648 0.2545-0.1159 ( 4110 PWs) bands (ev): -40.5841 -40.5841 -40.5837 -40.5837 -19.6170 -19.6170 -19.6010 -19.6010 -19.1446 -19.1446 -19.1394 -19.1394 -19.0679 -19.0679 -19.0532 -19.0532 -11.5068 -11.5068 -11.4725 -11.4725 -10.0343 -10.0343 -10.0270 -10.0270 -9.9545 -9.9545 -9.9181 -9.9181 1.1326 1.1326 1.3141 1.3141 2.1316 2.1316 2.1809 2.1809 2.3466 2.3466 2.4159 2.4159 3.1544 3.1544 3.1756 3.1756 4.8217 4.8217 4.8423 4.8423 4.9907 4.9907 5.0476 5.0476 5.8473 5.8473 5.9548 5.9548 6.0227 6.0227 6.3101 6.3101 6.3562 6.3562 6.5206 6.5206 11.7882 11.7882 11.9628 11.9628 12.1067 12.1067 12.1643 12.1643 12.2538 12.2538 12.2872 12.2872 k = 0.5604 0.2525-0.0983 ( 4117 PWs) bands (ev): -40.5841 -40.5841 -40.5838 -40.5838 -19.6160 -19.6160 -19.6008 -19.6008 -19.1426 -19.1426 -19.1381 -19.1381 -19.0694 -19.0694 -19.0554 -19.0554 -11.5102 -11.5102 -11.4818 -11.4818 -10.0220 -10.0220 -10.0203 -10.0203 -9.9560 -9.9560 -9.9199 -9.9199 1.1449 1.1449 1.2985 1.2985 2.1304 2.1304 2.1737 2.1737 2.3243 2.3243 2.3811 2.3811 3.1590 3.1590 3.1746 3.1746 4.8415 4.8415 4.8542 4.8542 4.9814 4.9814 5.0350 5.0350 5.8693 5.8693 5.9967 5.9967 6.0213 6.0213 6.3278 6.3278 6.3407 6.3407 6.5173 6.5173 11.8166 11.8166 11.9747 11.9747 12.1123 12.1123 12.1726 12.1726 12.2473 12.2473 12.2763 12.2763 k = 0.5561 0.2506-0.0807 ( 4117 PWs) bands (ev): -40.5840 -40.5840 -40.5838 -40.5838 -19.6149 -19.6149 -19.6007 -19.6007 -19.1405 -19.1405 -19.1367 -19.1367 -19.0709 -19.0709 -19.0576 -19.0576 -11.5135 -11.5135 -11.4904 -11.4904 -10.0153 -10.0153 -10.0090 -10.0090 -9.9571 -9.9571 -9.9218 -9.9218 1.1568 1.1568 1.2848 1.2848 2.1288 2.1288 2.1671 2.1671 2.3023 2.3023 2.3473 2.3473 3.1629 3.1629 3.1740 3.1740 4.8596 4.8596 4.8657 4.8657 4.9739 4.9739 5.0235 5.0235 5.8886 5.8886 6.0144 6.0144 6.0400 6.0400 6.3251 6.3251 6.3492 6.3492 6.5144 6.5144 11.8450 11.8450 11.9869 11.9869 12.1168 12.1168 12.1806 12.1806 12.2407 12.2407 12.2657 12.2657 k = 0.5518 0.2486-0.0632 ( 4116 PWs) bands (ev): -40.5840 -40.5840 -40.5839 -40.5839 -19.6138 -19.6138 -19.6006 -19.6006 -19.1385 -19.1385 -19.1352 -19.1352 -19.0724 -19.0724 -19.0599 -19.0599 -11.5168 -11.5168 -11.4984 -11.4984 -10.0091 -10.0091 -9.9981 -9.9981 -9.9580 -9.9580 -9.9237 -9.9237 1.1683 1.1683 1.2729 1.2729 2.1270 2.1270 2.1609 2.1609 2.2808 2.2808 2.3149 2.3149 3.1660 3.1660 3.1738 3.1738 4.8749 4.8749 4.8778 4.8778 4.9680 4.9680 5.0131 5.0131 5.9046 5.9046 6.0070 6.0070 6.0802 6.0802 6.3157 6.3157 6.3677 6.3677 6.5114 6.5114 11.8731 11.8731 11.9991 11.9991 12.1207 12.1207 12.1876 12.1876 12.2339 12.2339 12.2556 12.2556 k = 0.5475 0.2467-0.0456 ( 4118 PWs) bands (ev): -40.5840 -40.5840 -40.5839 -40.5839 -19.6128 -19.6128 -19.6005 -19.6005 -19.1365 -19.1365 -19.1338 -19.1338 -19.0739 -19.0739 -19.0621 -19.0621 -11.5201 -11.5201 -11.5057 -11.5057 -10.0029 -10.0029 -9.9883 -9.9883 -9.9585 -9.9585 -9.9258 -9.9258 1.1792 1.1792 1.2628 1.2628 2.1250 2.1250 2.1551 2.1551 2.2598 2.2598 2.2842 2.2842 3.1685 3.1685 3.1738 3.1738 4.8861 4.8861 4.8920 4.8920 4.9636 4.9636 5.0039 5.0039 5.9171 5.9171 5.9973 5.9973 6.1197 6.1197 6.3101 6.3101 6.3857 6.3857 6.5084 6.5084 11.9008 11.9008 12.0113 12.0113 12.1241 12.1241 12.1935 12.1935 12.2269 12.2269 12.2461 12.2461 k = 0.5432 0.2447-0.0280 ( 4124 PWs) bands (ev): -40.5840 -40.5840 -40.5839 -40.5839 -19.6118 -19.6118 -19.6005 -19.6005 -19.1345 -19.1345 -19.1323 -19.1323 -19.0754 -19.0754 -19.0645 -19.0645 -11.5233 -11.5233 -11.5123 -11.5123 -9.9966 -9.9966 -9.9797 -9.9797 -9.9588 -9.9588 -9.9280 -9.9280 1.1894 1.1894 1.2545 1.2545 2.1230 2.1230 2.1498 2.1498 2.2395 2.2395 2.2554 2.2554 3.1703 3.1703 3.1740 3.1740 4.8961 4.8961 4.9053 4.9053 4.9604 4.9604 4.9959 4.9959 5.9257 5.9257 5.9863 5.9863 6.1579 6.1579 6.3087 6.3087 6.4023 6.4023 6.5050 6.5050 11.9279 11.9279 12.0236 12.0236 12.1272 12.1272 12.1979 12.1979 12.2197 12.2197 12.2373 12.2373 k = 0.5389 0.2428-0.0104 ( 4130 PWs) bands (ev): -40.5840 -40.5840 -40.5839 -40.5839 -19.6108 -19.6108 -19.6005 -19.6005 -19.1325 -19.1325 -19.1308 -19.1308 -19.0768 -19.0768 -19.0667 -19.0667 -11.5263 -11.5263 -11.5182 -11.5182 -9.9905 -9.9905 -9.9724 -9.9724 -9.9585 -9.9585 -9.9302 -9.9302 1.1988 1.1988 1.2479 1.2479 2.1210 2.1210 2.1448 2.1448 2.2201 2.2201 2.2289 2.2289 3.1716 3.1716 3.1743 3.1743 4.9057 4.9057 4.9170 4.9170 4.9583 4.9583 4.9889 4.9889 5.9306 5.9306 5.9745 5.9745 6.1945 6.1945 6.3114 6.3114 6.4170 6.4170 6.5011 6.5011 11.9545 11.9545 12.0358 12.0358 12.1301 12.1301 12.2005 12.2005 12.2124 12.2124 12.2292 12.2292 k = 0.5345 0.2409 0.0071 ( 4133 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6098 -19.6098 -19.6006 -19.6006 -19.1306 -19.1306 -19.1293 -19.1293 -19.0782 -19.0782 -19.0690 -19.0690 -11.5293 -11.5293 -11.5234 -11.5234 -9.9845 -9.9845 -9.9665 -9.9665 -9.9577 -9.9577 -9.9325 -9.9325 1.2072 1.2072 1.2428 1.2428 2.1193 2.1193 2.1402 2.1402 2.2016 2.2016 2.2051 2.2051 3.1725 3.1725 3.1745 3.1745 4.9148 4.9148 4.9271 4.9271 4.9571 4.9571 4.9831 4.9831 5.9321 5.9321 5.9627 5.9627 6.2294 6.2294 6.3177 6.3177 6.4295 6.4295 6.4965 6.4965 11.9802 11.9802 12.0479 12.0479 12.1330 12.1330 12.2008 12.2008 12.2054 12.2054 12.2220 12.2220 k = 0.5302 0.2389 0.0247 ( 4133 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6089 -19.6089 -19.6008 -19.6008 -19.1288 -19.1288 -19.1278 -19.1278 -19.0795 -19.0795 -19.0712 -19.0712 -11.5320 -11.5320 -11.5280 -11.5280 -9.9788 -9.9788 -9.9626 -9.9626 -9.9557 -9.9557 -9.9347 -9.9347 1.2146 1.2146 1.2392 1.2392 2.1177 2.1177 2.1359 2.1359 2.1826 2.1826 2.1856 2.1856 3.1730 3.1730 3.1748 3.1748 4.9233 4.9233 4.9355 4.9355 4.9569 4.9569 4.9782 4.9782 5.9309 5.9309 5.9512 5.9512 6.2622 6.2622 6.3271 6.3271 6.4395 6.4395 6.4911 6.4911 12.0049 12.0049 12.0597 12.0597 12.1358 12.1358 12.1961 12.1961 12.2008 12.2008 12.2159 12.2159 k = 0.5259 0.2370 0.0423 ( 4142 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6080 -19.6080 -19.6010 -19.6010 -19.1271 -19.1271 -19.1264 -19.1264 -19.0806 -19.0806 -19.0734 -19.0734 -11.5345 -11.5345 -11.5319 -11.5319 -9.9733 -9.9733 -9.9605 -9.9605 -9.9529 -9.9529 -9.9370 -9.9370 1.2208 1.2208 1.2367 1.2367 2.1164 2.1164 2.1319 2.1319 2.1643 2.1643 2.1697 2.1697 3.1734 3.1734 3.1749 3.1749 4.9312 4.9312 4.9421 4.9421 4.9576 4.9576 4.9743 4.9743 5.9278 5.9278 5.9405 5.9405 6.2930 6.2930 6.3389 6.3389 6.4467 6.4467 6.4849 6.4849 12.0286 12.0286 12.0714 12.0714 12.1386 12.1386 12.1887 12.1887 12.1970 12.1970 12.2106 12.2106 k = 0.5216 0.2350 0.0599 ( 4134 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6071 -19.6071 -19.6012 -19.6012 -19.1256 -19.1256 -19.1251 -19.1251 -19.0816 -19.0816 -19.0754 -19.0754 -11.5368 -11.5368 -11.5351 -11.5351 -9.9683 -9.9683 -9.9591 -9.9591 -9.9502 -9.9502 -9.9392 -9.9392 1.2259 1.2259 1.2354 1.2354 2.1154 2.1154 2.1283 2.1283 2.1489 2.1489 2.1557 2.1557 3.1737 3.1737 3.1749 3.1749 4.9382 4.9382 4.9469 4.9469 4.9592 4.9592 4.9712 4.9712 5.9236 5.9236 5.9310 5.9310 6.3214 6.3214 6.3522 6.3522 6.4510 6.4510 6.4776 6.4776 12.0509 12.0509 12.0828 12.0828 12.1412 12.1412 12.1808 12.1808 12.1921 12.1921 12.2054 12.2054 k = 0.5173 0.2331 0.0774 ( 4132 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6062 -19.6062 -19.6016 -19.6016 -19.1242 -19.1242 -19.1240 -19.1240 -19.0823 -19.0823 -19.0773 -19.0773 -11.5387 -11.5387 -11.5377 -11.5377 -9.9637 -9.9637 -9.9578 -9.9578 -9.9481 -9.9481 -9.9413 -9.9413 1.2298 1.2298 1.2348 1.2348 2.1148 2.1148 2.1248 2.1248 2.1368 2.1368 2.1436 2.1436 3.1738 3.1738 3.1748 3.1748 4.9442 4.9442 4.9501 4.9501 4.9613 4.9613 4.9689 4.9689 5.9190 5.9190 5.9229 5.9229 6.3472 6.3472 6.3663 6.3663 6.4522 6.4522 6.4693 6.4693 12.0718 12.0718 12.0939 12.0939 12.1436 12.1436 12.1727 12.1727 12.1869 12.1869 12.1997 12.1997 k = 0.5130 0.2311 0.0950 ( 4132 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6055 -19.6055 -19.6019 -19.6019 -19.1231 -19.1231 -19.1230 -19.1230 -19.0828 -19.0828 -19.0789 -19.0789 -11.5403 -11.5403 -11.5396 -11.5396 -9.9598 -9.9598 -9.9565 -9.9565 -9.9469 -9.9469 -9.9433 -9.9433 1.2326 1.2326 1.2349 1.2349 2.1145 2.1145 2.1212 2.1212 2.1283 2.1283 2.1337 2.1337 3.1740 3.1740 3.1747 3.1747 4.9490 4.9490 4.9522 4.9522 4.9635 4.9635 4.9673 4.9673 5.9146 5.9146 5.9165 5.9165 6.3704 6.3704 6.3808 6.3808 6.4504 6.4504 6.4600 6.4600 12.0910 12.0910 12.1047 12.1047 12.1454 12.1454 12.1644 12.1644 12.1821 12.1821 12.1934 12.1934 k = 0.5086 0.2292 0.1126 ( 4124 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6047 -19.6047 -19.6024 -19.6024 -19.1223 -19.1223 -19.1222 -19.1222 -19.0830 -19.0830 -19.0804 -19.0804 -11.5414 -11.5414 -11.5410 -11.5410 -9.9566 -9.9566 -9.9551 -9.9551 -9.9463 -9.9463 -9.9450 -9.9450 1.2344 1.2344 1.2352 1.2352 2.1144 2.1144 2.1174 2.1174 2.1236 2.1236 2.1262 2.1262 3.1741 3.1741 3.1746 3.1746 4.9523 4.9523 4.9536 4.9536 4.9651 4.9651 4.9664 4.9664 5.9111 5.9111 5.9119 5.9119 6.3906 6.3906 6.3951 6.3951 6.4455 6.4455 6.4497 6.4497 12.1081 12.1081 12.1149 12.1149 12.1458 12.1458 12.1559 12.1559 12.1782 12.1782 12.1869 12.1869 k = 0.5043 0.2272 0.1302 ( 4116 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6040 -19.6040 -19.6028 -19.6028 -19.1218 -19.1218 -19.1217 -19.1217 -19.0828 -19.0828 -19.0815 -19.0815 -11.5420 -11.5420 -11.5418 -11.5418 -9.9545 -9.9545 -9.9540 -9.9540 -9.9464 -9.9464 -9.9462 -9.9462 1.2353 1.2353 1.2356 1.2356 2.1143 2.1143 2.1148 2.1148 2.1211 2.1211 2.1216 2.1216 3.1742 3.1742 3.1744 3.1744 4.9541 4.9541 4.9546 4.9546 4.9660 4.9660 4.9662 4.9662 5.9088 5.9088 5.9091 5.9091 6.4071 6.4071 6.4082 6.4082 6.4382 6.4382 6.4392 6.4392 12.1224 12.1224 12.1243 12.1243 12.1434 12.1434 12.1475 12.1475 12.1763 12.1763 12.1812 12.1812 k = 0.5000 0.2253 0.1478 ( 4114 PWs) bands (ev): -40.5840 -40.5840 -40.5840 -40.5840 -19.6034 -19.6034 -19.6034 -19.6034 -19.1216 -19.1216 -19.1216 -19.1216 -19.0824 -19.0824 -19.0823 -19.0823 -11.5422 -11.5422 -11.5422 -11.5422 -9.9537 -9.9537 -9.9537 -9.9537 -9.9466 -9.9466 -9.9466 -9.9466 1.2357 1.2357 1.2357 1.2357 2.1141 2.1141 2.1141 2.1141 2.1202 2.1202 2.1202 2.1202 3.1743 3.1743 3.1743 3.1743 4.9548 4.9548 4.9548 4.9548 4.9662 4.9662 4.9662 4.9662 5.9081 5.9081 5.9081 5.9081 6.4159 6.4159 6.4159 6.4159 6.4324 6.4324 6.4324 6.4324 12.1301 12.1301 12.1301 12.1301 12.1410 12.1410 12.1410 12.1410 12.1774 12.1774 12.1774 12.1774 k = 0.5000-0.4422-0.2900 ( 4142 PWs) bands (ev): -40.5837 -40.5837 -40.5837 -40.5837 -19.6094 -19.6094 -19.6094 -19.6094 -19.1350 -19.1350 -19.1350 -19.1350 -19.0780 -19.0780 -19.0780 -19.0780 -11.3886 -11.3886 -11.3886 -11.3886 -10.0964 -10.0964 -10.0964 -10.0964 -9.9914 -9.9914 -9.9914 -9.9914 1.3111 1.3111 1.3111 1.3111 2.0465 2.0465 2.0465 2.0465 2.8953 2.8953 2.8953 2.8953 3.2063 3.2063 3.2063 3.2063 4.5286 4.5286 4.5286 4.5286 5.1228 5.1228 5.1229 5.1229 5.6225 5.6225 5.6225 5.6225 5.8725 5.8725 5.8725 5.8725 6.7556 6.7556 6.7557 6.7557 11.8180 11.8180 11.8180 11.8180 12.0911 12.0911 12.0911 12.0911 12.2920 12.2920 12.2920 12.2920 k = 0.5130-0.4320-0.2833 ( 4140 PWs) bands (ev): -40.5838 -40.5838 -40.5837 -40.5837 -19.6102 -19.6102 -19.6086 -19.6086 -19.1355 -19.1355 -19.1348 -19.1348 -19.0791 -19.0791 -19.0766 -19.0766 -11.3952 -11.3952 -11.3819 -11.3819 -10.1091 -10.1091 -10.0839 -10.0839 -9.9960 -9.9960 -9.9867 -9.9867 1.2890 1.2890 1.3333 1.3333 2.0395 2.0395 2.0545 2.0545 2.8831 2.8831 2.9074 2.9074 3.2043 3.2043 3.2074 3.2074 4.5123 4.5123 4.5455 4.5455 5.1038 5.1038 5.1413 5.1413 5.5981 5.5981 5.6475 5.6475 5.8683 5.8683 5.8758 5.8758 6.7523 6.7523 6.7586 6.7586 11.8050 11.8050 11.8295 11.8295 12.0767 12.0767 12.1054 12.1054 12.2833 12.2833 12.3007 12.3007 k = 0.5259-0.4217-0.2766 ( 4138 PWs) bands (ev): -40.5838 -40.5838 -40.5836 -40.5836 -19.6110 -19.6110 -19.6079 -19.6079 -19.1362 -19.1362 -19.1348 -19.1348 -19.0798 -19.0798 -19.0748 -19.0748 -11.4015 -11.4015 -11.3750 -11.3750 -10.1220 -10.1220 -10.0717 -10.0717 -10.0006 -10.0006 -9.9820 -9.9820 1.2673 1.2673 1.3558 1.3558 2.0336 2.0336 2.0637 2.0637 2.8709 2.8709 2.9194 2.9194 3.2016 3.2016 3.2077 3.2077 4.4969 4.4969 4.5628 4.5628 5.0844 5.0844 5.1590 5.1590 5.5744 5.5744 5.6730 5.6730 5.8632 5.8632 5.8777 5.8777 6.7487 6.7487 6.7609 6.7609 11.7904 11.7904 11.8394 11.8394 12.0621 12.0621 12.1195 12.1195 12.2745 12.2745 12.3094 12.3094 k = 0.5389-0.4115-0.2699 ( 4134 PWs) bands (ev): -40.5839 -40.5839 -40.5836 -40.5836 -19.6119 -19.6119 -19.6073 -19.6073 -19.1372 -19.1372 -19.1352 -19.1352 -19.0801 -19.0801 -19.0728 -19.0728 -11.4076 -11.4076 -11.3680 -11.3680 -10.1351 -10.1351 -10.0599 -10.0599 -10.0051 -10.0051 -9.9774 -9.9774 1.2460 1.2460 1.3784 1.3784 2.0287 2.0287 2.0739 2.0739 2.8587 2.8587 2.9312 2.9312 3.1984 3.1984 3.2070 3.2070 4.4825 4.4825 4.5802 4.5802 5.0647 5.0647 5.1760 5.1760 5.5516 5.5516 5.6989 5.6989 5.8577 5.8577 5.8780 5.8780 6.7451 6.7451 6.7623 6.7623 11.7744 11.7744 11.8477 11.8477 12.0476 12.0476 12.1333 12.1333 12.2656 12.2656 12.3179 12.3179 k = 0.5518-0.4012-0.2631 ( 4132 PWs) bands (ev): -40.5839 -40.5839 -40.5835 -40.5835 -19.6129 -19.6129 -19.6067 -19.6067 -19.1383 -19.1383 -19.1357 -19.1357 -19.0801 -19.0801 -19.0705 -19.0705 -11.4135 -11.4135 -11.3610 -11.3610 -10.1483 -10.1483 -10.0484 -10.0484 -10.0094 -10.0094 -9.9728 -9.9728 1.2250 1.2250 1.4010 1.4010 2.0247 2.0247 2.0854 2.0854 2.8466 2.8466 2.9425 2.9425 3.1950 3.1950 3.2052 3.2052 4.4691 4.4691 4.5972 4.5972 5.0453 5.0453 5.1922 5.1922 5.5297 5.5297 5.7250 5.7250 5.8518 5.8518 5.8765 5.8765 6.7419 6.7419 6.7628 6.7628 11.7571 11.7571 11.8545 11.8545 12.0330 12.0330 12.1467 12.1467 12.2569 12.2569 12.3263 12.3263 k = 0.5648-0.3910-0.2564 ( 4129 PWs) bands (ev): -40.5840 -40.5840 -40.5835 -40.5835 -19.6139 -19.6139 -19.6062 -19.6062 -19.1397 -19.1397 -19.1365 -19.1365 -19.0797 -19.0797 -19.0681 -19.0681 -11.4190 -11.4190 -11.3539 -11.3539 -10.1615 -10.1615 -10.0377 -10.0377 -10.0132 -10.0132 -9.9683 -9.9683 1.2045 1.2045 1.4236 1.4236 2.0214 2.0214 2.0981 2.0981 2.8347 2.8347 2.9533 2.9533 3.1914 3.1914 3.2024 3.2024 4.4568 4.4568 4.6133 4.6133 5.0266 5.0266 5.2077 5.2077 5.5087 5.5087 5.7512 5.7512 5.8460 5.8460 5.8730 5.8730 6.7391 6.7391 6.7621 6.7621 11.7386 11.7386 11.8597 11.8597 12.0184 12.0184 12.1597 12.1597 12.2482 12.2482 12.3346 12.3346 k = 0.5777-0.3807-0.2497 ( 4128 PWs) bands (ev): -40.5840 -40.5840 -40.5834 -40.5834 -19.6150 -19.6150 -19.6058 -19.6058 -19.1412 -19.1412 -19.1375 -19.1375 -19.0790 -19.0790 -19.0656 -19.0656 -11.4242 -11.4242 -11.3469 -11.3469 -10.1748 -10.1748 -10.0288 -10.0288 -10.0155 -10.0155 -9.9638 -9.9638 1.1845 1.1845 1.4461 1.4461 2.0190 2.0190 2.1119 2.1119 2.8228 2.8228 2.9633 2.9633 3.1879 3.1879 3.1985 3.1985 4.4456 4.4456 4.6276 4.6276 5.0094 5.0094 5.2226 5.2226 5.4888 5.4888 5.7771 5.7771 5.8403 5.8403 5.8672 5.8672 6.7371 6.7371 6.7602 6.7602 11.7190 11.7190 11.8634 11.8634 12.0039 12.0039 12.1720 12.1720 12.2399 12.2399 12.3426 12.3426 k = 0.5907-0.3705-0.2430 ( 4127 PWs) bands (ev): -40.5841 -40.5841 -40.5834 -40.5834 -19.6161 -19.6161 -19.6054 -19.6054 -19.1429 -19.1429 -19.1386 -19.1386 -19.0780 -19.0780 -19.0630 -19.0630 -11.4291 -11.4291 -11.3399 -11.3399 -10.1880 -10.1880 -10.0263 -10.0263 -10.0115 -10.0115 -9.9595 -9.9595 1.1651 1.1651 1.4685 1.4685 2.0172 2.0172 2.1270 2.1270 2.8112 2.8112 2.9723 2.9723 3.1849 3.1849 3.1937 3.1937 4.4355 4.4355 4.6393 4.6393 4.9945 4.9945 5.2370 5.2370 5.4699 5.4699 5.8019 5.8019 5.8358 5.8358 5.8589 5.8589 6.7361 6.7361 6.7571 6.7571 11.6984 11.6984 11.8658 11.8658 11.9896 11.9896 12.1831 12.1831 12.2323 12.2323 12.3505 12.3505 k = 0.6036-0.3603-0.2363 ( 4134 PWs) bands (ev): -40.5842 -40.5842 -40.5833 -40.5833 -19.6172 -19.6172 -19.6051 -19.6051 -19.1447 -19.1447 -19.1396 -19.1396 -19.0769 -19.0769 -19.0602 -19.0602 -11.4337 -11.4337 -11.3330 -11.3330 -10.2011 -10.2011 -10.0289 -10.0289 -10.0027 -10.0027 -9.9553 -9.9553 1.1463 1.1463 1.4906 1.4906 2.0159 2.0159 2.1432 2.1432 2.7997 2.7997 2.9800 2.9800 3.1823 3.1823 3.1882 3.1882 4.4264 4.4264 4.6474 4.6474 4.9830 4.9830 5.2509 5.2509 5.4520 5.4520 5.8195 5.8195 5.8383 5.8383 5.8485 5.8485 6.7361 6.7361 6.7527 6.7527 11.6772 11.6772 11.8669 11.8669 11.9755 11.9755 12.1916 12.1916 12.2270 12.2270 12.3582 12.3582 k = 0.6166-0.3500-0.2296 ( 4142 PWs) bands (ev): -40.5842 -40.5842 -40.5832 -40.5832 -19.6184 -19.6184 -19.6048 -19.6048 -19.1467 -19.1467 -19.1407 -19.1407 -19.0755 -19.0755 -19.0575 -19.0575 -11.4379 -11.4379 -11.3264 -11.3264 -10.2141 -10.2141 -10.0323 -10.0323 -9.9934 -9.9934 -9.9512 -9.9512 1.1280 1.1280 1.5124 1.5124 2.0152 2.0152 2.1605 2.1605 2.7884 2.7884 2.9862 2.9862 3.1788 3.1788 3.1838 3.1838 4.4182 4.4182 4.6508 4.6508 4.9761 4.9761 5.2646 5.2646 5.4351 5.4351 5.8196 5.8196 5.8346 5.8346 5.8593 5.8593 6.7370 6.7370 6.7471 6.7471 11.6554 11.6554 11.8669 11.8669 11.9616 11.9616 12.1942 12.1942 12.2270 12.2270 12.3656 12.3656 k = 0.6295-0.3398-0.2228 ( 4140 PWs) bands (ev): -40.5843 -40.5843 -40.5832 -40.5832 -19.6196 -19.6196 -19.6046 -19.6046 -19.1487 -19.1487 -19.1418 -19.1418 -19.0740 -19.0740 -19.0547 -19.0547 -11.4418 -11.4418 -11.3200 -11.3200 -10.2269 -10.2269 -10.0358 -10.0358 -9.9841 -9.9841 -9.9473 -9.9473 1.1105 1.1105 1.5338 1.5338 2.0149 2.0149 2.1789 2.1789 2.7773 2.7773 2.9907 2.9907 3.1722 3.1722 3.1831 3.1831 4.4109 4.4109 4.6489 4.6489 4.9745 4.9745 5.2780 5.2780 5.4193 5.4193 5.8148 5.8148 5.8200 5.8200 5.8834 5.8834 6.7371 6.7371 6.7425 6.7425 11.6331 11.6331 11.8657 11.8657 11.9480 11.9480 12.1902 12.1902 12.2333 12.2333 12.3727 12.3727 k = 0.6425-0.3295-0.2161 ( 4141 PWs) bands (ev): -40.5844 -40.5844 -40.5831 -40.5831 -19.6208 -19.6208 -19.6044 -19.6044 -19.1509 -19.1509 -19.1427 -19.1427 -19.0725 -19.0725 -19.0519 -19.0519 -11.4452 -11.4452 -11.3139 -11.3139 -10.2393 -10.2393 -10.0393 -10.0393 -9.9752 -9.9752 -9.9435 -9.9435 1.0936 1.0936 1.5547 1.5547 2.0149 2.0149 2.1983 2.1983 2.7665 2.7665 2.9931 2.9931 3.1642 3.1642 3.1845 3.1845 4.4043 4.4043 4.6414 4.6414 4.9783 4.9783 5.2914 5.2914 5.4046 5.4046 5.7996 5.7996 5.8132 5.8132 5.9077 5.9077 6.7304 6.7304 6.7445 6.7445 11.6107 11.6107 11.8635 11.8635 11.9347 11.9347 12.1829 12.1829 12.2425 12.2425 12.3795 12.3795 k = 0.6554-0.3193-0.2094 ( 4144 PWs) bands (ev): -40.5844 -40.5844 -40.5830 -40.5830 -19.6220 -19.6220 -19.6043 -19.6043 -19.1531 -19.1531 -19.1436 -19.1436 -19.0708 -19.0708 -19.0492 -19.0492 -11.4483 -11.4483 -11.3082 -11.3082 -10.2514 -10.2514 -10.0425 -10.0425 -9.9668 -9.9668 -9.9398 -9.9398 1.0775 1.0775 1.5752 1.5752 2.0151 2.0151 2.2187 2.2187 2.7558 2.7558 2.9935 2.9935 3.1556 3.1556 3.1876 3.1876 4.3983 4.3983 4.6290 4.6290 4.9873 4.9873 5.3048 5.3048 5.3909 5.3909 5.7793 5.7793 5.8097 5.8097 5.9316 5.9316 6.7211 6.7211 6.7490 6.7490 11.5882 11.5882 11.8604 11.8604 11.9219 11.9219 12.1743 12.1743 12.2526 12.2526 12.3859 12.3859 k = 0.6684-0.3091-0.2027 ( 4133 PWs) bands (ev): -40.5845 -40.5845 -40.5830 -40.5830 -19.6231 -19.6231 -19.6042 -19.6042 -19.1553 -19.1553 -19.1444 -19.1444 -19.0691 -19.0691 -19.0464 -19.0464 -11.4510 -11.4510 -11.3030 -11.3030 -10.2630 -10.2630 -10.0455 -10.0455 -9.9587 -9.9587 -9.9363 -9.9363 1.0621 1.0621 1.5950 1.5950 2.0155 2.0155 2.2400 2.2400 2.7454 2.7454 2.9919 2.9919 3.1466 3.1466 3.1921 3.1921 4.3928 4.3928 4.6125 4.6125 5.0007 5.0007 5.3184 5.3184 5.3783 5.3783 5.7567 5.7567 5.8069 5.8069 5.9548 5.9548 6.7105 6.7105 6.7548 6.7548 11.5659 11.5659 11.8566 11.8566 11.9095 11.9095 12.1652 12.1652 12.2629 12.2629 12.3921 12.3921 k = 0.6813-0.2988-0.1960 ( 4131 PWs) bands (ev): -40.5846 -40.5846 -40.5829 -40.5829 -19.6243 -19.6243 -19.6041 -19.6041 -19.1575 -19.1575 -19.1451 -19.1451 -19.0675 -19.0675 -19.0437 -19.0437 -11.4532 -11.4532 -11.2983 -11.2983 -10.2741 -10.2741 -10.0484 -10.0484 -9.9513 -9.9513 -9.9328 -9.9328 1.0475 1.0475 1.6141 1.6141 2.0159 2.0159 2.2621 2.2621 2.7353 2.7353 2.9884 2.9884 3.1374 3.1374 3.1977 3.1977 4.3875 4.3875 4.5931 4.5931 5.0173 5.0173 5.3321 5.3321 5.3668 5.3668 5.7323 5.7323 5.8047 5.8047 5.9774 5.9774 6.6988 6.6988 6.7616 6.7616 11.5439 11.5439 11.8520 11.8520 11.8976 11.8976 12.1558 12.1558 12.2730 12.2730 12.3979 12.3979 k = 0.6943-0.2886-0.1893 ( 4131 PWs) bands (ev): -40.5846 -40.5846 -40.5828 -40.5828 -19.6255 -19.6255 -19.6040 -19.6040 -19.1597 -19.1597 -19.1457 -19.1457 -19.0659 -19.0659 -19.0411 -19.0411 -11.4551 -11.4551 -11.2941 -11.2941 -10.2846 -10.2846 -10.0510 -10.0510 -9.9446 -9.9446 -9.9292 -9.9292 1.0337 1.0337 1.6324 1.6324 2.0164 2.0164 2.2849 2.2849 2.7253 2.7253 2.9832 2.9832 3.1281 3.1281 3.2041 3.2041 4.3825 4.3825 4.5717 4.5717 5.0365 5.0365 5.3450 5.3450 5.3577 5.3577 5.7063 5.7063 5.8031 5.8031 5.9991 5.9991 6.6862 6.6862 6.7690 6.7690 11.5223 11.5223 11.8468 11.8468 11.8863 11.8863 12.1464 12.1464 12.2829 12.2829 12.4033 12.4033 k = 0.7072-0.2783-0.1825 ( 4131 PWs) bands (ev): -40.5847 -40.5847 -40.5827 -40.5827 -19.6266 -19.6266 -19.6040 -19.6040 -19.1619 -19.1619 -19.1462 -19.1462 -19.0643 -19.0643 -19.0386 -19.0386 -11.4565 -11.4565 -11.2907 -11.2907 -10.2943 -10.2943 -10.0533 -10.0533 -9.9388 -9.9388 -9.9253 -9.9253 1.0206 1.0206 1.6499 1.6499 2.0167 2.0167 2.3082 2.3082 2.7157 2.7157 2.9766 2.9766 3.1190 3.1190 3.2108 3.2108 4.3776 4.3776 4.5494 4.5494 5.0573 5.0573 5.3444 5.3444 5.3635 5.3635 5.6792 5.6792 5.8022 5.8022 6.0200 6.0200 6.6727 6.6727 6.7770 6.7770 11.5013 11.5013 11.8410 11.8410 11.8756 11.8756 12.1370 12.1370 12.2925 12.2925 12.4084 12.4084 k = 0.7202-0.2681-0.1758 ( 4132 PWs) bands (ev): -40.5848 -40.5848 -40.5827 -40.5827 -19.6278 -19.6278 -19.6039 -19.6039 -19.1641 -19.1641 -19.1466 -19.1466 -19.0629 -19.0629 -19.0361 -19.0361 -11.4576 -11.4576 -11.2880 -11.2880 -10.3034 -10.3034 -10.0554 -10.0554 -9.9341 -9.9341 -9.9210 -9.9210 1.0084 1.0084 1.6665 1.6665 2.0170 2.0170 2.3319 2.3319 2.7063 2.7063 2.9686 2.9686 3.1102 3.1102 3.2174 3.2174 4.3727 4.3727 4.5269 4.5269 5.0792 5.0792 5.3365 5.3365 5.3783 5.3783 5.6512 5.6512 5.8020 5.8020 6.0401 6.0401 6.6585 6.6585 6.7854 6.7854 11.4811 11.4811 11.8347 11.8347 11.8656 11.8656 12.1276 12.1276 12.3018 12.3018 12.4132 12.4132 k = 0.7331-0.2579-0.1691 ( 4133 PWs) bands (ev): -40.5849 -40.5849 -40.5826 -40.5826 -19.6289 -19.6289 -19.6039 -19.6039 -19.1661 -19.1661 -19.1469 -19.1469 -19.0615 -19.0615 -19.0338 -19.0338 -11.4582 -11.4582 -11.2861 -11.2861 -10.3116 -10.3116 -10.0572 -10.0572 -9.9306 -9.9306 -9.9161 -9.9161 0.9970 0.9970 1.6821 1.6821 2.0170 2.0170 2.3559 2.3559 2.6972 2.6972 2.9596 2.9596 3.1020 3.1020 3.2236 3.2236 4.3677 4.3677 4.5049 4.5049 5.1017 5.1017 5.3292 5.3292 5.3942 5.3942 5.6226 5.6226 5.8024 5.8024 6.0592 6.0592 6.6437 6.6437 6.7939 6.7939 11.4618 11.4618 11.8280 11.8280 11.8562 11.8562 12.1185 12.1185 12.3106 12.3106 12.4176 12.4176 k = 0.7461-0.2476-0.1624 ( 4136 PWs) bands (ev): -40.5850 -40.5850 -40.5825 -40.5825 -19.6299 -19.6299 -19.6038 -19.6038 -19.1682 -19.1682 -19.1470 -19.1470 -19.0603 -19.0603 -19.0315 -19.0315 -11.4584 -11.4584 -11.2851 -11.2851 -10.3188 -10.3188 -10.0587 -10.0587 -9.9280 -9.9280 -9.9110 -9.9110 0.9864 0.9864 1.6967 1.6967 2.0168 2.0168 2.3800 2.3800 2.6885 2.6885 2.9495 2.9495 3.0944 3.0944 3.2288 3.2288 4.3627 4.3627 4.4841 4.4841 5.1242 5.1242 5.3231 5.3231 5.4108 5.4108 5.5938 5.5938 5.8035 5.8035 6.0774 6.0774 6.6284 6.6284 6.8025 6.8025 11.4435 11.4435 11.8210 11.8210 11.8475 11.8475 12.1096 12.1096 12.3190 12.3190 12.4217 12.4217 k = 0.7590-0.2374-0.1557 ( 4135 PWs) bands (ev): -40.5851 -40.5851 -40.5824 -40.5824 -19.6310 -19.6310 -19.6037 -19.6037 -19.1701 -19.1701 -19.1471 -19.1471 -19.0591 -19.0591 -19.0293 -19.0293 -11.4583 -11.4583 -11.2850 -11.2850 -10.3252 -10.3252 -10.0600 -10.0600 -9.9261 -9.9261 -9.9059 -9.9059 0.9767 0.9767 1.7102 1.7102 2.0164 2.0164 2.4039 2.4039 2.6801 2.6801 2.9385 2.9385 3.0877 3.0877 3.2329 3.2329 4.3574 4.3574 4.4649 4.4649 5.1462 5.1462 5.3184 5.3184 5.4280 5.4280 5.5652 5.5652 5.8053 5.8053 6.0947 6.0947 6.6128 6.6128 6.8109 6.8109 11.4264 11.4264 11.8138 11.8138 11.8395 11.8395 12.1009 12.1009 12.3270 12.3270 12.4256 12.4256 k = 0.7720-0.2271-0.1490 ( 4134 PWs) bands (ev): -40.5852 -40.5852 -40.5823 -40.5823 -19.6320 -19.6320 -19.6036 -19.6036 -19.1720 -19.1720 -19.1471 -19.1471 -19.0582 -19.0582 -19.0272 -19.0272 -11.4577 -11.4577 -11.2858 -11.2858 -10.3305 -10.3305 -10.0610 -10.0610 -9.9247 -9.9247 -9.9010 -9.9010 0.9678 0.9678 1.7225 1.7225 2.0156 2.0156 2.4273 2.4273 2.6723 2.6723 2.9266 2.9266 3.0821 3.0821 3.2353 3.2353 4.3521 4.3521 4.4478 4.4478 5.1671 5.1671 5.3155 5.3155 5.4456 5.4456 5.5370 5.5370 5.8079 5.8079 6.1111 6.1111 6.5969 6.5969 6.8190 6.8190 11.4105 11.4105 11.8063 11.8063 11.8323 11.8323 12.0925 12.0925 12.3345 12.3345 12.4291 12.4291 k = 0.7849-0.2169-0.1423 ( 4131 PWs) bands (ev): -40.5853 -40.5853 -40.5822 -40.5822 -19.6329 -19.6329 -19.6035 -19.6035 -19.1737 -19.1737 -19.1470 -19.1470 -19.0574 -19.0574 -19.0253 -19.0253 -11.4567 -11.4567 -11.2877 -11.2877 -10.3347 -10.3347 -10.0616 -10.0616 -9.9237 -9.9237 -9.8962 -9.8962 0.9598 0.9598 1.7336 1.7336 2.0146 2.0146 2.4500 2.4500 2.6650 2.6650 2.9138 2.9138 3.0776 3.0776 3.2358 3.2358 4.3466 4.3466 4.4333 4.4333 5.1859 5.1859 5.3152 5.3152 5.4634 5.4634 5.5098 5.5098 5.8112 5.8112 6.1266 6.1266 6.5809 6.5809 6.8266 6.8266 11.3960 11.3960 11.7986 11.7986 11.8259 11.8259 12.0845 12.0845 12.3415 12.3415 12.4325 12.4325 Writing output data file ScBO3.save init_run : 0.35s CPU 1.08s WALL ( 1 calls) electrons : 321.82s CPU 327.29s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.21s WALL ( 1 calls) potinit : 0.03s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 321.81s CPU 327.28s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.05s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.08s WALL ( 281 calls) cegterg : 297.85s CPU 301.37s WALL ( 551 calls) Called by sum_band: Called by *egterg: h_psi : 192.39s CPU 194.56s WALL ( 7014 calls) s_psi : 8.55s CPU 8.51s WALL ( 7014 calls) g_psi : 0.39s CPU 0.37s WALL ( 6182 calls) cdiaghg : 85.46s CPU 86.68s WALL ( 6463 calls) cegterg:over : 11.77s CPU 12.13s WALL ( 6182 calls) cegterg:upda : 8.82s CPU 8.93s WALL ( 6182 calls) cegterg:last : 5.73s CPU 5.69s WALL ( 1394 calls) cdiaghg:chol : 4.86s CPU 5.06s WALL ( 6463 calls) cdiaghg:inve : 3.60s CPU 3.68s WALL ( 6463 calls) cdiaghg:para : 6.57s CPU 6.43s WALL ( 12926 calls) Called by h_psi: h_psi:vloc : 171.17s CPU 173.20s WALL ( 7014 calls) h_psi:vnl : 20.76s CPU 20.92s WALL ( 7014 calls) add_vuspsi : 10.53s CPU 10.34s WALL ( 7014 calls) General routines calbec : 10.20s CPU 10.56s WALL ( 7014 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 159.44s CPU 161.42s WALL ( 1304668 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.23s CPU 0.25s WALL ( 562 calls) Parallel routines fft_scatter : 45.11s CPU 45.14s WALL ( 1304691 calls) PWSCF : 5m40.66s CPU 6m15.16s WALL This run was terminated on: 15:58:45 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=