Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:45:23 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: ./LiN.save/ 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 95 95 27 1975 1975 300 Max 96 96 28 1977 1977 301 Sum 3421 3421 975 71129 71129 10819 bravais-lattice index = 14 lattice parameter (alat) = 11.4114 a.u. unit-cell volume = 503.7735 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 32.00 number of Kohn-Sham states= 40 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 412.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.411398 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.866688 celldm(5)= -0.730035 celldm(6)= 0.596722 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.596722 0.802448 0.000000 ) a(3) = ( -0.730035 -0.537181 0.422476 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.743628 0.782463 ) b(2) = ( 0.000000 1.246187 1.584535 ) b(3) = ( 0.000000 0.000000 2.366999 ) PseudoPot. # 1 for Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 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 N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 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 Li 3.00 6.94100 Li( 1.00) N 5.00 14.00670 N( 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= 436 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022936 k( 2) = ( -0.0049250 0.0097998 0.0156075), wk = 0.0022936 k( 3) = ( -0.0098499 0.0195995 0.0312151), wk = 0.0022936 k( 4) = ( -0.0147749 0.0293993 0.0468226), wk = 0.0022936 k( 5) = ( -0.0196998 0.0391990 0.0624302), wk = 0.0022936 k( 6) = ( -0.0246248 0.0489988 0.0780377), wk = 0.0022936 k( 7) = ( -0.0295498 0.0587986 0.0936453), wk = 0.0022936 k( 8) = ( -0.0344747 0.0685983 0.1092528), wk = 0.0022936 k( 9) = ( -0.0393997 0.0783981 0.1248604), wk = 0.0022936 k( 10) = ( -0.0443246 0.0881978 0.1404679), wk = 0.0022936 k( 11) = ( -0.0492496 0.0979976 0.1560755), wk = 0.0022936 k( 12) = ( -0.0541746 0.1077974 0.1716830), wk = 0.0022936 k( 13) = ( -0.0590995 0.1175971 0.1872906), wk = 0.0022936 k( 14) = ( -0.0640245 0.1273969 0.2028981), wk = 0.0022936 k( 15) = ( -0.0689494 0.1371966 0.2185057), wk = 0.0022936 k( 16) = ( -0.0738744 0.1469964 0.2341132), wk = 0.0022936 k( 17) = ( -0.0787994 0.1567961 0.2497208), wk = 0.0022936 k( 18) = ( -0.0837243 0.1665959 0.2653283), wk = 0.0022936 k( 19) = ( -0.0886493 0.1763957 0.2809358), wk = 0.0022936 k( 20) = ( -0.0935742 0.1861954 0.2965434), wk = 0.0022936 k( 21) = ( -0.0984992 0.1959952 0.3121509), wk = 0.0022936 k( 22) = ( -0.1034242 0.2057949 0.3277585), wk = 0.0022936 k( 23) = ( -0.1083491 0.2155947 0.3433660), wk = 0.0022936 k( 24) = ( -0.1132741 0.2253945 0.3589736), wk = 0.0022936 k( 25) = ( -0.1181990 0.2351942 0.3745811), wk = 0.0022936 k( 26) = ( -0.1231240 0.2449940 0.3901887), wk = 0.0022936 k( 27) = ( -0.1280490 0.2547937 0.4057962), wk = 0.0022936 k( 28) = ( -0.1329739 0.2645935 0.4214038), wk = 0.0022936 k( 29) = ( -0.1378989 0.2743933 0.4370113), wk = 0.0022936 k( 30) = ( -0.1428238 0.2841930 0.4526189), wk = 0.0022936 k( 31) = ( -0.1477488 0.2939928 0.4682264), wk = 0.0022936 k( 32) = ( -0.1526738 0.3037925 0.4838340), wk = 0.0022936 k( 33) = ( -0.1575987 0.3135923 0.4994415), wk = 0.0022936 k( 34) = ( -0.1625237 0.3233921 0.5150490), wk = 0.0022936 k( 35) = ( -0.1674486 0.3331918 0.5306566), wk = 0.0022936 k( 36) = ( -0.1723736 0.3429916 0.5462641), wk = 0.0022936 k( 37) = ( -0.1772986 0.3527913 0.5618717), wk = 0.0022936 k( 38) = ( -0.1822235 0.3625911 0.5774792), wk = 0.0022936 k( 39) = ( -0.1871485 0.3723908 0.5930868), wk = 0.0022936 k( 40) = ( -0.1920734 0.3821906 0.6086943), wk = 0.0022936 k( 41) = ( -0.1969984 0.3919904 0.6243019), wk = 0.0022936 k( 42) = ( -0.2019234 0.4017901 0.6399094), wk = 0.0022936 k( 43) = ( -0.2068483 0.4115899 0.6555170), wk = 0.0022936 k( 44) = ( -0.2117733 0.4213896 0.6711245), wk = 0.0022936 k( 45) = ( -0.2166982 0.4311894 0.6867321), wk = 0.0022936 k( 46) = ( -0.2216232 0.4409892 0.7023396), wk = 0.0022936 k( 47) = ( -0.2265482 0.4507889 0.7179472), wk = 0.0022936 k( 48) = ( -0.2314731 0.4605887 0.7335547), wk = 0.0022936 k( 49) = ( -0.2363981 0.4703884 0.7491623), wk = 0.0022936 k( 50) = ( -0.2413230 0.4801882 0.7647698), wk = 0.0022936 k( 51) = ( -0.2462480 0.4899880 0.7803773), wk = 0.0022936 k( 52) = ( -0.2511730 0.4997877 0.7959849), wk = 0.0022936 k( 53) = ( -0.2560979 0.5095875 0.8115924), wk = 0.0022936 k( 54) = ( -0.2610229 0.5193872 0.8272000), wk = 0.0022936 k( 55) = ( -0.2659478 0.5291870 0.8428075), wk = 0.0022936 k( 56) = ( -0.2708728 0.5389867 0.8584150), wk = 0.0022936 k( 57) = ( -0.2708728 0.5389867 0.8584150), wk = 0.0022936 k( 58) = ( -0.2639484 0.5252085 0.8692512), wk = 0.0022936 k( 59) = ( -0.2570240 0.5114303 0.8800874), wk = 0.0022936 k( 60) = ( -0.2500997 0.4976520 0.8909235), wk = 0.0022936 k( 61) = ( -0.2431753 0.4838738 0.9017596), wk = 0.0022936 k( 62) = ( -0.2362509 0.4700956 0.9125958), wk = 0.0022936 k( 63) = ( -0.2293265 0.4563174 0.9234319), wk = 0.0022936 k( 64) = ( -0.2224021 0.4425391 0.9342681), wk = 0.0022936 k( 65) = ( -0.2154778 0.4287609 0.9451042), wk = 0.0022936 k( 66) = ( -0.2085534 0.4149827 0.9559404), wk = 0.0022936 k( 67) = ( -0.2016290 0.4012044 0.9667765), wk = 0.0022936 k( 68) = ( -0.1947046 0.3874262 0.9776126), wk = 0.0022936 k( 69) = ( -0.1877803 0.3736480 0.9884488), wk = 0.0022936 k( 70) = ( -0.1808559 0.3598697 0.9992849), wk = 0.0022936 k( 71) = ( -0.1739315 0.3460915 1.0101211), wk = 0.0022936 k( 72) = ( -0.1670071 0.3323133 1.0209572), wk = 0.0022936 k( 73) = ( -0.1600827 0.3185351 1.0317934), wk = 0.0022936 k( 74) = ( -0.1531584 0.3047568 1.0426295), wk = 0.0022936 k( 75) = ( -0.1462340 0.2909786 1.0534657), wk = 0.0022936 k( 76) = ( -0.1393096 0.2772004 1.0643018), wk = 0.0022936 k( 77) = ( -0.1323852 0.2634221 1.0751379), wk = 0.0022936 k( 78) = ( -0.1254609 0.2496439 1.0859741), wk = 0.0022936 k( 79) = ( -0.1185365 0.2358657 1.0968102), wk = 0.0022936 k( 80) = ( -0.1116121 0.2220874 1.1076464), wk = 0.0022936 k( 81) = ( -0.1046877 0.2083092 1.1184825), wk = 0.0022936 k( 82) = ( -0.0977633 0.1945310 1.1293187), wk = 0.0022936 k( 83) = ( -0.0908390 0.1807527 1.1401548), wk = 0.0022936 k( 84) = ( -0.0839146 0.1669745 1.1509910), wk = 0.0022936 k( 85) = ( -0.0769902 0.1531963 1.1618271), wk = 0.0022936 k( 86) = ( -0.0700658 0.1394181 1.1726632), wk = 0.0022936 k( 87) = ( -0.0631415 0.1256398 1.1834994), wk = 0.0022936 k( 88) = ( -0.0631415 0.1256398 1.1834994), wk = 0.0022936 k( 89) = ( -0.0552488 0.1099348 1.1834994), wk = 0.0022936 k( 90) = ( -0.0473561 0.0942299 1.1834994), wk = 0.0022936 k( 91) = ( -0.0394634 0.0785249 1.1834994), wk = 0.0022936 k( 92) = ( -0.0315707 0.0628199 1.1834994), wk = 0.0022936 k( 93) = ( -0.0236780 0.0471149 1.1834994), wk = 0.0022936 k( 94) = ( -0.0157854 0.0314100 1.1834994), wk = 0.0022936 k( 95) = ( -0.0078927 0.0157050 1.1834994), wk = 0.0022936 k( 96) = ( 0.0000000 0.0000000 1.1834994), wk = 0.0022936 k( 97) = ( 0.0000000 0.0000000 1.1834994), wk = 0.0022936 k( 98) = ( 0.0166667 0.0083760 1.1834994), wk = 0.0022936 k( 99) = ( 0.0333333 0.0167520 1.1834994), wk = 0.0022936 k( 100) = ( 0.0500000 0.0251280 1.1834994), wk = 0.0022936 k( 101) = ( 0.0666667 0.0335040 1.1834994), wk = 0.0022936 k( 102) = ( 0.0833333 0.0418799 1.1834994), wk = 0.0022936 k( 103) = ( 0.1000000 0.0502559 1.1834994), wk = 0.0022936 k( 104) = ( 0.1166667 0.0586319 1.1834994), wk = 0.0022936 k( 105) = ( 0.1333333 0.0670079 1.1834994), wk = 0.0022936 k( 106) = ( 0.1500000 0.0753839 1.1834994), wk = 0.0022936 k( 107) = ( 0.1666667 0.0837599 1.1834994), wk = 0.0022936 k( 108) = ( 0.1833333 0.0921359 1.1834994), wk = 0.0022936 k( 109) = ( 0.2000000 0.1005119 1.1834994), wk = 0.0022936 k( 110) = ( 0.2166667 0.1088878 1.1834994), wk = 0.0022936 k( 111) = ( 0.2333333 0.1172638 1.1834994), wk = 0.0022936 k( 112) = ( 0.2500000 0.1256398 1.1834994), wk = 0.0022936 k( 113) = ( 0.2500000 0.1256398 1.1834994), wk = 0.0022936 k( 114) = ( 0.2430556 0.1394580 1.1726318), wk = 0.0022936 k( 115) = ( 0.2361111 0.1532761 1.1617643), wk = 0.0022936 k( 116) = ( 0.2291667 0.1670943 1.1508967), wk = 0.0022936 k( 117) = ( 0.2222222 0.1809125 1.1400292), wk = 0.0022936 k( 118) = ( 0.2152778 0.1947306 1.1291617), wk = 0.0022936 k( 119) = ( 0.2083333 0.2085488 1.1182941), wk = 0.0022936 k( 120) = ( 0.2013889 0.2223669 1.1074266), wk = 0.0022936 k( 121) = ( 0.1944444 0.2361851 1.0965590), wk = 0.0022936 k( 122) = ( 0.1875000 0.2500033 1.0856915), wk = 0.0022936 k( 123) = ( 0.1805556 0.2638214 1.0748239), wk = 0.0022936 k( 124) = ( 0.1736111 0.2776396 1.0639564), wk = 0.0022936 k( 125) = ( 0.1666667 0.2914577 1.0530888), wk = 0.0022936 k( 126) = ( 0.1597222 0.3052759 1.0422213), wk = 0.0022936 k( 127) = ( 0.1527778 0.3190941 1.0313537), wk = 0.0022936 k( 128) = ( 0.1458333 0.3329122 1.0204862), wk = 0.0022936 k( 129) = ( 0.1388889 0.3467304 1.0096186), wk = 0.0022936 k( 130) = ( 0.1319444 0.3605485 0.9987511), wk = 0.0022936 k( 131) = ( 0.1250000 0.3743667 0.9878835), wk = 0.0022936 k( 132) = ( 0.1180556 0.3881848 0.9770160), wk = 0.0022936 k( 133) = ( 0.1111111 0.4020030 0.9661484), wk = 0.0022936 k( 134) = ( 0.1041667 0.4158212 0.9552809), wk = 0.0022936 k( 135) = ( 0.0972222 0.4296393 0.9444134), wk = 0.0022936 k( 136) = ( 0.0902778 0.4434575 0.9335458), wk = 0.0022936 k( 137) = ( 0.0833333 0.4572757 0.9226783), wk = 0.0022936 k( 138) = ( 0.0763889 0.4710938 0.9118107), wk = 0.0022936 k( 139) = ( 0.0694444 0.4849120 0.9009432), wk = 0.0022936 k( 140) = ( 0.0625000 0.4987301 0.8900756), wk = 0.0022936 k( 141) = ( 0.0555556 0.5125483 0.8792081), wk = 0.0022936 k( 142) = ( 0.0486111 0.5263665 0.8683405), wk = 0.0022936 k( 143) = ( 0.0416667 0.5401846 0.8574730), wk = 0.0022936 k( 144) = ( 0.0347222 0.5540028 0.8466054), wk = 0.0022936 k( 145) = ( 0.0277778 0.5678209 0.8357379), wk = 0.0022936 k( 146) = ( 0.0208333 0.5816391 0.8248703), wk = 0.0022936 k( 147) = ( 0.0138889 0.5954572 0.8140028), wk = 0.0022936 k( 148) = ( 0.0069444 0.6092754 0.8031352), wk = 0.0022936 k( 149) = ( 0.0000000 0.6230936 0.7922677), wk = 0.0022936 k( 150) = ( 0.0000000 0.6230936 0.7922677), wk = 0.0022936 k( 151) = ( 0.0169296 0.6283502 0.7881335), wk = 0.0022936 k( 152) = ( 0.0338591 0.6336069 0.7839993), wk = 0.0022936 k( 153) = ( 0.0507886 0.6388636 0.7798651), wk = 0.0022936 k( 154) = ( 0.0677182 0.6441203 0.7757309), wk = 0.0022936 k( 155) = ( 0.0846477 0.6493769 0.7715966), wk = 0.0022936 k( 156) = ( 0.1015773 0.6546336 0.7674624), wk = 0.0022936 k( 157) = ( 0.1185068 0.6598903 0.7633282), wk = 0.0022936 k( 158) = ( 0.1354364 0.6651470 0.7591940), wk = 0.0022936 k( 159) = ( 0.1523659 0.6704036 0.7550598), wk = 0.0022936 k( 160) = ( 0.1692955 0.6756603 0.7509256), wk = 0.0022936 k( 161) = ( 0.1862251 0.6809170 0.7467914), wk = 0.0022936 k( 162) = ( 0.2031546 0.6861737 0.7426572), wk = 0.0022936 k( 163) = ( 0.2200842 0.6914304 0.7385230), wk = 0.0022936 k( 164) = ( 0.2370137 0.6966870 0.7343887), wk = 0.0022936 k( 165) = ( 0.2539433 0.7019437 0.7302545), wk = 0.0022936 k( 166) = ( 0.2708728 0.7072004 0.7261203), wk = 0.0022936 k( 167) = ( 0.2708728 0.7072004 0.7261203), wk = 0.0022936 k( 168) = ( 0.2757478 0.6975000 0.7106710), wk = 0.0022936 k( 169) = ( 0.2806229 0.6877995 0.6952216), wk = 0.0022936 k( 170) = ( 0.2854979 0.6780991 0.6797722), wk = 0.0022936 k( 171) = ( 0.2903730 0.6683986 0.6643229), wk = 0.0022936 k( 172) = ( 0.2952480 0.6586982 0.6488735), wk = 0.0022936 k( 173) = ( 0.3001231 0.6489977 0.6334241), wk = 0.0022936 k( 174) = ( 0.3049981 0.6392973 0.6179748), wk = 0.0022936 k( 175) = ( 0.3098732 0.6295969 0.6025254), wk = 0.0022936 k( 176) = ( 0.3147482 0.6198964 0.5870760), wk = 0.0022936 k( 177) = ( 0.3196233 0.6101960 0.5716267), wk = 0.0022936 k( 178) = ( 0.3244983 0.6004955 0.5561773), wk = 0.0022936 k( 179) = ( 0.3293734 0.5907951 0.5407279), wk = 0.0022936 k( 180) = ( 0.3342484 0.5810947 0.5252786), wk = 0.0022936 k( 181) = ( 0.3391234 0.5713942 0.5098292), wk = 0.0022936 k( 182) = ( 0.3439985 0.5616938 0.4943798), wk = 0.0022936 k( 183) = ( 0.3488735 0.5519933 0.4789304), wk = 0.0022936 k( 184) = ( 0.3537486 0.5422929 0.4634811), wk = 0.0022936 k( 185) = ( 0.3586236 0.5325924 0.4480317), wk = 0.0022936 k( 186) = ( 0.3634987 0.5228920 0.4325823), wk = 0.0022936 k( 187) = ( 0.3683737 0.5131916 0.4171330), wk = 0.0022936 k( 188) = ( 0.3732488 0.5034911 0.4016836), wk = 0.0022936 k( 189) = ( 0.3781238 0.4937907 0.3862342), wk = 0.0022936 k( 190) = ( 0.3829989 0.4840902 0.3707849), wk = 0.0022936 k( 191) = ( 0.3878739 0.4743898 0.3553355), wk = 0.0022936 k( 192) = ( 0.3927490 0.4646894 0.3398861), wk = 0.0022936 k( 193) = ( 0.3976240 0.4549889 0.3244368), wk = 0.0022936 k( 194) = ( 0.4024991 0.4452885 0.3089874), wk = 0.0022936 k( 195) = ( 0.4073741 0.4355880 0.2935380), wk = 0.0022936 k( 196) = ( 0.4122492 0.4258876 0.2780886), wk = 0.0022936 k( 197) = ( 0.4171242 0.4161872 0.2626393), wk = 0.0022936 k( 198) = ( 0.4219992 0.4064867 0.2471899), wk = 0.0022936 k( 199) = ( 0.4268743 0.3967863 0.2317405), wk = 0.0022936 k( 200) = ( 0.4317493 0.3870858 0.2162912), wk = 0.0022936 k( 201) = ( 0.4366244 0.3773854 0.2008418), wk = 0.0022936 k( 202) = ( 0.4414994 0.3676849 0.1853924), wk = 0.0022936 k( 203) = ( 0.4463745 0.3579845 0.1699431), wk = 0.0022936 k( 204) = ( 0.4512495 0.3482841 0.1544937), wk = 0.0022936 k( 205) = ( 0.4561246 0.3385836 0.1390443), wk = 0.0022936 k( 206) = ( 0.4609996 0.3288832 0.1235950), wk = 0.0022936 k( 207) = ( 0.4658747 0.3191827 0.1081456), wk = 0.0022936 k( 208) = ( 0.4707497 0.3094823 0.0926962), wk = 0.0022936 k( 209) = ( 0.4756248 0.2997818 0.0772468), wk = 0.0022936 k( 210) = ( 0.4804998 0.2900814 0.0617975), wk = 0.0022936 k( 211) = ( 0.4853749 0.2803810 0.0463481), wk = 0.0022936 k( 212) = ( 0.4902499 0.2706805 0.0308987), wk = 0.0022936 k( 213) = ( 0.4951250 0.2609801 0.0154494), wk = 0.0022936 k( 214) = ( 0.5000000 0.2512796 0.0000000), wk = 0.0022936 k( 215) = ( 0.5000000 0.2512796 0.0000000), wk = 0.0022936 k( 216) = ( 0.4833333 0.2429037 0.0000000), wk = 0.0022936 k( 217) = ( 0.4666667 0.2345277 0.0000000), wk = 0.0022936 k( 218) = ( 0.4500000 0.2261517 0.0000000), wk = 0.0022936 k( 219) = ( 0.4333333 0.2177757 -0.0000000), wk = 0.0022936 k( 220) = ( 0.4166667 0.2093997 -0.0000000), wk = 0.0022936 k( 221) = ( 0.4000000 0.2010237 0.0000000), wk = 0.0022936 k( 222) = ( 0.3833333 0.1926477 0.0000000), wk = 0.0022936 k( 223) = ( 0.3666667 0.1842717 0.0000000), wk = 0.0022936 k( 224) = ( 0.3500000 0.1758958 0.0000000), wk = 0.0022936 k( 225) = ( 0.3333333 0.1675198 0.0000000), wk = 0.0022936 k( 226) = ( 0.3166667 0.1591438 -0.0000000), wk = 0.0022936 k( 227) = ( 0.3000000 0.1507678 0.0000000), wk = 0.0022936 k( 228) = ( 0.2833333 0.1423918 -0.0000000), wk = 0.0022936 k( 229) = ( 0.2666667 0.1340158 0.0000000), wk = 0.0022936 k( 230) = ( 0.2500000 0.1256398 0.0000000), wk = 0.0022936 k( 231) = ( 0.2333333 0.1172638 -0.0000000), wk = 0.0022936 k( 232) = ( 0.2166667 0.1088878 0.0000000), wk = 0.0022936 k( 233) = ( 0.2000000 0.1005119 0.0000000), wk = 0.0022936 k( 234) = ( 0.1833333 0.0921359 -0.0000000), wk = 0.0022936 k( 235) = ( 0.1666667 0.0837599 0.0000000), wk = 0.0022936 k( 236) = ( 0.1500000 0.0753839 0.0000000), wk = 0.0022936 k( 237) = ( 0.1333333 0.0670079 0.0000000), wk = 0.0022936 k( 238) = ( 0.1166667 0.0586319 0.0000000), wk = 0.0022936 k( 239) = ( 0.1000000 0.0502559 0.0000000), wk = 0.0022936 k( 240) = ( 0.0833333 0.0418799 0.0000000), wk = 0.0022936 k( 241) = ( 0.0666667 0.0335040 0.0000000), wk = 0.0022936 k( 242) = ( 0.0500000 0.0251280 0.0000000), wk = 0.0022936 k( 243) = ( 0.0333333 0.0167520 -0.0000000), wk = 0.0022936 k( 244) = ( 0.0166667 0.0083760 0.0000000), wk = 0.0022936 k( 245) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022936 k( 246) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022936 k( 247) = ( 0.0069588 -0.0138467 0.0108900), wk = 0.0022936 k( 248) = ( 0.0139176 -0.0276934 0.0217800), wk = 0.0022936 k( 249) = ( 0.0208763 -0.0415400 0.0326699), wk = 0.0022936 k( 250) = ( 0.0278351 -0.0553867 0.0435599), wk = 0.0022936 k( 251) = ( 0.0347939 -0.0692334 0.0544499), wk = 0.0022936 k( 252) = ( 0.0417527 -0.0830801 0.0653399), wk = 0.0022936 k( 253) = ( 0.0487114 -0.0969268 0.0762298), wk = 0.0022936 k( 254) = ( 0.0556702 -0.1107734 0.0871198), wk = 0.0022936 k( 255) = ( 0.0626290 -0.1246201 0.0980098), wk = 0.0022936 k( 256) = ( 0.0695878 -0.1384668 0.1088998), wk = 0.0022936 k( 257) = ( 0.0765466 -0.1523135 0.1197898), wk = 0.0022936 k( 258) = ( 0.0835053 -0.1661602 0.1306797), wk = 0.0022936 k( 259) = ( 0.0904641 -0.1800068 0.1415697), wk = 0.0022936 k( 260) = ( 0.0974229 -0.1938535 0.1524597), wk = 0.0022936 k( 261) = ( 0.1043817 -0.2077002 0.1633497), wk = 0.0022936 k( 262) = ( 0.1113404 -0.2215469 0.1742396), wk = 0.0022936 k( 263) = ( 0.1182992 -0.2353936 0.1851296), wk = 0.0022936 k( 264) = ( 0.1252580 -0.2492402 0.1960196), wk = 0.0022936 k( 265) = ( 0.1322168 -0.2630869 0.2069096), wk = 0.0022936 k( 266) = ( 0.1391756 -0.2769336 0.2177995), wk = 0.0022936 k( 267) = ( 0.1461343 -0.2907803 0.2286895), wk = 0.0022936 k( 268) = ( 0.1530931 -0.3046270 0.2395795), wk = 0.0022936 k( 269) = ( 0.1600519 -0.3184736 0.2504695), wk = 0.0022936 k( 270) = ( 0.1670107 -0.3323203 0.2613595), wk = 0.0022936 k( 271) = ( 0.1739694 -0.3461670 0.2722494), wk = 0.0022936 k( 272) = ( 0.1809282 -0.3600137 0.2831394), wk = 0.0022936 k( 273) = ( 0.1878870 -0.3738604 0.2940294), wk = 0.0022936 k( 274) = ( 0.1948458 -0.3877071 0.3049194), wk = 0.0022936 k( 275) = ( 0.2018045 -0.4015537 0.3158093), wk = 0.0022936 k( 276) = ( 0.2087633 -0.4154004 0.3266993), wk = 0.0022936 k( 277) = ( 0.2157221 -0.4292471 0.3375893), wk = 0.0022936 k( 278) = ( 0.2226809 -0.4430938 0.3484793), wk = 0.0022936 k( 279) = ( 0.2296397 -0.4569405 0.3593693), wk = 0.0022936 k( 280) = ( 0.2365984 -0.4707871 0.3702592), wk = 0.0022936 k( 281) = ( 0.2435572 -0.4846338 0.3811492), wk = 0.0022936 k( 282) = ( 0.2505160 -0.4984805 0.3920392), wk = 0.0022936 k( 283) = ( 0.2574748 -0.5123272 0.4029292), wk = 0.0022936 k( 284) = ( 0.2644336 -0.5261738 0.4138191), wk = 0.0022936 k( 285) = ( 0.2713923 -0.5400205 0.4247091), wk = 0.0022936 k( 286) = ( 0.2783511 -0.5538672 0.4355991), wk = 0.0022936 k( 287) = ( 0.2853099 -0.5677139 0.4464891), wk = 0.0022936 k( 288) = ( 0.2922687 -0.5815606 0.4573791), wk = 0.0022936 k( 289) = ( 0.2922687 -0.5815606 0.4573791), wk = 0.0022936 k( 290) = ( 0.3052519 -0.5684514 0.4532448), wk = 0.0022936 k( 291) = ( 0.3182351 -0.5553422 0.4491106), wk = 0.0022936 k( 292) = ( 0.3312183 -0.5422331 0.4449764), wk = 0.0022936 k( 293) = ( 0.3442015 -0.5291239 0.4408422), wk = 0.0022936 k( 294) = ( 0.3571847 -0.5160147 0.4367080), wk = 0.0022936 k( 295) = ( 0.3701679 -0.5029056 0.4325738), wk = 0.0022936 k( 296) = ( 0.3831511 -0.4897964 0.4284396), wk = 0.0022936 k( 297) = ( 0.3961343 -0.4766872 0.4243054), wk = 0.0022936 k( 298) = ( 0.4091175 -0.4635781 0.4201712), wk = 0.0022936 k( 299) = ( 0.4221008 -0.4504689 0.4160369), wk = 0.0022936 k( 300) = ( 0.4350840 -0.4373598 0.4119027), wk = 0.0022936 k( 301) = ( 0.4480672 -0.4242506 0.4077685), wk = 0.0022936 k( 302) = ( 0.4610504 -0.4111414 0.4036343), wk = 0.0022936 k( 303) = ( 0.4740336 -0.3980322 0.3995001), wk = 0.0022936 k( 304) = ( 0.4870168 -0.3849231 0.3953659), wk = 0.0022936 k( 305) = ( 0.5000000 -0.3718139 0.3912317), wk = 0.0022936 k( 306) = ( 0.5000000 -0.3718139 0.3912317), wk = 0.0022936 k( 307) = ( 0.4950980 -0.3620599 0.4067663), wk = 0.0022936 k( 308) = ( 0.4901961 -0.3523059 0.4223010), wk = 0.0022936 k( 309) = ( 0.4852941 -0.3425519 0.4378357), wk = 0.0022936 k( 310) = ( 0.4803922 -0.3327979 0.4533703), wk = 0.0022936 k( 311) = ( 0.4754902 -0.3230440 0.4689050), wk = 0.0022936 k( 312) = ( 0.4705882 -0.3132900 0.4844396), wk = 0.0022936 k( 313) = ( 0.4656863 -0.3035359 0.4999743), wk = 0.0022936 k( 314) = ( 0.4607843 -0.2937820 0.5155090), wk = 0.0022936 k( 315) = ( 0.4558823 -0.2840280 0.5310436), wk = 0.0022936 k( 316) = ( 0.4509804 -0.2742740 0.5465783), wk = 0.0022936 k( 317) = ( 0.4460784 -0.2645200 0.5621130), wk = 0.0022936 k( 318) = ( 0.4411765 -0.2547660 0.5776476), wk = 0.0022936 k( 319) = ( 0.4362745 -0.2450120 0.5931823), wk = 0.0022936 k( 320) = ( 0.4313726 -0.2352580 0.6087169), wk = 0.0022936 k( 321) = ( 0.4264706 -0.2255040 0.6242516), wk = 0.0022936 k( 322) = ( 0.4215686 -0.2157500 0.6397862), wk = 0.0022936 k( 323) = ( 0.4166667 -0.2059960 0.6553209), wk = 0.0022936 k( 324) = ( 0.4117647 -0.1962420 0.6708556), wk = 0.0022936 k( 325) = ( 0.4068627 -0.1864880 0.6863902), wk = 0.0022936 k( 326) = ( 0.4019608 -0.1767340 0.7019249), wk = 0.0022936 k( 327) = ( 0.3970588 -0.1669800 0.7174596), wk = 0.0022936 k( 328) = ( 0.3921569 -0.1572260 0.7329942), wk = 0.0022936 k( 329) = ( 0.3872549 -0.1474720 0.7485289), wk = 0.0022936 k( 330) = ( 0.3823529 -0.1377180 0.7640635), wk = 0.0022936 k( 331) = ( 0.3774510 -0.1279640 0.7795982), wk = 0.0022936 k( 332) = ( 0.3725490 -0.1182101 0.7951329), wk = 0.0022936 k( 333) = ( 0.3676471 -0.1084561 0.8106675), wk = 0.0022936 k( 334) = ( 0.3627451 -0.0987021 0.8262022), wk = 0.0022936 k( 335) = ( 0.3578431 -0.0889481 0.8417368), wk = 0.0022936 k( 336) = ( 0.3529412 -0.0791941 0.8572715), wk = 0.0022936 k( 337) = ( 0.3480392 -0.0694401 0.8728062), wk = 0.0022936 k( 338) = ( 0.3431373 -0.0596861 0.8883408), wk = 0.0022936 k( 339) = ( 0.3382353 -0.0499321 0.9038755), wk = 0.0022936 k( 340) = ( 0.3333333 -0.0401781 0.9194102), wk = 0.0022936 k( 341) = ( 0.3284314 -0.0304241 0.9349448), wk = 0.0022936 k( 342) = ( 0.3235294 -0.0206701 0.9504795), wk = 0.0022936 k( 343) = ( 0.3186274 -0.0109161 0.9660141), wk = 0.0022936 k( 344) = ( 0.3137255 -0.0011621 0.9815488), wk = 0.0022936 k( 345) = ( 0.3088235 0.0085919 0.9970835), wk = 0.0022936 k( 346) = ( 0.3039216 0.0183459 1.0126181), wk = 0.0022936 k( 347) = ( 0.2990196 0.0280999 1.0281528), wk = 0.0022936 k( 348) = ( 0.2941177 0.0378539 1.0436874), wk = 0.0022936 k( 349) = ( 0.2892157 0.0476079 1.0592221), wk = 0.0022936 k( 350) = ( 0.2843137 0.0573618 1.0747567), wk = 0.0022936 k( 351) = ( 0.2794118 0.0671159 1.0902914), wk = 0.0022936 k( 352) = ( 0.2745098 0.0768699 1.1058261), wk = 0.0022936 k( 353) = ( 0.2696078 0.0866238 1.1213608), wk = 0.0022936 k( 354) = ( 0.2647059 0.0963778 1.1368954), wk = 0.0022936 k( 355) = ( 0.2598039 0.1061318 1.1524301), wk = 0.0022936 k( 356) = ( 0.2549020 0.1158858 1.1679647), wk = 0.0022936 k( 357) = ( 0.2500000 0.1256398 1.1834994), wk = 0.0022936 k( 358) = ( 0.0631415 -0.1256398 1.1834994), wk = 0.0022936 k( 359) = ( 0.0680165 -0.1353403 1.1680500), wk = 0.0022936 k( 360) = ( 0.0728915 -0.1450407 1.1526007), wk = 0.0022936 k( 361) = ( 0.0777666 -0.1547411 1.1371513), wk = 0.0022936 k( 362) = ( 0.0826416 -0.1644416 1.1217019), wk = 0.0022936 k( 363) = ( 0.0875167 -0.1741420 1.1062526), wk = 0.0022936 k( 364) = ( 0.0923917 -0.1838425 1.0908032), wk = 0.0022936 k( 365) = ( 0.0972668 -0.1935429 1.0753538), wk = 0.0022936 k( 366) = ( 0.1021418 -0.2032434 1.0599044), wk = 0.0022936 k( 367) = ( 0.1070169 -0.2129438 1.0444551), wk = 0.0022936 k( 368) = ( 0.1118919 -0.2226442 1.0290057), wk = 0.0022936 k( 369) = ( 0.1167670 -0.2323447 1.0135563), wk = 0.0022936 k( 370) = ( 0.1216420 -0.2420451 0.9981070), wk = 0.0022936 k( 371) = ( 0.1265171 -0.2517456 0.9826576), wk = 0.0022936 k( 372) = ( 0.1313921 -0.2614460 0.9672082), wk = 0.0022936 k( 373) = ( 0.1362672 -0.2711464 0.9517589), wk = 0.0022936 k( 374) = ( 0.1411422 -0.2808469 0.9363095), wk = 0.0022936 k( 375) = ( 0.1460173 -0.2905473 0.9208601), wk = 0.0022936 k( 376) = ( 0.1508923 -0.3002478 0.9054108), wk = 0.0022936 k( 377) = ( 0.1557673 -0.3099482 0.8899614), wk = 0.0022936 k( 378) = ( 0.1606424 -0.3196487 0.8745120), wk = 0.0022936 k( 379) = ( 0.1655175 -0.3293491 0.8590626), wk = 0.0022936 k( 380) = ( 0.1703925 -0.3390495 0.8436133), wk = 0.0022936 k( 381) = ( 0.1752675 -0.3487500 0.8281639), wk = 0.0022936 k( 382) = ( 0.1801426 -0.3584504 0.8127145), wk = 0.0022936 k( 383) = ( 0.1850176 -0.3681509 0.7972652), wk = 0.0022936 k( 384) = ( 0.1898927 -0.3778513 0.7818158), wk = 0.0022936 k( 385) = ( 0.1947677 -0.3875517 0.7663664), wk = 0.0022936 k( 386) = ( 0.1996428 -0.3972522 0.7509171), wk = 0.0022936 k( 387) = ( 0.2045178 -0.4069526 0.7354677), wk = 0.0022936 k( 388) = ( 0.2093929 -0.4166531 0.7200183), wk = 0.0022936 k( 389) = ( 0.2142679 -0.4263535 0.7045690), wk = 0.0022936 k( 390) = ( 0.2191430 -0.4360539 0.6891196), wk = 0.0022936 k( 391) = ( 0.2240180 -0.4457544 0.6736702), wk = 0.0022936 k( 392) = ( 0.2288931 -0.4554548 0.6582209), wk = 0.0022936 k( 393) = ( 0.2337681 -0.4651553 0.6427715), wk = 0.0022936 k( 394) = ( 0.2386431 -0.4748557 0.6273221), wk = 0.0022936 k( 395) = ( 0.2435182 -0.4845562 0.6118727), wk = 0.0022936 k( 396) = ( 0.2483932 -0.4942566 0.5964234), wk = 0.0022936 k( 397) = ( 0.2532683 -0.5039570 0.5809740), wk = 0.0022936 k( 398) = ( 0.2581433 -0.5136575 0.5655246), wk = 0.0022936 k( 399) = ( 0.2630184 -0.5233579 0.5500753), wk = 0.0022936 k( 400) = ( 0.2678934 -0.5330584 0.5346259), wk = 0.0022936 k( 401) = ( 0.2727685 -0.5427588 0.5191765), wk = 0.0022936 k( 402) = ( 0.2776435 -0.5524592 0.5037272), wk = 0.0022936 k( 403) = ( 0.2825186 -0.5621597 0.4882778), wk = 0.0022936 k( 404) = ( 0.2873936 -0.5718601 0.4728284), wk = 0.0022936 k( 405) = ( 0.2922687 -0.5815606 0.4573791), wk = 0.0022936 k( 406) = ( 0.7077313 -0.1620673 0.3250843), wk = 0.0022936 k( 407) = ( 0.7008070 -0.1482891 0.3142482), wk = 0.0022936 k( 408) = ( 0.6938826 -0.1345108 0.3034120), wk = 0.0022936 k( 409) = ( 0.6869582 -0.1207326 0.2925759), wk = 0.0022936 k( 410) = ( 0.6800338 -0.1069543 0.2817397), wk = 0.0022936 k( 411) = ( 0.6731094 -0.0931761 0.2709036), wk = 0.0022936 k( 412) = ( 0.6661851 -0.0793979 0.2600675), wk = 0.0022936 k( 413) = ( 0.6592607 -0.0656197 0.2492313), wk = 0.0022936 k( 414) = ( 0.6523363 -0.0518414 0.2383952), wk = 0.0022936 k( 415) = ( 0.6454119 -0.0380632 0.2275590), wk = 0.0022936 k( 416) = ( 0.6384876 -0.0242850 0.2167229), wk = 0.0022936 k( 417) = ( 0.6315632 -0.0105067 0.2058867), wk = 0.0022936 k( 418) = ( 0.6246388 0.0032715 0.1950506), wk = 0.0022936 k( 419) = ( 0.6177144 0.0170497 0.1842144), wk = 0.0022936 k( 420) = ( 0.6107900 0.0308279 0.1733783), wk = 0.0022936 k( 421) = ( 0.6038657 0.0446062 0.1625422), wk = 0.0022936 k( 422) = ( 0.5969413 0.0583844 0.1517060), wk = 0.0022936 k( 423) = ( 0.5900169 0.0721626 0.1408699), wk = 0.0022936 k( 424) = ( 0.5830925 0.0859409 0.1300337), wk = 0.0022936 k( 425) = ( 0.5761682 0.0997191 0.1191976), wk = 0.0022936 k( 426) = ( 0.5692438 0.1134973 0.1083614), wk = 0.0022936 k( 427) = ( 0.5623194 0.1272756 0.0975253), wk = 0.0022936 k( 428) = ( 0.5553950 0.1410538 0.0866891), wk = 0.0022936 k( 429) = ( 0.5484706 0.1548320 0.0758530), wk = 0.0022936 k( 430) = ( 0.5415463 0.1686103 0.0650169), wk = 0.0022936 k( 431) = ( 0.5346219 0.1823885 0.0541807), wk = 0.0022936 k( 432) = ( 0.5276975 0.1961667 0.0433446), wk = 0.0022936 k( 433) = ( 0.5207731 0.2099450 0.0325084), wk = 0.0022936 k( 434) = ( 0.5138488 0.2237232 0.0216723), wk = 0.0022936 k( 435) = ( 0.5069244 0.2375014 0.0108361), wk = 0.0022936 k( 436) = ( 0.5000000 0.2512796 0.0000000), wk = 0.0022936 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022936 k( 2) = ( -0.0049250 0.0049250 0.0049250), wk = 0.0022936 k( 3) = ( -0.0098499 0.0098499 0.0098499), wk = 0.0022936 k( 4) = ( -0.0147749 0.0147749 0.0147749), wk = 0.0022936 k( 5) = ( -0.0196998 0.0196998 0.0196998), wk = 0.0022936 k( 6) = ( -0.0246248 0.0246248 0.0246248), wk = 0.0022936 k( 7) = ( -0.0295498 0.0295498 0.0295498), wk = 0.0022936 k( 8) = ( -0.0344747 0.0344747 0.0344747), wk = 0.0022936 k( 9) = ( -0.0393997 0.0393997 0.0393997), wk = 0.0022936 k( 10) = ( -0.0443246 0.0443246 0.0443246), wk = 0.0022936 k( 11) = ( -0.0492496 0.0492496 0.0492496), wk = 0.0022936 k( 12) = ( -0.0541746 0.0541746 0.0541746), wk = 0.0022936 k( 13) = ( -0.0590995 0.0590995 0.0590995), wk = 0.0022936 k( 14) = ( -0.0640245 0.0640245 0.0640245), wk = 0.0022936 k( 15) = ( -0.0689494 0.0689494 0.0689494), wk = 0.0022936 k( 16) = ( -0.0738744 0.0738744 0.0738744), wk = 0.0022936 k( 17) = ( -0.0787994 0.0787994 0.0787994), wk = 0.0022936 k( 18) = ( -0.0837243 0.0837243 0.0837243), wk = 0.0022936 k( 19) = ( -0.0886493 0.0886493 0.0886493), wk = 0.0022936 k( 20) = ( -0.0935742 0.0935742 0.0935742), wk = 0.0022936 k( 21) = ( -0.0984992 0.0984992 0.0984992), wk = 0.0022936 k( 22) = ( -0.1034242 0.1034242 0.1034242), wk = 0.0022936 k( 23) = ( -0.1083491 0.1083491 0.1083491), wk = 0.0022936 k( 24) = ( -0.1132741 0.1132741 0.1132741), wk = 0.0022936 k( 25) = ( -0.1181990 0.1181990 0.1181990), wk = 0.0022936 k( 26) = ( -0.1231240 0.1231240 0.1231240), wk = 0.0022936 k( 27) = ( -0.1280490 0.1280490 0.1280490), wk = 0.0022936 k( 28) = ( -0.1329739 0.1329739 0.1329739), wk = 0.0022936 k( 29) = ( -0.1378989 0.1378989 0.1378989), wk = 0.0022936 k( 30) = ( -0.1428238 0.1428238 0.1428238), wk = 0.0022936 k( 31) = ( -0.1477488 0.1477488 0.1477488), wk = 0.0022936 k( 32) = ( -0.1526738 0.1526738 0.1526738), wk = 0.0022936 k( 33) = ( -0.1575987 0.1575987 0.1575987), wk = 0.0022936 k( 34) = ( -0.1625237 0.1625237 0.1625237), wk = 0.0022936 k( 35) = ( -0.1674486 0.1674486 0.1674486), wk = 0.0022936 k( 36) = ( -0.1723736 0.1723736 0.1723736), wk = 0.0022936 k( 37) = ( -0.1772986 0.1772986 0.1772986), wk = 0.0022936 k( 38) = ( -0.1822235 0.1822235 0.1822235), wk = 0.0022936 k( 39) = ( -0.1871485 0.1871485 0.1871485), wk = 0.0022936 k( 40) = ( -0.1920734 0.1920734 0.1920734), wk = 0.0022936 k( 41) = ( -0.1969984 0.1969984 0.1969984), wk = 0.0022936 k( 42) = ( -0.2019234 0.2019234 0.2019234), wk = 0.0022936 k( 43) = ( -0.2068483 0.2068483 0.2068483), wk = 0.0022936 k( 44) = ( -0.2117733 0.2117733 0.2117733), wk = 0.0022936 k( 45) = ( -0.2166982 0.2166982 0.2166982), wk = 0.0022936 k( 46) = ( -0.2216232 0.2216232 0.2216232), wk = 0.0022936 k( 47) = ( -0.2265482 0.2265482 0.2265482), wk = 0.0022936 k( 48) = ( -0.2314731 0.2314731 0.2314731), wk = 0.0022936 k( 49) = ( -0.2363981 0.2363981 0.2363981), wk = 0.0022936 k( 50) = ( -0.2413230 0.2413230 0.2413230), wk = 0.0022936 k( 51) = ( -0.2462480 0.2462480 0.2462480), wk = 0.0022936 k( 52) = ( -0.2511730 0.2511730 0.2511730), wk = 0.0022936 k( 53) = ( -0.2560979 0.2560979 0.2560979), wk = 0.0022936 k( 54) = ( -0.2610229 0.2610229 0.2610229), wk = 0.0022936 k( 55) = ( -0.2659478 0.2659478 0.2659478), wk = 0.0022936 k( 56) = ( -0.2708728 0.2708728 0.2708728), wk = 0.0022936 k( 57) = ( -0.2708728 0.2708728 0.2708728), wk = 0.0022936 k( 58) = ( -0.2639484 0.2639484 0.2777972), wk = 0.0022936 k( 59) = ( -0.2570240 0.2570240 0.2847216), wk = 0.0022936 k( 60) = ( -0.2500997 0.2500997 0.2916459), wk = 0.0022936 k( 61) = ( -0.2431753 0.2431753 0.2985703), wk = 0.0022936 k( 62) = ( -0.2362509 0.2362509 0.3054947), wk = 0.0022936 k( 63) = ( -0.2293265 0.2293265 0.3124191), wk = 0.0022936 k( 64) = ( -0.2224021 0.2224022 0.3193434), wk = 0.0022936 k( 65) = ( -0.2154778 0.2154778 0.3262678), wk = 0.0022936 k( 66) = ( -0.2085534 0.2085534 0.3331922), wk = 0.0022936 k( 67) = ( -0.2016290 0.2016290 0.3401166), wk = 0.0022936 k( 68) = ( -0.1947046 0.1947046 0.3470410), wk = 0.0022936 k( 69) = ( -0.1877803 0.1877803 0.3539653), wk = 0.0022936 k( 70) = ( -0.1808559 0.1808559 0.3608897), wk = 0.0022936 k( 71) = ( -0.1739315 0.1739315 0.3678141), wk = 0.0022936 k( 72) = ( -0.1670071 0.1670071 0.3747385), wk = 0.0022936 k( 73) = ( -0.1600827 0.1600827 0.3816628), wk = 0.0022936 k( 74) = ( -0.1531584 0.1531584 0.3885872), wk = 0.0022936 k( 75) = ( -0.1462340 0.1462340 0.3955116), wk = 0.0022936 k( 76) = ( -0.1393096 0.1393096 0.4024360), wk = 0.0022936 k( 77) = ( -0.1323852 0.1323852 0.4093604), wk = 0.0022936 k( 78) = ( -0.1254609 0.1254609 0.4162847), wk = 0.0022936 k( 79) = ( -0.1185365 0.1185365 0.4232091), wk = 0.0022936 k( 80) = ( -0.1116121 0.1116121 0.4301335), wk = 0.0022936 k( 81) = ( -0.1046877 0.1046877 0.4370579), wk = 0.0022936 k( 82) = ( -0.0977633 0.0977633 0.4439822), wk = 0.0022936 k( 83) = ( -0.0908390 0.0908390 0.4509066), wk = 0.0022936 k( 84) = ( -0.0839146 0.0839146 0.4578310), wk = 0.0022936 k( 85) = ( -0.0769902 0.0769902 0.4647554), wk = 0.0022936 k( 86) = ( -0.0700658 0.0700658 0.4716798), wk = 0.0022936 k( 87) = ( -0.0631415 0.0631415 0.4786041), wk = 0.0022936 k( 88) = ( -0.0631415 0.0631415 0.4786041), wk = 0.0022936 k( 89) = ( -0.0552488 0.0552488 0.4812786), wk = 0.0022936 k( 90) = ( -0.0473561 0.0473561 0.4839531), wk = 0.0022936 k( 91) = ( -0.0394634 0.0394634 0.4866276), wk = 0.0022936 k( 92) = ( -0.0315707 0.0315707 0.4893021), wk = 0.0022936 k( 93) = ( -0.0236780 0.0236780 0.4919766), wk = 0.0022936 k( 94) = ( -0.0157854 0.0157854 0.4946510), wk = 0.0022936 k( 95) = ( -0.0078927 0.0078927 0.4973255), wk = 0.0022936 k( 96) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022936 k( 97) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022936 k( 98) = ( 0.0166667 0.0166667 0.4833333), wk = 0.0022936 k( 99) = ( 0.0333333 0.0333333 0.4666667), wk = 0.0022936 k( 100) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0022936 k( 101) = ( 0.0666667 0.0666667 0.4333333), wk = 0.0022936 k( 102) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0022936 k( 103) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0022936 k( 104) = ( 0.1166667 0.1166667 0.3833333), wk = 0.0022936 k( 105) = ( 0.1333333 0.1333333 0.3666667), wk = 0.0022936 k( 106) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0022936 k( 107) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0022936 k( 108) = ( 0.1833333 0.1833333 0.3166667), wk = 0.0022936 k( 109) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0022936 k( 110) = ( 0.2166667 0.2166667 0.2833333), wk = 0.0022936 k( 111) = ( 0.2333333 0.2333333 0.2666667), wk = 0.0022936 k( 112) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0022936 k( 113) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0022936 k( 114) = ( 0.2430556 0.2569444 0.2430556), wk = 0.0022936 k( 115) = ( 0.2361111 0.2638889 0.2361111), wk = 0.0022936 k( 116) = ( 0.2291667 0.2708333 0.2291667), wk = 0.0022936 k( 117) = ( 0.2222222 0.2777778 0.2222222), wk = 0.0022936 k( 118) = ( 0.2152778 0.2847222 0.2152778), wk = 0.0022936 k( 119) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0022936 k( 120) = ( 0.2013889 0.2986111 0.2013889), wk = 0.0022936 k( 121) = ( 0.1944444 0.3055556 0.1944444), wk = 0.0022936 k( 122) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0022936 k( 123) = ( 0.1805556 0.3194444 0.1805556), wk = 0.0022936 k( 124) = ( 0.1736111 0.3263889 0.1736111), wk = 0.0022936 k( 125) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0022936 k( 126) = ( 0.1597222 0.3402778 0.1597222), wk = 0.0022936 k( 127) = ( 0.1527778 0.3472222 0.1527778), wk = 0.0022936 k( 128) = ( 0.1458333 0.3541667 0.1458333), wk = 0.0022936 k( 129) = ( 0.1388889 0.3611111 0.1388889), wk = 0.0022936 k( 130) = ( 0.1319444 0.3680556 0.1319444), wk = 0.0022936 k( 131) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0022936 k( 132) = ( 0.1180556 0.3819444 0.1180556), wk = 0.0022936 k( 133) = ( 0.1111111 0.3888889 0.1111111), wk = 0.0022936 k( 134) = ( 0.1041667 0.3958333 0.1041667), wk = 0.0022936 k( 135) = ( 0.0972222 0.4027778 0.0972222), wk = 0.0022936 k( 136) = ( 0.0902778 0.4097222 0.0902778), wk = 0.0022936 k( 137) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0022936 k( 138) = ( 0.0763889 0.4236111 0.0763889), wk = 0.0022936 k( 139) = ( 0.0694444 0.4305556 0.0694444), wk = 0.0022936 k( 140) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0022936 k( 141) = ( 0.0555556 0.4444444 0.0555556), wk = 0.0022936 k( 142) = ( 0.0486111 0.4513889 0.0486111), wk = 0.0022936 k( 143) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0022936 k( 144) = ( 0.0347222 0.4652778 0.0347222), wk = 0.0022936 k( 145) = ( 0.0277778 0.4722222 0.0277778), wk = 0.0022936 k( 146) = ( 0.0208333 0.4791667 0.0208333), wk = 0.0022936 k( 147) = ( 0.0138889 0.4861111 0.0138889), wk = 0.0022936 k( 148) = ( 0.0069444 0.4930556 0.0069444), wk = 0.0022936 k( 149) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022936 k( 150) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022936 k( 151) = ( 0.0169296 0.5143205 -0.0169296), wk = 0.0022936 k( 152) = ( 0.0338591 0.5286409 -0.0338591), wk = 0.0022936 k( 153) = ( 0.0507886 0.5429614 -0.0507887), wk = 0.0022936 k( 154) = ( 0.0677182 0.5572818 -0.0677182), wk = 0.0022936 k( 155) = ( 0.0846477 0.5716022 -0.0846477), wk = 0.0022936 k( 156) = ( 0.1015773 0.5859227 -0.1015773), wk = 0.0022936 k( 157) = ( 0.1185068 0.6002432 -0.1185069), wk = 0.0022936 k( 158) = ( 0.1354364 0.6145636 -0.1354364), wk = 0.0022936 k( 159) = ( 0.1523659 0.6288841 -0.1523660), wk = 0.0022936 k( 160) = ( 0.1692955 0.6432045 -0.1692955), wk = 0.0022936 k( 161) = ( 0.1862251 0.6575249 -0.1862251), wk = 0.0022936 k( 162) = ( 0.2031546 0.6718454 -0.2031546), wk = 0.0022936 k( 163) = ( 0.2200842 0.6861658 -0.2200841), wk = 0.0022936 k( 164) = ( 0.2370137 0.7004863 -0.2370137), wk = 0.0022936 k( 165) = ( 0.2539433 0.7148068 -0.2539433), wk = 0.0022936 k( 166) = ( 0.2708728 0.7291272 -0.2708728), wk = 0.0022936 k( 167) = ( 0.2708728 0.7291272 -0.2708728), wk = 0.0022936 k( 168) = ( 0.2757478 0.7242522 -0.2757478), wk = 0.0022936 k( 169) = ( 0.2806229 0.7193771 -0.2806229), wk = 0.0022936 k( 170) = ( 0.2854979 0.7145021 -0.2854979), wk = 0.0022936 k( 171) = ( 0.2903730 0.7096270 -0.2903730), wk = 0.0022936 k( 172) = ( 0.2952480 0.7047520 -0.2952480), wk = 0.0022936 k( 173) = ( 0.3001231 0.6998769 -0.3001231), wk = 0.0022936 k( 174) = ( 0.3049981 0.6950019 -0.3049981), wk = 0.0022936 k( 175) = ( 0.3098732 0.6901268 -0.3098732), wk = 0.0022936 k( 176) = ( 0.3147482 0.6852518 -0.3147482), wk = 0.0022936 k( 177) = ( 0.3196233 0.6803767 -0.3196233), wk = 0.0022936 k( 178) = ( 0.3244983 0.6755017 -0.3244983), wk = 0.0022936 k( 179) = ( 0.3293734 0.6706266 -0.3293734), wk = 0.0022936 k( 180) = ( 0.3342484 0.6657516 -0.3342484), wk = 0.0022936 k( 181) = ( 0.3391234 0.6608765 -0.3391234), wk = 0.0022936 k( 182) = ( 0.3439985 0.6560015 -0.3439985), wk = 0.0022936 k( 183) = ( 0.3488735 0.6511265 -0.3488736), wk = 0.0022936 k( 184) = ( 0.3537486 0.6462514 -0.3537486), wk = 0.0022936 k( 185) = ( 0.3586236 0.6413764 -0.3586236), wk = 0.0022936 k( 186) = ( 0.3634987 0.6365013 -0.3634987), wk = 0.0022936 k( 187) = ( 0.3683737 0.6316263 -0.3683737), wk = 0.0022936 k( 188) = ( 0.3732488 0.6267512 -0.3732488), wk = 0.0022936 k( 189) = ( 0.3781238 0.6218762 -0.3781238), wk = 0.0022936 k( 190) = ( 0.3829989 0.6170011 -0.3829989), wk = 0.0022936 k( 191) = ( 0.3878739 0.6121261 -0.3878739), wk = 0.0022936 k( 192) = ( 0.3927490 0.6072510 -0.3927490), wk = 0.0022936 k( 193) = ( 0.3976240 0.6023760 -0.3976240), wk = 0.0022936 k( 194) = ( 0.4024991 0.5975009 -0.4024991), wk = 0.0022936 k( 195) = ( 0.4073741 0.5926259 -0.4073741), wk = 0.0022936 k( 196) = ( 0.4122492 0.5877508 -0.4122492), wk = 0.0022936 k( 197) = ( 0.4171242 0.5828758 -0.4171242), wk = 0.0022936 k( 198) = ( 0.4219992 0.5780007 -0.4219992), wk = 0.0022936 k( 199) = ( 0.4268743 0.5731257 -0.4268743), wk = 0.0022936 k( 200) = ( 0.4317493 0.5682507 -0.4317493), wk = 0.0022936 k( 201) = ( 0.4366244 0.5633756 -0.4366244), wk = 0.0022936 k( 202) = ( 0.4414994 0.5585006 -0.4414994), wk = 0.0022936 k( 203) = ( 0.4463745 0.5536255 -0.4463745), wk = 0.0022936 k( 204) = ( 0.4512495 0.5487505 -0.4512495), wk = 0.0022936 k( 205) = ( 0.4561246 0.5438754 -0.4561246), wk = 0.0022936 k( 206) = ( 0.4609996 0.5390004 -0.4609996), wk = 0.0022936 k( 207) = ( 0.4658747 0.5341253 -0.4658747), wk = 0.0022936 k( 208) = ( 0.4707497 0.5292503 -0.4707497), wk = 0.0022936 k( 209) = ( 0.4756248 0.5243752 -0.4756248), wk = 0.0022936 k( 210) = ( 0.4804998 0.5195002 -0.4804998), wk = 0.0022936 k( 211) = ( 0.4853749 0.5146251 -0.4853749), wk = 0.0022936 k( 212) = ( 0.4902499 0.5097501 -0.4902499), wk = 0.0022936 k( 213) = ( 0.4951250 0.5048750 -0.4951250), wk = 0.0022936 k( 214) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0022936 k( 215) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0022936 k( 216) = ( 0.4833333 0.4833333 -0.4833333), wk = 0.0022936 k( 217) = ( 0.4666667 0.4666667 -0.4666667), wk = 0.0022936 k( 218) = ( 0.4500000 0.4500000 -0.4500000), wk = 0.0022936 k( 219) = ( 0.4333333 0.4333333 -0.4333333), wk = 0.0022936 k( 220) = ( 0.4166667 0.4166667 -0.4166667), wk = 0.0022936 k( 221) = ( 0.4000000 0.4000000 -0.4000000), wk = 0.0022936 k( 222) = ( 0.3833333 0.3833333 -0.3833333), wk = 0.0022936 k( 223) = ( 0.3666667 0.3666667 -0.3666667), wk = 0.0022936 k( 224) = ( 0.3500000 0.3500000 -0.3500000), wk = 0.0022936 k( 225) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0022936 k( 226) = ( 0.3166667 0.3166667 -0.3166667), wk = 0.0022936 k( 227) = ( 0.3000000 0.3000000 -0.3000000), wk = 0.0022936 k( 228) = ( 0.2833333 0.2833333 -0.2833333), wk = 0.0022936 k( 229) = ( 0.2666667 0.2666667 -0.2666667), wk = 0.0022936 k( 230) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0022936 k( 231) = ( 0.2333333 0.2333333 -0.2333333), wk = 0.0022936 k( 232) = ( 0.2166667 0.2166667 -0.2166667), wk = 0.0022936 k( 233) = ( 0.2000000 0.2000000 -0.2000000), wk = 0.0022936 k( 234) = ( 0.1833333 0.1833333 -0.1833333), wk = 0.0022936 k( 235) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0022936 k( 236) = ( 0.1500000 0.1500000 -0.1500000), wk = 0.0022936 k( 237) = ( 0.1333333 0.1333333 -0.1333333), wk = 0.0022936 k( 238) = ( 0.1166667 0.1166667 -0.1166667), wk = 0.0022936 k( 239) = ( 0.1000000 0.1000000 -0.1000000), wk = 0.0022936 k( 240) = ( 0.0833333 0.0833333 -0.0833333), wk = 0.0022936 k( 241) = ( 0.0666667 0.0666667 -0.0666667), wk = 0.0022936 k( 242) = ( 0.0500000 0.0500000 -0.0500000), wk = 0.0022936 k( 243) = ( 0.0333333 0.0333333 -0.0333333), wk = 0.0022936 k( 244) = ( 0.0166667 0.0166667 -0.0166667), wk = 0.0022936 k( 245) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022936 k( 246) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022936 k( 247) = ( 0.0069588 -0.0069588 0.0069588), wk = 0.0022936 k( 248) = ( 0.0139176 -0.0139176 0.0139176), wk = 0.0022936 k( 249) = ( 0.0208763 -0.0208763 0.0208763), wk = 0.0022936 k( 250) = ( 0.0278351 -0.0278351 0.0278351), wk = 0.0022936 k( 251) = ( 0.0347939 -0.0347939 0.0347939), wk = 0.0022936 k( 252) = ( 0.0417527 -0.0417527 0.0417527), wk = 0.0022936 k( 253) = ( 0.0487114 -0.0487114 0.0487114), wk = 0.0022936 k( 254) = ( 0.0556702 -0.0556702 0.0556702), wk = 0.0022936 k( 255) = ( 0.0626290 -0.0626290 0.0626290), wk = 0.0022936 k( 256) = ( 0.0695878 -0.0695878 0.0695878), wk = 0.0022936 k( 257) = ( 0.0765466 -0.0765466 0.0765466), wk = 0.0022936 k( 258) = ( 0.0835053 -0.0835053 0.0835053), wk = 0.0022936 k( 259) = ( 0.0904641 -0.0904641 0.0904641), wk = 0.0022936 k( 260) = ( 0.0974229 -0.0974229 0.0974229), wk = 0.0022936 k( 261) = ( 0.1043817 -0.1043817 0.1043817), wk = 0.0022936 k( 262) = ( 0.1113404 -0.1113404 0.1113404), wk = 0.0022936 k( 263) = ( 0.1182992 -0.1182992 0.1182992), wk = 0.0022936 k( 264) = ( 0.1252580 -0.1252580 0.1252580), wk = 0.0022936 k( 265) = ( 0.1322168 -0.1322168 0.1322168), wk = 0.0022936 k( 266) = ( 0.1391756 -0.1391755 0.1391756), wk = 0.0022936 k( 267) = ( 0.1461343 -0.1461343 0.1461343), wk = 0.0022936 k( 268) = ( 0.1530931 -0.1530931 0.1530931), wk = 0.0022936 k( 269) = ( 0.1600519 -0.1600519 0.1600519), wk = 0.0022936 k( 270) = ( 0.1670107 -0.1670107 0.1670107), wk = 0.0022936 k( 271) = ( 0.1739694 -0.1739694 0.1739694), wk = 0.0022936 k( 272) = ( 0.1809282 -0.1809282 0.1809282), wk = 0.0022936 k( 273) = ( 0.1878870 -0.1878870 0.1878870), wk = 0.0022936 k( 274) = ( 0.1948458 -0.1948458 0.1948458), wk = 0.0022936 k( 275) = ( 0.2018045 -0.2018046 0.2018045), wk = 0.0022936 k( 276) = ( 0.2087633 -0.2087633 0.2087633), wk = 0.0022936 k( 277) = ( 0.2157221 -0.2157221 0.2157221), wk = 0.0022936 k( 278) = ( 0.2226809 -0.2226809 0.2226809), wk = 0.0022936 k( 279) = ( 0.2296397 -0.2296397 0.2296397), wk = 0.0022936 k( 280) = ( 0.2365984 -0.2365984 0.2365984), wk = 0.0022936 k( 281) = ( 0.2435572 -0.2435572 0.2435572), wk = 0.0022936 k( 282) = ( 0.2505160 -0.2505160 0.2505160), wk = 0.0022936 k( 283) = ( 0.2574748 -0.2574748 0.2574748), wk = 0.0022936 k( 284) = ( 0.2644336 -0.2644336 0.2644336), wk = 0.0022936 k( 285) = ( 0.2713923 -0.2713923 0.2713923), wk = 0.0022936 k( 286) = ( 0.2783511 -0.2783511 0.2783511), wk = 0.0022936 k( 287) = ( 0.2853099 -0.2853099 0.2853099), wk = 0.0022936 k( 288) = ( 0.2922687 -0.2922687 0.2922687), wk = 0.0022936 k( 289) = ( 0.2922687 -0.2922687 0.2922687), wk = 0.0022936 k( 290) = ( 0.3052519 -0.2740019 0.2740019), wk = 0.0022936 k( 291) = ( 0.3182351 -0.2557351 0.2557351), wk = 0.0022936 k( 292) = ( 0.3312183 -0.2374683 0.2374683), wk = 0.0022936 k( 293) = ( 0.3442015 -0.2192015 0.2192015), wk = 0.0022936 k( 294) = ( 0.3571847 -0.2009347 0.2009347), wk = 0.0022936 k( 295) = ( 0.3701679 -0.1826679 0.1826679), wk = 0.0022936 k( 296) = ( 0.3831511 -0.1644011 0.1644011), wk = 0.0022936 k( 297) = ( 0.3961343 -0.1461343 0.1461343), wk = 0.0022936 k( 298) = ( 0.4091175 -0.1278675 0.1278675), wk = 0.0022936 k( 299) = ( 0.4221008 -0.1096007 0.1096007), wk = 0.0022936 k( 300) = ( 0.4350840 -0.0913340 0.0913340), wk = 0.0022936 k( 301) = ( 0.4480672 -0.0730672 0.0730672), wk = 0.0022936 k( 302) = ( 0.4610504 -0.0548004 0.0548004), wk = 0.0022936 k( 303) = ( 0.4740336 -0.0365336 0.0365336), wk = 0.0022936 k( 304) = ( 0.4870168 -0.0182668 0.0182668), wk = 0.0022936 k( 305) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0022936 k( 306) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0022936 k( 307) = ( 0.4950980 0.0049020 0.0049020), wk = 0.0022936 k( 308) = ( 0.4901961 0.0098039 0.0098039), wk = 0.0022936 k( 309) = ( 0.4852941 0.0147059 0.0147059), wk = 0.0022936 k( 310) = ( 0.4803922 0.0196078 0.0196078), wk = 0.0022936 k( 311) = ( 0.4754902 0.0245098 0.0245098), wk = 0.0022936 k( 312) = ( 0.4705882 0.0294118 0.0294118), wk = 0.0022936 k( 313) = ( 0.4656863 0.0343137 0.0343137), wk = 0.0022936 k( 314) = ( 0.4607843 0.0392157 0.0392157), wk = 0.0022936 k( 315) = ( 0.4558823 0.0441177 0.0441176), wk = 0.0022936 k( 316) = ( 0.4509804 0.0490196 0.0490196), wk = 0.0022936 k( 317) = ( 0.4460784 0.0539216 0.0539216), wk = 0.0022936 k( 318) = ( 0.4411765 0.0588235 0.0588235), wk = 0.0022936 k( 319) = ( 0.4362745 0.0637255 0.0637255), wk = 0.0022936 k( 320) = ( 0.4313726 0.0686275 0.0686274), wk = 0.0022936 k( 321) = ( 0.4264706 0.0735294 0.0735294), wk = 0.0022936 k( 322) = ( 0.4215686 0.0784314 0.0784314), wk = 0.0022936 k( 323) = ( 0.4166667 0.0833333 0.0833333), wk = 0.0022936 k( 324) = ( 0.4117647 0.0882353 0.0882353), wk = 0.0022936 k( 325) = ( 0.4068627 0.0931373 0.0931373), wk = 0.0022936 k( 326) = ( 0.4019608 0.0980392 0.0980392), wk = 0.0022936 k( 327) = ( 0.3970588 0.1029412 0.1029412), wk = 0.0022936 k( 328) = ( 0.3921569 0.1078431 0.1078431), wk = 0.0022936 k( 329) = ( 0.3872549 0.1127451 0.1127451), wk = 0.0022936 k( 330) = ( 0.3823529 0.1176471 0.1176471), wk = 0.0022936 k( 331) = ( 0.3774510 0.1225490 0.1225490), wk = 0.0022936 k( 332) = ( 0.3725490 0.1274510 0.1274510), wk = 0.0022936 k( 333) = ( 0.3676471 0.1323529 0.1323529), wk = 0.0022936 k( 334) = ( 0.3627451 0.1372549 0.1372549), wk = 0.0022936 k( 335) = ( 0.3578431 0.1421569 0.1421569), wk = 0.0022936 k( 336) = ( 0.3529412 0.1470588 0.1470588), wk = 0.0022936 k( 337) = ( 0.3480392 0.1519608 0.1519608), wk = 0.0022936 k( 338) = ( 0.3431373 0.1568627 0.1568628), wk = 0.0022936 k( 339) = ( 0.3382353 0.1617647 0.1617647), wk = 0.0022936 k( 340) = ( 0.3333333 0.1666667 0.1666667), wk = 0.0022936 k( 341) = ( 0.3284314 0.1715686 0.1715686), wk = 0.0022936 k( 342) = ( 0.3235294 0.1764706 0.1764706), wk = 0.0022936 k( 343) = ( 0.3186274 0.1813725 0.1813726), wk = 0.0022936 k( 344) = ( 0.3137255 0.1862745 0.1862745), wk = 0.0022936 k( 345) = ( 0.3088235 0.1911765 0.1911765), wk = 0.0022936 k( 346) = ( 0.3039216 0.1960784 0.1960784), wk = 0.0022936 k( 347) = ( 0.2990196 0.2009804 0.2009804), wk = 0.0022936 k( 348) = ( 0.2941177 0.2058823 0.2058824), wk = 0.0022936 k( 349) = ( 0.2892157 0.2107843 0.2107843), wk = 0.0022936 k( 350) = ( 0.2843137 0.2156863 0.2156863), wk = 0.0022936 k( 351) = ( 0.2794118 0.2205882 0.2205882), wk = 0.0022936 k( 352) = ( 0.2745098 0.2254902 0.2254902), wk = 0.0022936 k( 353) = ( 0.2696078 0.2303922 0.2303922), wk = 0.0022936 k( 354) = ( 0.2647059 0.2352941 0.2352941), wk = 0.0022936 k( 355) = ( 0.2598039 0.2401961 0.2401961), wk = 0.0022936 k( 356) = ( 0.2549020 0.2450980 0.2450980), wk = 0.0022936 k( 357) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0022936 k( 358) = ( 0.0631415 -0.0631415 0.5213959), wk = 0.0022936 k( 359) = ( 0.0680165 -0.0680165 0.5165208), wk = 0.0022936 k( 360) = ( 0.0728915 -0.0728915 0.5116458), wk = 0.0022936 k( 361) = ( 0.0777666 -0.0777666 0.5067707), wk = 0.0022936 k( 362) = ( 0.0826416 -0.0826416 0.5018957), wk = 0.0022936 k( 363) = ( 0.0875167 -0.0875167 0.4970206), wk = 0.0022936 k( 364) = ( 0.0923917 -0.0923917 0.4921456), wk = 0.0022936 k( 365) = ( 0.0972668 -0.0972668 0.4872705), wk = 0.0022936 k( 366) = ( 0.1021418 -0.1021418 0.4823955), wk = 0.0022936 k( 367) = ( 0.1070169 -0.1070169 0.4775204), wk = 0.0022936 k( 368) = ( 0.1118919 -0.1118919 0.4726454), wk = 0.0022936 k( 369) = ( 0.1167670 -0.1167670 0.4677704), wk = 0.0022936 k( 370) = ( 0.1216420 -0.1216420 0.4628953), wk = 0.0022936 k( 371) = ( 0.1265171 -0.1265171 0.4580203), wk = 0.0022936 k( 372) = ( 0.1313921 -0.1313921 0.4531452), wk = 0.0022936 k( 373) = ( 0.1362672 -0.1362672 0.4482702), wk = 0.0022936 k( 374) = ( 0.1411422 -0.1411422 0.4433951), wk = 0.0022936 k( 375) = ( 0.1460173 -0.1460173 0.4385201), wk = 0.0022936 k( 376) = ( 0.1508923 -0.1508923 0.4336450), wk = 0.0022936 k( 377) = ( 0.1557673 -0.1557673 0.4287700), wk = 0.0022936 k( 378) = ( 0.1606424 -0.1606424 0.4238949), wk = 0.0022936 k( 379) = ( 0.1655175 -0.1655175 0.4190199), wk = 0.0022936 k( 380) = ( 0.1703925 -0.1703925 0.4141448), wk = 0.0022936 k( 381) = ( 0.1752675 -0.1752675 0.4092698), wk = 0.0022936 k( 382) = ( 0.1801426 -0.1801426 0.4043947), wk = 0.0022936 k( 383) = ( 0.1850176 -0.1850176 0.3995197), wk = 0.0022936 k( 384) = ( 0.1898927 -0.1898927 0.3946446), wk = 0.0022936 k( 385) = ( 0.1947677 -0.1947677 0.3897696), wk = 0.0022936 k( 386) = ( 0.1996428 -0.1996428 0.3848946), wk = 0.0022936 k( 387) = ( 0.2045178 -0.2045178 0.3800195), wk = 0.0022936 k( 388) = ( 0.2093929 -0.2093929 0.3751445), wk = 0.0022936 k( 389) = ( 0.2142679 -0.2142679 0.3702694), wk = 0.0022936 k( 390) = ( 0.2191430 -0.2191430 0.3653944), wk = 0.0022936 k( 391) = ( 0.2240180 -0.2240180 0.3605193), wk = 0.0022936 k( 392) = ( 0.2288931 -0.2288931 0.3556443), wk = 0.0022936 k( 393) = ( 0.2337681 -0.2337681 0.3507692), wk = 0.0022936 k( 394) = ( 0.2386431 -0.2386431 0.3458942), wk = 0.0022936 k( 395) = ( 0.2435182 -0.2435182 0.3410191), wk = 0.0022936 k( 396) = ( 0.2483932 -0.2483932 0.3361441), wk = 0.0022936 k( 397) = ( 0.2532683 -0.2532683 0.3312690), wk = 0.0022936 k( 398) = ( 0.2581433 -0.2581433 0.3263940), wk = 0.0022936 k( 399) = ( 0.2630184 -0.2630184 0.3215190), wk = 0.0022936 k( 400) = ( 0.2678934 -0.2678934 0.3166439), wk = 0.0022936 k( 401) = ( 0.2727685 -0.2727685 0.3117688), wk = 0.0022936 k( 402) = ( 0.2776435 -0.2776435 0.3068938), wk = 0.0022936 k( 403) = ( 0.2825186 -0.2825186 0.3020188), wk = 0.0022936 k( 404) = ( 0.2873936 -0.2873936 0.2971437), wk = 0.0022936 k( 405) = ( 0.2922687 -0.2922687 0.2922687), wk = 0.0022936 k( 406) = ( 0.7077313 0.2922687 -0.2922687), wk = 0.0022936 k( 407) = ( 0.7008070 0.2991930 -0.2991930), wk = 0.0022936 k( 408) = ( 0.6938826 0.3061174 -0.3061174), wk = 0.0022936 k( 409) = ( 0.6869582 0.3130418 -0.3130418), wk = 0.0022936 k( 410) = ( 0.6800338 0.3199662 -0.3199662), wk = 0.0022936 k( 411) = ( 0.6731094 0.3268906 -0.3268906), wk = 0.0022936 k( 412) = ( 0.6661851 0.3338149 -0.3338149), wk = 0.0022936 k( 413) = ( 0.6592607 0.3407393 -0.3407393), wk = 0.0022936 k( 414) = ( 0.6523363 0.3476637 -0.3476637), wk = 0.0022936 k( 415) = ( 0.6454119 0.3545881 -0.3545881), wk = 0.0022936 k( 416) = ( 0.6384876 0.3615124 -0.3615124), wk = 0.0022936 k( 417) = ( 0.6315632 0.3684368 -0.3684368), wk = 0.0022936 k( 418) = ( 0.6246388 0.3753612 -0.3753612), wk = 0.0022936 k( 419) = ( 0.6177144 0.3822856 -0.3822856), wk = 0.0022936 k( 420) = ( 0.6107900 0.3892100 -0.3892100), wk = 0.0022936 k( 421) = ( 0.6038657 0.3961343 -0.3961343), wk = 0.0022936 k( 422) = ( 0.5969413 0.4030587 -0.4030587), wk = 0.0022936 k( 423) = ( 0.5900169 0.4099831 -0.4099831), wk = 0.0022936 k( 424) = ( 0.5830925 0.4169075 -0.4169075), wk = 0.0022936 k( 425) = ( 0.5761682 0.4238318 -0.4238318), wk = 0.0022936 k( 426) = ( 0.5692438 0.4307562 -0.4307562), wk = 0.0022936 k( 427) = ( 0.5623194 0.4376806 -0.4376806), wk = 0.0022936 k( 428) = ( 0.5553950 0.4446050 -0.4446050), wk = 0.0022936 k( 429) = ( 0.5484706 0.4515294 -0.4515294), wk = 0.0022936 k( 430) = ( 0.5415463 0.4584537 -0.4584537), wk = 0.0022936 k( 431) = ( 0.5346219 0.4653781 -0.4653781), wk = 0.0022936 k( 432) = ( 0.5276975 0.4723025 -0.4723025), wk = 0.0022936 k( 433) = ( 0.5207731 0.4792269 -0.4792269), wk = 0.0022936 k( 434) = ( 0.5138488 0.4861512 -0.4861512), wk = 0.0022936 k( 435) = ( 0.5069244 0.4930756 -0.4930756), wk = 0.0022936 k( 436) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0022936 Dense grid: 71129 G-vectors FFT dimensions: ( 75, 75, 75) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.31 Mb ( 506, 40) NL pseudopotentials 0.43 Mb ( 253, 112) Each V/rho on FFT grid 0.26 Mb ( 16875) Each G-vector array 0.02 Mb ( 1976) G-vector shells 0.01 Mb ( 1796) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.24 Mb ( 506, 160) Each subspace H/S matrix 0.02 Mb ( 40, 40) Each matrix 0.14 Mb ( 112, 2, 40) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./LiN.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.5 secs Computing kpt #: 2 total cpu time spent up to now is 3.4 secs Computing kpt #: 3 total cpu time spent up to now is 4.2 secs Computing kpt #: 4 total cpu time spent up to now is 5.0 secs Computing kpt #: 5 total cpu time spent up to now is 5.8 secs Computing kpt #: 6 total cpu time spent up to now is 6.7 secs Computing kpt #: 7 total cpu time spent up to now is 7.5 secs Computing kpt #: 8 total cpu time spent up to now is 8.3 secs Computing kpt #: 9 total cpu time spent up to now is 9.2 secs Computing kpt #: 10 total cpu time spent up to now is 10.0 secs Computing kpt #: 11 total cpu time spent up to now is 10.8 secs Computing kpt #: 12 total cpu time spent up to now is 11.7 secs Computing kpt #: 13 total cpu time spent up to now is 12.5 secs Computing kpt #: 14 total cpu time spent up to now is 13.4 secs Computing kpt #: 15 total cpu time spent up to now is 14.3 secs Computing kpt #: 16 total cpu time spent up to now is 15.2 secs Computing kpt #: 17 total cpu time spent up to now is 16.0 secs Computing kpt #: 18 total cpu time spent up to now is 17.1 secs Computing kpt #: 19 total cpu time spent up to now is 18.1 secs Computing kpt #: 20 total cpu time spent up to now is 19.1 secs Computing kpt #: 21 total cpu time spent up to now is 20.2 secs Computing kpt #: 22 total cpu time spent up to now is 21.2 secs Computing kpt #: 23 total cpu time spent up to now is 22.2 secs Computing kpt #: 24 total cpu time spent up to now is 23.3 secs Computing kpt #: 25 total cpu time spent up to now is 24.3 secs Computing kpt #: 26 total cpu time spent up to now is 25.3 secs Computing kpt #: 27 total cpu time spent up to now is 26.4 secs Computing kpt #: 28 total cpu time spent up to now is 27.4 secs Computing kpt #: 29 total cpu time spent up to now is 28.5 secs Computing kpt #: 30 total cpu time spent up to now is 29.5 secs Computing kpt #: 31 total cpu time spent up to now is 30.5 secs Computing kpt #: 32 total cpu time spent up to now is 31.5 secs Computing kpt #: 33 total cpu time spent up to now is 32.6 secs Computing kpt #: 34 total cpu time spent up to now is 33.6 secs Computing kpt #: 35 total cpu time spent up to now is 34.6 secs Computing kpt #: 36 total cpu time spent up to now is 35.7 secs Computing kpt #: 37 total cpu time spent up to now is 36.7 secs Computing kpt #: 38 total cpu time spent up to now is 37.7 secs Computing kpt #: 39 total cpu time spent up to now is 38.7 secs Computing kpt #: 40 total cpu time spent up to now is 39.8 secs Computing kpt #: 41 total cpu time spent up to now is 40.8 secs Computing kpt #: 42 total cpu time spent up to now is 41.8 secs Computing kpt #: 43 total cpu time spent up to now is 42.8 secs Computing kpt #: 44 total cpu time spent up to now is 43.8 secs Computing kpt #: 45 total cpu time spent up to now is 44.8 secs Computing kpt #: 46 total cpu time spent up to now is 45.8 secs Computing kpt #: 47 total cpu time spent up to now is 46.9 secs Computing kpt #: 48 total cpu time spent up to now is 47.9 secs Computing kpt #: 49 total cpu time spent up to now is 48.7 secs Computing kpt #: 50 total cpu time spent up to now is 49.5 secs Computing kpt #: 51 total cpu time spent up to now is 50.4 secs Computing kpt #: 52 total cpu time spent up to now is 51.2 secs Computing kpt #: 53 total cpu time spent up to now is 52.0 secs Computing kpt #: 54 total cpu time spent up to now is 52.8 secs Computing kpt #: 55 total cpu time spent up to now is 53.6 secs Computing kpt #: 56 total cpu time spent up to now is 54.4 secs Computing kpt #: 57 total cpu time spent up to now is 55.1 secs Computing kpt #: 58 total cpu time spent up to now is 55.9 secs Computing kpt #: 59 total cpu time spent up to now is 56.7 secs Computing kpt #: 60 total cpu time spent up to now is 57.5 secs Computing kpt #: 61 total cpu time spent up to now is 58.4 secs Computing kpt #: 62 total cpu time spent up to now is 59.5 secs Computing kpt #: 63 total cpu time spent up to now is 60.5 secs Computing kpt #: 64 total cpu time spent up to now is 61.5 secs Computing kpt #: 65 total cpu time spent up to now is 62.6 secs Computing kpt #: 66 total cpu time spent up to now is 63.6 secs Computing kpt #: 67 total cpu time spent up to now is 64.6 secs Computing kpt #: 68 total cpu time spent up to now is 65.7 secs Computing kpt #: 69 total cpu time spent up to now is 66.7 secs Computing kpt #: 70 total cpu time spent up to now is 67.7 secs Computing kpt #: 71 total cpu time spent up to now is 68.7 secs Computing kpt #: 72 total cpu time spent up to now is 69.8 secs Computing kpt #: 73 total cpu time spent up to now is 70.8 secs Computing kpt #: 74 total cpu time spent up to now is 71.8 secs Computing kpt #: 75 total cpu time spent up to now is 72.9 secs Computing kpt #: 76 total cpu time spent up to now is 73.9 secs Computing kpt #: 77 total cpu time spent up to now is 75.0 secs Computing kpt #: 78 total cpu time spent up to now is 76.0 secs Computing kpt #: 79 total cpu time spent up to now is 77.1 secs Computing kpt #: 80 total cpu time spent up to now is 78.1 secs Computing kpt #: 81 total cpu time spent up to now is 79.2 secs Computing kpt #: 82 total cpu time spent up to now is 80.3 secs Computing kpt #: 83 total cpu time spent up to now is 81.3 secs Computing kpt #: 84 total cpu time spent up to now is 82.4 secs Computing kpt #: 85 total cpu time spent up to now is 83.5 secs Computing kpt #: 86 total cpu time spent up to now is 84.6 secs Computing kpt #: 87 total cpu time spent up to now is 85.6 secs Computing kpt #: 88 total cpu time spent up to now is 86.7 secs Computing kpt #: 89 total cpu time spent up to now is 87.8 secs Computing kpt #: 90 total cpu time spent up to now is 88.9 secs Computing kpt #: 91 total cpu time spent up to now is 89.9 secs Computing kpt #: 92 total cpu time spent up to now is 91.0 secs Computing kpt #: 93 total cpu time spent up to now is 92.1 secs Computing kpt #: 94 total cpu time spent up to now is 93.1 secs Computing kpt #: 95 total cpu time spent up to now is 94.1 secs Computing kpt #: 96 total cpu time spent up to now is 95.2 secs Computing kpt #: 97 total cpu time spent up to now is 96.2 secs Computing kpt #: 98 total cpu time spent up to now is 97.3 secs Computing kpt #: 99 total cpu time spent up to now is 98.1 secs Computing kpt #: 100 total cpu time spent up to now is 99.0 secs Computing kpt #: 101 total cpu time spent up to now is 99.9 secs Computing kpt #: 102 total cpu time spent up to now is 100.8 secs Computing kpt #: 103 total cpu time spent up to now is 101.6 secs Computing kpt #: 104 total cpu time spent up to now is 102.5 secs Computing kpt #: 105 total cpu time spent up to now is 103.4 secs Computing kpt #: 106 total cpu time spent up to now is 104.2 secs Computing kpt #: 107 total cpu time spent up to now is 105.1 secs Computing kpt #: 108 total cpu time spent up to now is 106.0 secs Computing kpt #: 109 total cpu time spent up to now is 106.9 secs Computing kpt #: 110 total cpu time spent up to now is 107.7 secs Computing kpt #: 111 total cpu time spent up to now is 108.5 secs Computing kpt #: 112 total cpu time spent up to now is 109.4 secs Computing kpt #: 113 total cpu time spent up to now is 110.2 secs Computing kpt #: 114 total cpu time spent up to now is 111.1 secs Computing kpt #: 115 total cpu time spent up to now is 111.9 secs Computing kpt #: 116 total cpu time spent up to now is 113.2 secs Computing kpt #: 117 total cpu time spent up to now is 114.2 secs Computing kpt #: 118 total cpu time spent up to now is 115.0 secs Computing kpt #: 119 total cpu time spent up to now is 115.9 secs Computing kpt #: 120 total cpu time spent up to now is 116.7 secs Computing kpt #: 121 total cpu time spent up to now is 117.6 secs Computing kpt #: 122 total cpu time spent up to now is 118.5 secs Computing kpt #: 123 total cpu time spent up to now is 119.3 secs Computing kpt #: 124 total cpu time spent up to now is 120.2 secs Computing kpt #: 125 total cpu time spent up to now is 121.0 secs Computing kpt #: 126 total cpu time spent up to now is 121.9 secs Computing kpt #: 127 total cpu time spent up to now is 122.8 secs Computing kpt #: 128 total cpu time spent up to now is 123.6 secs Computing kpt #: 129 total cpu time spent up to now is 124.4 secs Computing kpt #: 130 total cpu time spent up to now is 125.3 secs Computing kpt #: 131 total cpu time spent up to now is 126.1 secs Computing kpt #: 132 total cpu time spent up to now is 126.9 secs Computing kpt #: 133 total cpu time spent up to now is 127.8 secs Computing kpt #: 134 total cpu time spent up to now is 128.6 secs Computing kpt #: 135 total cpu time spent up to now is 129.4 secs Computing kpt #: 136 total cpu time spent up to now is 130.3 secs Computing kpt #: 137 total cpu time spent up to now is 131.1 secs Computing kpt #: 138 total cpu time spent up to now is 131.9 secs Computing kpt #: 139 total cpu time spent up to now is 132.7 secs Computing kpt #: 140 total cpu time spent up to now is 133.5 secs Computing kpt #: 141 total cpu time spent up to now is 134.3 secs Computing kpt #: 142 total cpu time spent up to now is 135.1 secs Computing kpt #: 143 total cpu time spent up to now is 135.9 secs Computing kpt #: 144 total cpu time spent up to now is 136.7 secs Computing kpt #: 145 total cpu time spent up to now is 137.5 secs Computing kpt #: 146 total cpu time spent up to now is 138.3 secs Computing kpt #: 147 total cpu time spent up to now is 139.1 secs Computing kpt #: 148 total cpu time spent up to now is 139.9 secs Computing kpt #: 149 total cpu time spent up to now is 140.6 secs Computing kpt #: 150 total cpu time spent up to now is 141.4 secs Computing kpt #: 151 total cpu time spent up to now is 142.2 secs Computing kpt #: 152 total cpu time spent up to now is 143.0 secs Computing kpt #: 153 total cpu time spent up to now is 143.9 secs Computing kpt #: 154 total cpu time spent up to now is 144.7 secs Computing kpt #: 155 total cpu time spent up to now is 145.5 secs Computing kpt #: 156 total cpu time spent up to now is 146.3 secs Computing kpt #: 157 total cpu time spent up to now is 147.1 secs Computing kpt #: 158 total cpu time spent up to now is 147.9 secs Computing kpt #: 159 total cpu time spent up to now is 148.8 secs Computing kpt #: 160 total cpu time spent up to now is 149.6 secs Computing kpt #: 161 total cpu time spent up to now is 150.4 secs Computing kpt #: 162 total cpu time spent up to now is 151.3 secs Computing kpt #: 163 total cpu time spent up to now is 152.1 secs Computing kpt #: 164 total cpu time spent up to now is 153.0 secs Computing kpt #: 165 total cpu time spent up to now is 153.8 secs Computing kpt #: 166 total cpu time spent up to now is 154.6 secs Computing kpt #: 167 total cpu time spent up to now is 155.4 secs Computing kpt #: 168 total cpu time spent up to now is 156.1 secs Computing kpt #: 169 total cpu time spent up to now is 156.9 secs Computing kpt #: 170 total cpu time spent up to now is 157.9 secs Computing kpt #: 171 total cpu time spent up to now is 158.9 secs Computing kpt #: 172 total cpu time spent up to now is 159.7 secs Computing kpt #: 173 total cpu time spent up to now is 160.7 secs Computing kpt #: 174 total cpu time spent up to now is 161.7 secs Computing kpt #: 175 total cpu time spent up to now is 162.7 secs Computing kpt #: 176 total cpu time spent up to now is 163.7 secs Computing kpt #: 177 total cpu time spent up to now is 164.4 secs Computing kpt #: 178 total cpu time spent up to now is 165.4 secs Computing kpt #: 179 total cpu time spent up to now is 166.2 secs Computing kpt #: 180 total cpu time spent up to now is 167.3 secs Computing kpt #: 181 total cpu time spent up to now is 168.0 secs Computing kpt #: 182 total cpu time spent up to now is 168.8 secs Computing kpt #: 183 total cpu time spent up to now is 169.6 secs Computing kpt #: 184 total cpu time spent up to now is 170.4 secs Computing kpt #: 185 total cpu time spent up to now is 171.2 secs Computing kpt #: 186 total cpu time spent up to now is 172.0 secs Computing kpt #: 187 total cpu time spent up to now is 172.8 secs Computing kpt #: 188 total cpu time spent up to now is 173.6 secs Computing kpt #: 189 total cpu time spent up to now is 174.4 secs Computing kpt #: 190 total cpu time spent up to now is 175.3 secs Computing kpt #: 191 total cpu time spent up to now is 176.1 secs Computing kpt #: 192 total cpu time spent up to now is 176.9 secs Computing kpt #: 193 total cpu time spent up to now is 177.7 secs Computing kpt #: 194 total cpu time spent up to now is 178.5 secs Computing kpt #: 195 total cpu time spent up to now is 179.3 secs Computing kpt #: 196 total cpu time spent up to now is 180.1 secs Computing kpt #: 197 total cpu time spent up to now is 181.0 secs Computing kpt #: 198 total cpu time spent up to now is 181.8 secs Computing kpt #: 199 total cpu time spent up to now is 182.6 secs Computing kpt #: 200 total cpu time spent up to now is 183.4 secs Computing kpt #: 201 total cpu time spent up to now is 184.2 secs Computing kpt #: 202 total cpu time spent up to now is 185.0 secs Computing kpt #: 203 total cpu time spent up to now is 185.9 secs Computing kpt #: 204 total cpu time spent up to now is 186.7 secs Computing kpt #: 205 total cpu time spent up to now is 187.5 secs Computing kpt #: 206 total cpu time spent up to now is 188.4 secs Computing kpt #: 207 total cpu time spent up to now is 189.2 secs Computing kpt #: 208 total cpu time spent up to now is 190.0 secs Computing kpt #: 209 total cpu time spent up to now is 190.8 secs Computing kpt #: 210 total cpu time spent up to now is 191.7 secs Computing kpt #: 211 total cpu time spent up to now is 192.5 secs Computing kpt #: 212 total cpu time spent up to now is 193.3 secs Computing kpt #: 213 total cpu time spent up to now is 194.1 secs Computing kpt #: 214 total cpu time spent up to now is 194.9 secs Computing kpt #: 215 total cpu time spent up to now is 195.7 secs Computing kpt #: 216 total cpu time spent up to now is 196.6 secs Computing kpt #: 217 total cpu time spent up to now is 197.4 secs Computing kpt #: 218 total cpu time spent up to now is 198.2 secs Computing kpt #: 219 total cpu time spent up to now is 199.0 secs Computing kpt #: 220 total cpu time spent up to now is 199.8 secs Computing kpt #: 221 total cpu time spent up to now is 200.6 secs Computing kpt #: 222 total cpu time spent up to now is 201.4 secs Computing kpt #: 223 total cpu time spent up to now is 202.2 secs Computing kpt #: 224 total cpu time spent up to now is 203.1 secs Computing kpt #: 225 total cpu time spent up to now is 203.9 secs Computing kpt #: 226 total cpu time spent up to now is 204.7 secs Computing kpt #: 227 total cpu time spent up to now is 205.5 secs Computing kpt #: 228 total cpu time spent up to now is 206.3 secs Computing kpt #: 229 total cpu time spent up to now is 207.1 secs Computing kpt #: 230 total cpu time spent up to now is 207.9 secs Computing kpt #: 231 total cpu time spent up to now is 208.8 secs Computing kpt #: 232 total cpu time spent up to now is 209.6 secs Computing kpt #: 233 total cpu time spent up to now is 210.4 secs Computing kpt #: 234 total cpu time spent up to now is 211.2 secs Computing kpt #: 235 total cpu time spent up to now is 212.1 secs Computing kpt #: 236 total cpu time spent up to now is 212.9 secs Computing kpt #: 237 total cpu time spent up to now is 213.7 secs Computing kpt #: 238 total cpu time spent up to now is 214.6 secs Computing kpt #: 239 total cpu time spent up to now is 215.4 secs Computing kpt #: 240 total cpu time spent up to now is 216.3 secs Computing kpt #: 241 total cpu time spent up to now is 217.1 secs Computing kpt #: 242 total cpu time spent up to now is 218.0 secs Computing kpt #: 243 total cpu time spent up to now is 218.8 secs Computing kpt #: 244 total cpu time spent up to now is 219.7 secs Computing kpt #: 245 total cpu time spent up to now is 220.5 secs Computing kpt #: 246 total cpu time spent up to now is 221.3 secs Computing kpt #: 247 total cpu time spent up to now is 222.1 secs Computing kpt #: 248 total cpu time spent up to now is 222.9 secs Computing kpt #: 249 total cpu time spent up to now is 223.7 secs Computing kpt #: 250 total cpu time spent up to now is 224.6 secs Computing kpt #: 251 total cpu time spent up to now is 225.4 secs Computing kpt #: 252 total cpu time spent up to now is 226.2 secs Computing kpt #: 253 total cpu time spent up to now is 227.0 secs Computing kpt #: 254 total cpu time spent up to now is 227.8 secs Computing kpt #: 255 total cpu time spent up to now is 228.6 secs Computing kpt #: 256 total cpu time spent up to now is 229.5 secs Computing kpt #: 257 total cpu time spent up to now is 230.3 secs Computing kpt #: 258 total cpu time spent up to now is 231.1 secs Computing kpt #: 259 total cpu time spent up to now is 232.0 secs Computing kpt #: 260 total cpu time spent up to now is 232.8 secs Computing kpt #: 261 total cpu time spent up to now is 233.6 secs Computing kpt #: 262 total cpu time spent up to now is 234.5 secs Computing kpt #: 263 total cpu time spent up to now is 235.3 secs Computing kpt #: 264 total cpu time spent up to now is 236.2 secs Computing kpt #: 265 total cpu time spent up to now is 237.0 secs Computing kpt #: 266 total cpu time spent up to now is 237.8 secs Computing kpt #: 267 total cpu time spent up to now is 238.7 secs Computing kpt #: 268 total cpu time spent up to now is 239.5 secs Computing kpt #: 269 total cpu time spent up to now is 240.3 secs Computing kpt #: 270 total cpu time spent up to now is 241.1 secs Computing kpt #: 271 total cpu time spent up to now is 241.9 secs Computing kpt #: 272 total cpu time spent up to now is 242.8 secs Computing kpt #: 273 total cpu time spent up to now is 243.6 secs Computing kpt #: 274 total cpu time spent up to now is 244.4 secs Computing kpt #: 275 total cpu time spent up to now is 245.2 secs Computing kpt #: 276 total cpu time spent up to now is 246.0 secs Computing kpt #: 277 total cpu time spent up to now is 246.8 secs Computing kpt #: 278 total cpu time spent up to now is 247.6 secs Computing kpt #: 279 total cpu time spent up to now is 248.4 secs Computing kpt #: 280 total cpu time spent up to now is 249.3 secs Computing kpt #: 281 total cpu time spent up to now is 250.1 secs Computing kpt #: 282 total cpu time spent up to now is 250.9 secs Computing kpt #: 283 total cpu time spent up to now is 251.7 secs Computing kpt #: 284 total cpu time spent up to now is 252.6 secs Computing kpt #: 285 total cpu time spent up to now is 253.4 secs Computing kpt #: 286 total cpu time spent up to now is 254.3 secs Computing kpt #: 287 total cpu time spent up to now is 255.1 secs Computing kpt #: 288 total cpu time spent up to now is 255.9 secs Computing kpt #: 289 total cpu time spent up to now is 256.8 secs Computing kpt #: 290 total cpu time spent up to now is 257.6 secs Computing kpt #: 291 total cpu time spent up to now is 258.5 secs Computing kpt #: 292 total cpu time spent up to now is 259.3 secs Computing kpt #: 293 total cpu time spent up to now is 260.2 secs Computing kpt #: 294 total cpu time spent up to now is 261.0 secs Computing kpt #: 295 total cpu time spent up to now is 261.8 secs Computing kpt #: 296 total cpu time spent up to now is 262.7 secs Computing kpt #: 297 total cpu time spent up to now is 263.5 secs Computing kpt #: 298 total cpu time spent up to now is 264.4 secs Computing kpt #: 299 total cpu time spent up to now is 265.2 secs Computing kpt #: 300 total cpu time spent up to now is 266.0 secs Computing kpt #: 301 total cpu time spent up to now is 266.9 secs Computing kpt #: 302 total cpu time spent up to now is 267.7 secs Computing kpt #: 303 total cpu time spent up to now is 268.5 secs Computing kpt #: 304 total cpu time spent up to now is 269.4 secs Computing kpt #: 305 total cpu time spent up to now is 270.2 secs Computing kpt #: 306 total cpu time spent up to now is 271.0 secs Computing kpt #: 307 total cpu time spent up to now is 271.8 secs Computing kpt #: 308 total cpu time spent up to now is 272.7 secs Computing kpt #: 309 total cpu time spent up to now is 273.5 secs Computing kpt #: 310 total cpu time spent up to now is 274.4 secs Computing kpt #: 311 total cpu time spent up to now is 275.2 secs Computing kpt #: 312 total cpu time spent up to now is 276.1 secs Computing kpt #: 313 total cpu time spent up to now is 276.9 secs Computing kpt #: 314 total cpu time spent up to now is 277.7 secs Computing kpt #: 315 total cpu time spent up to now is 278.6 secs Computing kpt #: 316 total cpu time spent up to now is 279.4 secs Computing kpt #: 317 total cpu time spent up to now is 280.3 secs Computing kpt #: 318 total cpu time spent up to now is 281.1 secs Computing kpt #: 319 total cpu time spent up to now is 282.0 secs Computing kpt #: 320 total cpu time spent up to now is 282.9 secs Computing kpt #: 321 total cpu time spent up to now is 283.7 secs Computing kpt #: 322 total cpu time spent up to now is 284.5 secs Computing kpt #: 323 total cpu time spent up to now is 285.4 secs Computing kpt #: 324 total cpu time spent up to now is 286.3 secs Computing kpt #: 325 total cpu time spent up to now is 287.1 secs Computing kpt #: 326 total cpu time spent up to now is 288.0 secs Computing kpt #: 327 total cpu time spent up to now is 288.8 secs Computing kpt #: 328 total cpu time spent up to now is 289.7 secs Computing kpt #: 329 total cpu time spent up to now is 290.5 secs Computing kpt #: 330 total cpu time spent up to now is 291.4 secs Computing kpt #: 331 total cpu time spent up to now is 292.3 secs Computing kpt #: 332 total cpu time spent up to now is 293.1 secs Computing kpt #: 333 total cpu time spent up to now is 294.0 secs Computing kpt #: 334 total cpu time spent up to now is 294.8 secs Computing kpt #: 335 total cpu time spent up to now is 295.7 secs Computing kpt #: 336 total cpu time spent up to now is 296.6 secs Computing kpt #: 337 total cpu time spent up to now is 297.4 secs Computing kpt #: 338 total cpu time spent up to now is 298.3 secs Computing kpt #: 339 total cpu time spent up to now is 299.2 secs Computing kpt #: 340 total cpu time spent up to now is 300.0 secs Computing kpt #: 341 total cpu time spent up to now is 300.9 secs Computing kpt #: 342 total cpu time spent up to now is 301.8 secs Computing kpt #: 343 total cpu time spent up to now is 302.7 secs Computing kpt #: 344 total cpu time spent up to now is 303.5 secs Computing kpt #: 345 total cpu time spent up to now is 304.4 secs Computing kpt #: 346 total cpu time spent up to now is 305.3 secs Computing kpt #: 347 total cpu time spent up to now is 306.2 secs Computing kpt #: 348 total cpu time spent up to now is 307.1 secs Computing kpt #: 349 total cpu time spent up to now is 307.9 secs Computing kpt #: 350 total cpu time spent up to now is 308.8 secs Computing kpt #: 351 total cpu time spent up to now is 309.7 secs Computing kpt #: 352 total cpu time spent up to now is 310.5 secs Computing kpt #: 353 total cpu time spent up to now is 311.4 secs Computing kpt #: 354 total cpu time spent up to now is 312.2 secs Computing kpt #: 355 total cpu time spent up to now is 313.1 secs Computing kpt #: 356 total cpu time spent up to now is 313.9 secs Computing kpt #: 357 total cpu time spent up to now is 314.8 secs Computing kpt #: 358 total cpu time spent up to now is 315.9 secs Computing kpt #: 359 total cpu time spent up to now is 316.9 secs Computing kpt #: 360 total cpu time spent up to now is 318.0 secs Computing kpt #: 361 total cpu time spent up to now is 319.1 secs Computing kpt #: 362 total cpu time spent up to now is 320.2 secs Computing kpt #: 363 total cpu time spent up to now is 321.2 secs Computing kpt #: 364 total cpu time spent up to now is 322.3 secs Computing kpt #: 365 total cpu time spent up to now is 323.4 secs Computing kpt #: 366 total cpu time spent up to now is 324.5 secs Computing kpt #: 367 total cpu time spent up to now is 325.5 secs Computing kpt #: 368 total cpu time spent up to now is 326.6 secs Computing kpt #: 369 total cpu time spent up to now is 327.7 secs Computing kpt #: 370 total cpu time spent up to now is 328.8 secs Computing kpt #: 371 total cpu time spent up to now is 329.9 secs Computing kpt #: 372 total cpu time spent up to now is 331.0 secs Computing kpt #: 373 total cpu time spent up to now is 332.1 secs Computing kpt #: 374 total cpu time spent up to now is 333.0 secs Computing kpt #: 375 total cpu time spent up to now is 333.8 secs Computing kpt #: 376 total cpu time spent up to now is 334.7 secs Computing kpt #: 377 total cpu time spent up to now is 335.6 secs Computing kpt #: 378 total cpu time spent up to now is 336.5 secs Computing kpt #: 379 total cpu time spent up to now is 337.3 secs Computing kpt #: 380 total cpu time spent up to now is 338.2 secs Computing kpt #: 381 total cpu time spent up to now is 339.1 secs Computing kpt #: 382 total cpu time spent up to now is 339.9 secs Computing kpt #: 383 total cpu time spent up to now is 340.8 secs Computing kpt #: 384 total cpu time spent up to now is 341.6 secs Computing kpt #: 385 total cpu time spent up to now is 342.5 secs Computing kpt #: 386 total cpu time spent up to now is 343.3 secs Computing kpt #: 387 total cpu time spent up to now is 344.2 secs Computing kpt #: 388 total cpu time spent up to now is 345.0 secs Computing kpt #: 389 total cpu time spent up to now is 345.9 secs Computing kpt #: 390 total cpu time spent up to now is 346.7 secs Computing kpt #: 391 total cpu time spent up to now is 347.6 secs Computing kpt #: 392 total cpu time spent up to now is 348.4 secs Computing kpt #: 393 total cpu time spent up to now is 349.3 secs Computing kpt #: 394 total cpu time spent up to now is 350.1 secs Computing kpt #: 395 total cpu time spent up to now is 351.0 secs Computing kpt #: 396 total cpu time spent up to now is 351.8 secs Computing kpt #: 397 total cpu time spent up to now is 352.7 secs Computing kpt #: 398 total cpu time spent up to now is 353.5 secs Computing kpt #: 399 total cpu time spent up to now is 354.3 secs Computing kpt #: 400 total cpu time spent up to now is 355.2 secs Computing kpt #: 401 total cpu time spent up to now is 356.1 secs Computing kpt #: 402 total cpu time spent up to now is 356.9 secs Computing kpt #: 403 total cpu time spent up to now is 357.8 secs Computing kpt #: 404 total cpu time spent up to now is 358.6 secs Computing kpt #: 405 total cpu time spent up to now is 359.4 secs Computing kpt #: 406 total cpu time spent up to now is 360.3 secs Computing kpt #: 407 total cpu time spent up to now is 361.1 secs Computing kpt #: 408 total cpu time spent up to now is 362.0 secs Computing kpt #: 409 total cpu time spent up to now is 362.9 secs Computing kpt #: 410 total cpu time spent up to now is 363.7 secs Computing kpt #: 411 total cpu time spent up to now is 364.6 secs Computing kpt #: 412 total cpu time spent up to now is 365.4 secs Computing kpt #: 413 total cpu time spent up to now is 366.3 secs Computing kpt #: 414 total cpu time spent up to now is 367.1 secs Computing kpt #: 415 total cpu time spent up to now is 368.0 secs Computing kpt #: 416 total cpu time spent up to now is 368.9 secs Computing kpt #: 417 total cpu time spent up to now is 369.7 secs Computing kpt #: 418 total cpu time spent up to now is 370.6 secs Computing kpt #: 419 total cpu time spent up to now is 371.4 secs Computing kpt #: 420 total cpu time spent up to now is 372.2 secs Computing kpt #: 421 total cpu time spent up to now is 373.0 secs Computing kpt #: 422 total cpu time spent up to now is 373.9 secs Computing kpt #: 423 total cpu time spent up to now is 374.7 secs Computing kpt #: 424 total cpu time spent up to now is 375.6 secs Computing kpt #: 425 total cpu time spent up to now is 376.4 secs Computing kpt #: 426 total cpu time spent up to now is 377.2 secs Computing kpt #: 427 total cpu time spent up to now is 378.1 secs Computing kpt #: 428 total cpu time spent up to now is 378.9 secs Computing kpt #: 429 total cpu time spent up to now is 379.7 secs Computing kpt #: 430 total cpu time spent up to now is 380.5 secs Computing kpt #: 431 total cpu time spent up to now is 381.3 secs Computing kpt #: 432 total cpu time spent up to now is 382.2 secs Computing kpt #: 433 total cpu time spent up to now is 383.0 secs Computing kpt #: 434 total cpu time spent up to now is 383.8 secs Computing kpt #: 435 total cpu time spent up to now is 384.6 secs Computing kpt #: 436 total cpu time spent up to now is 385.4 secs ethr = 3.13E-08, avg # of iterations = 16.3 total cpu time spent up to now is 385.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8949 PWs) bands (ev): -40.5887 -40.5887 -40.5368 -40.5368 -40.4218 -40.4218 -40.2152 -40.2152 -15.6067 -15.6067 -15.2278 -15.2278 -5.4428 -5.4428 -5.2110 -5.2110 -2.0351 -2.0351 -1.7565 -1.7565 -1.1699 -1.1699 0.0231 0.0231 0.2412 0.2412 0.5714 0.5714 4.8768 4.8768 5.4432 5.4432 6.6090 6.6090 7.1830 7.1830 9.8657 9.8657 11.3564 11.3564 k =-0.0049 0.0098 0.0156 ( 8953 PWs) bands (ev): -40.5887 -40.5887 -40.5369 -40.5369 -40.4218 -40.4218 -40.2152 -40.2152 -15.6066 -15.6066 -15.2276 -15.2276 -5.4424 -5.4424 -5.2105 -5.2105 -2.0350 -2.0350 -1.7563 -1.7563 -1.1698 -1.1698 0.0214 0.0214 0.2385 0.2385 0.5719 0.5719 4.8767 4.8767 5.4435 5.4435 6.6066 6.6066 7.1813 7.1813 9.8648 9.8648 11.3584 11.3584 k =-0.0098 0.0196 0.0312 ( 8953 PWs) bands (ev): -40.5887 -40.5887 -40.5369 -40.5369 -40.4217 -40.4217 -40.2152 -40.2152 -15.6061 -15.6061 -15.2269 -15.2269 -5.4413 -5.4413 -5.2091 -5.2091 -2.0350 -2.0350 -1.7555 -1.7555 -1.1696 -1.1696 0.0164 0.0164 0.2307 0.2307 0.5735 0.5735 4.8765 4.8765 5.4444 5.4444 6.5996 6.5996 7.1763 7.1763 9.8622 9.8622 11.3642 11.3642 k =-0.0148 0.0294 0.0468 ( 8957 PWs) bands (ev): -40.5886 -40.5886 -40.5369 -40.5369 -40.4217 -40.4217 -40.2152 -40.2152 -15.6053 -15.6053 -15.2259 -15.2259 -5.4394 -5.4394 -5.2067 -5.2067 -2.0348 -2.0348 -1.7542 -1.7542 -1.1692 -1.1692 0.0081 0.0081 0.2178 0.2178 0.5759 0.5759 4.8760 4.8760 5.4460 5.4460 6.5881 6.5881 7.1681 7.1681 9.8577 9.8577 11.3737 11.3737 k =-0.0197 0.0392 0.0624 ( 8965 PWs) bands (ev): -40.5884 -40.5884 -40.5369 -40.5369 -40.4216 -40.4216 -40.2152 -40.2152 -15.6042 -15.6042 -15.2244 -15.2244 -5.4368 -5.4368 -5.2033 -5.2033 -2.0347 -2.0347 -1.7525 -1.7525 -1.1687 -1.1687 -0.0034 -0.0034 0.2003 0.2003 0.5790 0.5790 4.8753 4.8753 5.4481 5.4481 6.5720 6.5720 7.1566 7.1566 9.8513 9.8513 11.3865 11.3865 k =-0.0246 0.0490 0.0780 ( 8941 PWs) bands (ev): -40.5883 -40.5883 -40.5370 -40.5370 -40.4215 -40.4215 -40.2152 -40.2152 -15.6029 -15.6029 -15.2225 -15.2225 -5.4335 -5.4335 -5.1989 -5.1989 -2.0345 -2.0345 -1.7503 -1.7503 -1.1680 -1.1680 -0.0180 -0.0180 0.1785 0.1785 0.5824 0.5824 4.8744 4.8744 5.4508 5.4508 6.5517 6.5517 7.1420 7.1420 9.8428 9.8428 11.4021 11.4021 k =-0.0295 0.0588 0.0936 ( 8933 PWs) bands (ev): -40.5881 -40.5881 -40.5371 -40.5371 -40.4214 -40.4214 -40.2151 -40.2151 -15.6012 -15.6012 -15.2202 -15.2202 -5.4295 -5.4295 -5.1936 -5.1936 -2.0342 -2.0342 -1.7476 -1.7476 -1.1673 -1.1673 -0.0357 -0.0357 0.1527 0.1527 0.5860 0.5860 4.8732 4.8732 5.4540 5.4540 6.5272 6.5272 7.1245 7.1245 9.8322 9.8322 11.4201 11.4201 k =-0.0345 0.0686 0.1093 ( 8929 PWs) bands (ev): -40.5878 -40.5878 -40.5371 -40.5371 -40.4212 -40.4212 -40.2151 -40.2151 -15.5992 -15.5992 -15.2176 -15.2176 -5.4248 -5.4248 -5.1874 -5.1874 -2.0339 -2.0339 -1.7444 -1.7444 -1.1665 -1.1665 -0.0563 -0.0563 0.1234 0.1234 0.5895 0.5895 4.8716 4.8716 5.4576 5.4576 6.4988 6.4988 7.1041 7.1041 9.8192 9.8192 11.4396 11.4396 k =-0.0394 0.0784 0.1249 ( 8923 PWs) bands (ev): -40.5875 -40.5875 -40.5372 -40.5372 -40.4210 -40.4210 -40.2151 -40.2151 -15.5969 -15.5969 -15.2145 -15.2145 -5.4193 -5.4193 -5.1803 -5.1803 -2.0336 -2.0336 -1.7409 -1.7409 -1.1657 -1.1657 -0.0795 -0.0795 0.0908 0.0908 0.5928 0.5928 4.8696 4.8696 5.4617 5.4617 6.4667 6.4667 7.0811 7.0811 9.8037 9.8037 11.4600 11.4600 k =-0.0443 0.0882 0.1405 ( 8919 PWs) bands (ev): -40.5872 -40.5872 -40.5373 -40.5373 -40.4209 -40.4209 -40.2151 -40.2151 -15.5944 -15.5944 -15.2110 -15.2110 -5.4133 -5.4133 -5.1722 -5.1722 -2.0332 -2.0332 -1.7370 -1.7370 -1.1650 -1.1650 -0.1053 -0.1053 0.0554 0.0554 0.5958 0.5958 4.8670 4.8670 5.4661 5.4661 6.4314 6.4314 7.0556 7.0556 9.7856 9.7856 11.4803 11.4803 k =-0.0492 0.0980 0.1561 ( 8907 PWs) bands (ev): -40.5869 -40.5869 -40.5374 -40.5374 -40.4206 -40.4206 -40.2150 -40.2150 -15.5916 -15.5916 -15.2072 -15.2072 -5.4066 -5.4066 -5.1633 -5.1633 -2.0328 -2.0328 -1.7327 -1.7327 -1.1643 -1.1643 -0.1335 -0.1335 0.0175 0.0175 0.5985 0.5985 4.8639 4.8639 5.4708 5.4708 6.3930 6.3930 7.0280 7.0280 9.7647 9.7647 11.4996 11.4996 k =-0.0542 0.1078 0.1717 ( 8915 PWs) bands (ev): -40.5865 -40.5865 -40.5376 -40.5376 -40.4204 -40.4204 -40.2150 -40.2150 -15.5885 -15.5885 -15.2031 -15.2031 -5.3993 -5.3993 -5.1535 -5.1535 -2.0325 -2.0325 -1.7281 -1.7281 -1.1638 -1.1638 -0.1638 -0.1638 -0.0227 -0.0227 0.6007 0.6007 4.8601 4.8601 5.4757 5.4757 6.3519 6.3519 6.9983 6.9983 9.7410 9.7410 11.5171 11.5171 k =-0.0591 0.1176 0.1873 ( 8909 PWs) bands (ev): -40.5861 -40.5861 -40.5377 -40.5377 -40.4202 -40.4202 -40.2150 -40.2150 -15.5852 -15.5852 -15.1986 -15.1986 -5.3914 -5.3914 -5.1428 -5.1428 -2.0321 -2.0321 -1.7232 -1.7232 -1.1637 -1.1637 -0.1961 -0.1961 -0.0647 -0.0647 0.6024 0.6024 4.8555 4.8555 5.4806 5.4806 6.3086 6.3086 6.9670 6.9670 9.7144 9.7144 11.5319 11.5319 k =-0.0640 0.1274 0.2029 ( 8913 PWs) bands (ev): -40.5856 -40.5856 -40.5378 -40.5378 -40.4199 -40.4199 -40.2149 -40.2149 -15.5816 -15.5816 -15.1938 -15.1938 -5.3829 -5.3829 -5.1313 -5.1313 -2.0317 -2.0317 -1.7181 -1.7181 -1.1638 -1.1638 -0.2300 -0.2300 -0.1083 -0.1083 0.6037 0.6037 4.8499 4.8499 5.4854 5.4854 6.2633 6.2633 6.9344 6.9344 9.6849 9.6849 11.5433 11.5433 k =-0.0689 0.1372 0.2185 ( 8913 PWs) bands (ev): -40.5852 -40.5852 -40.5380 -40.5380 -40.4196 -40.4196 -40.2149 -40.2149 -15.5778 -15.5778 -15.1887 -15.1887 -5.3739 -5.3739 -5.1191 -5.1191 -2.0313 -2.0313 -1.7128 -1.7128 -1.1645 -1.1645 -0.2654 -0.2654 -0.1531 -0.1531 0.6044 0.6044 4.8432 4.8432 5.4900 5.4900 6.2165 6.2165 6.9006 6.9006 9.6525 9.6525 11.5507 11.5507 k =-0.0739 0.1470 0.2341 ( 8909 PWs) bands (ev): -40.5847 -40.5847 -40.5382 -40.5382 -40.4193 -40.4193 -40.2148 -40.2148 -15.5737 -15.5737 -15.1833 -15.1833 -5.3645 -5.3645 -5.1060 -5.1060 -2.0310 -2.0310 -1.7075 -1.7075 -1.1658 -1.1658 -0.3019 -0.3019 -0.1988 -0.1988 0.6047 0.6047 4.8352 4.8352 5.4943 5.4943 6.1686 6.1686 6.8662 6.8662 9.6173 9.6173 11.5538 11.5538 k =-0.0788 0.1568 0.2497 ( 8903 PWs) bands (ev): -40.5841 -40.5841 -40.5384 -40.5384 -40.4190 -40.4190 -40.2148 -40.2148 -15.5695 -15.5695 -15.1777 -15.1777 -5.3545 -5.3545 -5.0922 -5.0922 -2.0308 -2.0308 -1.7020 -1.7020 -1.1679 -1.1679 -0.3393 -0.3393 -0.2448 -0.2448 0.6045 0.6045 4.8259 4.8259 5.4980 5.4980 6.1201 6.1201 6.8314 6.8314 9.5795 9.5795 11.5522 11.5522 k =-0.0837 0.1666 0.2653 ( 8911 PWs) bands (ev): -40.5836 -40.5836 -40.5386 -40.5386 -40.4187 -40.4187 -40.2148 -40.2148 -15.5651 -15.5651 -15.1718 -15.1718 -5.3442 -5.3442 -5.0777 -5.0777 -2.0306 -2.0306 -1.6966 -1.6966 -1.1710 -1.1710 -0.3774 -0.3774 -0.2910 -0.2910 0.6039 0.6039 4.8150 4.8150 5.5009 5.5009 6.0713 6.0713 6.7966 6.7966 9.5392 9.5392 11.5460 11.5460 k =-0.0886 0.1764 0.2809 ( 8923 PWs) bands (ev): -40.5830 -40.5830 -40.5388 -40.5388 -40.4184 -40.4184 -40.2147 -40.2147 -15.5605 -15.5605 -15.1657 -15.1657 -5.3335 -5.3335 -5.0626 -5.0626 -2.0305 -2.0305 -1.6913 -1.6913 -1.1753 -1.1753 -0.4159 -0.4159 -0.3368 -0.3368 0.6027 0.6027 4.8023 4.8023 5.5029 5.5029 6.0226 6.0226 6.7623 6.7623 9.4966 9.4966 11.5354 11.5354 k =-0.0936 0.1862 0.2965 ( 8925 PWs) bands (ev): -40.5824 -40.5824 -40.5391 -40.5391 -40.4181 -40.4181 -40.2147 -40.2147 -15.5557 -15.5557 -15.1594 -15.1594 -5.3225 -5.3225 -5.0467 -5.0467 -2.0305 -2.0305 -1.6861 -1.6861 -1.1810 -1.1810 -0.4544 -0.4544 -0.3817 -0.3817 0.6012 0.6012 4.7877 4.7877 5.5036 5.5036 5.9746 5.9746 6.7289 6.7289 9.4519 9.4519 11.5206 11.5206 k =-0.0985 0.1960 0.3122 ( 8917 PWs) bands (ev): -40.5817 -40.5817 -40.5393 -40.5393 -40.4177 -40.4177 -40.2146 -40.2146 -15.5508 -15.5508 -15.1530 -15.1530 -5.3113 -5.3113 -5.0303 -5.0303 -2.0307 -2.0307 -1.6812 -1.6812 -1.1884 -1.1884 -0.4926 -0.4926 -0.4254 -0.4254 0.5991 0.5991 4.7711 4.7711 5.5029 5.5029 5.9275 5.9275 6.6968 6.6968 9.4055 9.4055 11.5020 11.5020 k =-0.1034 0.2058 0.3278 ( 8909 PWs) bands (ev): -40.5810 -40.5810 -40.5396 -40.5396 -40.4173 -40.4173 -40.2146 -40.2146 -15.5457 -15.5457 -15.1464 -15.1464 -5.2998 -5.2998 -5.0134 -5.0134 -2.0310 -2.0310 -1.6766 -1.6766 -1.1977 -1.1977 -0.5304 -0.5304 -0.4674 -0.4674 0.5966 0.5966 4.7522 4.7522 5.5005 5.5005 5.8817 5.8817 6.6664 6.6664 9.3575 9.3575 11.4801 11.4801 k =-0.1083 0.2156 0.3434 ( 8897 PWs) bands (ev): -40.5803 -40.5803 -40.5399 -40.5399 -40.4170 -40.4170 -40.2145 -40.2145 -15.5406 -15.5406 -15.1397 -15.1397 -5.2881 -5.2881 -4.9959 -4.9959 -2.0316 -2.0316 -1.6724 -1.6724 -1.2093 -1.2093 -0.5674 -0.5674 -0.5072 -0.5072 0.5937 0.5937 4.7311 4.7311 5.4962 5.4962 5.8375 5.8375 6.6381 6.6381 9.3083 9.3083 11.4553 11.4553 k =-0.1133 0.2254 0.3590 ( 8891 PWs) bands (ev): -40.5796 -40.5796 -40.5402 -40.5402 -40.4166 -40.4166 -40.2145 -40.2145 -15.5353 -15.5353 -15.1329 -15.1329 -5.2764 -5.2764 -4.9779 -4.9779 -2.0325 -2.0325 -1.6687 -1.6687 -1.2234 -1.2234 -0.6034 -0.6034 -0.5443 -0.5443 0.5904 0.5904 4.7076 4.7076 5.4897 5.4897 5.7952 5.7952 6.6124 6.6124 9.2581 9.2581 11.4282 11.4282 k =-0.1182 0.2352 0.3746 ( 8911 PWs) bands (ev): -40.5789 -40.5789 -40.5405 -40.5405 -40.4162 -40.4162 -40.2144 -40.2144 -15.5300 -15.5300 -15.1260 -15.1260 -5.2646 -5.2646 -4.9595 -4.9595 -2.0336 -2.0336 -1.6655 -1.6655 -1.2401 -1.2401 -0.6380 -0.6380 -0.5785 -0.5785 0.5867 0.5867 4.6818 4.6818 5.4809 5.4809 5.7549 5.7549 6.5895 6.5895 9.2073 9.2073 11.3991 11.3991 k =-0.1231 0.2450 0.3902 ( 8919 PWs) bands (ev): -40.5782 -40.5782 -40.5408 -40.5408 -40.4159 -40.4159 -40.2144 -40.2144 -15.5246 -15.5246 -15.1192 -15.1192 -5.2527 -5.2527 -4.9408 -4.9408 -2.0352 -2.0352 -1.6629 -1.6629 -1.2595 -1.2595 -0.6711 -0.6711 -0.6095 -0.6095 0.5825 0.5825 4.6538 4.6538 5.4696 5.4696 5.7168 5.7168 6.5698 6.5698 9.1561 9.1561 11.3686 11.3686 k =-0.1280 0.2548 0.4058 ( 8911 PWs) bands (ev): -40.5774 -40.5774 -40.5412 -40.5412 -40.4155 -40.4155 -40.2143 -40.2143 -15.5191 -15.5191 -15.1123 -15.1123 -5.2410 -5.2410 -4.9217 -4.9217 -2.0371 -2.0371 -1.6610 -1.6610 -1.2818 -1.2818 -0.7023 -0.7023 -0.6370 -0.6370 0.5779 0.5779 4.6236 4.6236 5.4558 5.4558 5.6810 5.6810 6.5535 6.5535 9.1047 9.1047 11.3372 11.3372 k =-0.1330 0.2646 0.4214 ( 8915 PWs) bands (ev): -40.5766 -40.5766 -40.5415 -40.5415 -40.4151 -40.4151 -40.2143 -40.2143 -15.5137 -15.5137 -15.1054 -15.1054 -5.2294 -5.2294 -4.9023 -4.9023 -2.0395 -2.0395 -1.6598 -1.6598 -1.3067 -1.3067 -0.7315 -0.7315 -0.6612 -0.6612 0.5730 0.5730 4.5915 4.5915 5.4396 5.4396 5.6473 5.6473 6.5407 6.5407 9.0535 9.0535 11.3051 11.3051 k =-0.1379 0.2744 0.4370 ( 8915 PWs) bands (ev): -40.5758 -40.5758 -40.5419 -40.5419 -40.4147 -40.4147 -40.2142 -40.2142 -15.5082 -15.5082 -15.0986 -15.0986 -5.2179 -5.2179 -4.8827 -4.8827 -2.0423 -2.0423 -1.6592 -1.6592 -1.3339 -1.3339 -0.7585 -0.7585 -0.6820 -0.6820 0.5677 0.5677 4.5578 4.5578 5.4209 5.4209 5.6157 5.6157 6.5314 6.5314 9.0028 9.0028 11.2728 11.2728 k =-0.1428 0.2842 0.4526 ( 8913 PWs) bands (ev): -40.5750 -40.5750 -40.5423 -40.5423 -40.4144 -40.4144 -40.2142 -40.2142 -15.5027 -15.5027 -15.0919 -15.0919 -5.2067 -5.2067 -4.8629 -4.8629 -2.0458 -2.0458 -1.6593 -1.6593 -1.3632 -1.3632 -0.7832 -0.7832 -0.6998 -0.6998 0.5620 0.5620 4.5226 4.5226 5.4000 5.4000 5.5860 5.5860 6.5257 6.5257 8.9527 8.9527 11.2407 11.2407 k =-0.1477 0.2940 0.4682 ( 8933 PWs) bands (ev): -40.5742 -40.5742 -40.5428 -40.5428 -40.4140 -40.4140 -40.2141 -40.2141 -15.4973 -15.4973 -15.0853 -15.0853 -5.1959 -5.1959 -4.8430 -4.8430 -2.0499 -2.0499 -1.6600 -1.6600 -1.3942 -1.3942 -0.8055 -0.8055 -0.7147 -0.7147 0.5559 0.5559 4.4864 4.4864 5.3772 5.3772 5.5581 5.5581 6.5233 6.5233 8.9035 8.9035 11.2089 11.2089 k =-0.1527 0.3038 0.4838 ( 8935 PWs) bands (ev): -40.5733 -40.5733 -40.5432 -40.5432 -40.4137 -40.4137 -40.2141 -40.2141 -15.4919 -15.4919 -15.0789 -15.0789 -5.1854 -5.1854 -4.8230 -4.8230 -2.0546 -2.0546 -1.6612 -1.6612 -1.4263 -1.4263 -0.8252 -0.8252 -0.7272 -0.7272 0.5495 0.5495 4.4495 4.4495 5.3526 5.3526 5.5317 5.5317 6.5242 6.5242 8.8555 8.8555 11.1778 11.1778 k =-0.1576 0.3136 0.4994 ( 8931 PWs) bands (ev): -40.5725 -40.5725 -40.5437 -40.5437 -40.4133 -40.4133 -40.2140 -40.2140 -15.4866 -15.4866 -15.0726 -15.0726 -5.1753 -5.1753 -4.8031 -4.8031 -2.0599 -2.0599 -1.6628 -1.6628 -1.4591 -1.4591 -0.8425 -0.8425 -0.7376 -0.7376 0.5427 0.5427 4.4123 4.4123 5.3268 5.3268 5.5065 5.5065 6.5281 6.5281 8.8088 8.8088 11.1476 11.1476 k =-0.1625 0.3234 0.5150 ( 8927 PWs) bands (ev): -40.5716 -40.5716 -40.5441 -40.5441 -40.4130 -40.4130 -40.2140 -40.2140 -15.4814 -15.4814 -15.0665 -15.0665 -5.1657 -5.1657 -4.7831 -4.7831 -2.0660 -2.0660 -1.6647 -1.6647 -1.4922 -1.4922 -0.8574 -0.8574 -0.7463 -0.7463 0.5356 0.5356 4.3751 4.3751 5.2999 5.2999 5.4825 5.4825 6.5348 6.5348 8.7636 8.7636 11.1185 11.1185 k =-0.1674 0.3332 0.5307 ( 8943 PWs) bands (ev): -40.5708 -40.5708 -40.5446 -40.5446 -40.4127 -40.4127 -40.2139 -40.2139 -15.4762 -15.4762 -15.0607 -15.0607 -5.1568 -5.1568 -4.7633 -4.7633 -2.0727 -2.0727 -1.6668 -1.6668 -1.5252 -1.5252 -0.8698 -0.8698 -0.7535 -0.7535 0.5282 0.5282 4.3382 4.3382 5.2724 5.2724 5.4592 5.4592 6.5441 6.5441 8.7202 8.7202 11.0907 11.0907 k =-0.1724 0.3430 0.5463 ( 8943 PWs) bands (ev): -40.5699 -40.5699 -40.5451 -40.5451 -40.4123 -40.4123 -40.2139 -40.2139 -15.4713 -15.4713 -15.0551 -15.0551 -5.1484 -5.1484 -4.7437 -4.7437 -2.0800 -2.0800 -1.6688 -1.6688 -1.5576 -1.5576 -0.8800 -0.8800 -0.7595 -0.7595 0.5206 0.5206 4.3021 4.3021 5.2446 5.2446 5.4366 5.4366 6.5555 6.5555 8.6787 8.6787 11.0644 11.0644 k =-0.1773 0.3528 0.5619 ( 8935 PWs) bands (ev): -40.5690 -40.5690 -40.5457 -40.5457 -40.4120 -40.4120 -40.2139 -40.2139 -15.4664 -15.4664 -15.0497 -15.0497 -5.1407 -5.1407 -4.7242 -4.7242 -2.0878 -2.0878 -1.6707 -1.6707 -1.5892 -1.5892 -0.8882 -0.8882 -0.7647 -0.7647 0.5126 0.5126 4.2671 4.2671 5.2169 5.2169 5.4143 5.4143 6.5690 6.5690 8.6392 8.6392 11.0398 11.0398 k =-0.1822 0.3626 0.5775 ( 8931 PWs) bands (ev): -40.5681 -40.5681 -40.5462 -40.5462 -40.4117 -40.4117 -40.2138 -40.2138 -15.4617 -15.4617 -15.0447 -15.0447 -5.1338 -5.1338 -4.7051 -4.7051 -2.0962 -2.0962 -1.6723 -1.6723 -1.6197 -1.6197 -0.8944 -0.8944 -0.7692 -0.7692 0.5044 0.5044 4.2334 4.2334 5.1896 5.1896 5.3922 5.3922 6.5843 6.5843 8.6020 8.6020 11.0168 11.0168 k =-0.1871 0.3724 0.5931 ( 8919 PWs) bands (ev): -40.5673 -40.5673 -40.5468 -40.5468 -40.4115 -40.4115 -40.2138 -40.2138 -15.4572 -15.4572 -15.0401 -15.0401 -5.1277 -5.1277 -4.6862 -4.6862 -2.1048 -2.1048 -1.6737 -1.6737 -1.6486 -1.6486 -0.8988 -0.8988 -0.7732 -0.7732 0.4959 0.4959 4.2012 4.2012 5.1630 5.1630 5.3701 5.3701 6.6011 6.6011 8.5671 8.5671 10.9957 10.9957 k =-0.1921 0.3822 0.6087 ( 8915 PWs) bands (ev): -40.5664 -40.5664 -40.5474 -40.5474 -40.4112 -40.4112 -40.2137 -40.2137 -15.4529 -15.4529 -15.0357 -15.0357 -5.1224 -5.1224 -4.6678 -4.6678 -2.1137 -2.1137 -1.6787 -1.6787 -1.6717 -1.6717 -0.9017 -0.9017 -0.7769 -0.7769 0.4872 0.4872 4.1710 4.1710 5.1375 5.1375 5.3478 5.3478 6.6192 6.6192 8.5347 8.5347 10.9766 10.9766 k =-0.1970 0.3920 0.6243 ( 8923 PWs) bands (ev): -40.5655 -40.5655 -40.5480 -40.5480 -40.4110 -40.4110 -40.2137 -40.2137 -15.4487 -15.4487 -15.0318 -15.0318 -5.1181 -5.1181 -4.6498 -4.6498 -2.1226 -2.1226 -1.7027 -1.7027 -1.6737 -1.6737 -0.9033 -0.9033 -0.7803 -0.7803 0.4783 0.4783 4.1427 4.1427 5.1131 5.1131 5.3254 5.3254 6.6384 6.6384 8.5048 8.5048 10.9595 10.9595 k =-0.2019 0.4018 0.6399 ( 8923 PWs) bands (ev): -40.5646 -40.5646 -40.5486 -40.5486 -40.4107 -40.4107 -40.2137 -40.2137 -15.4448 -15.4448 -15.0282 -15.0282 -5.1146 -5.1146 -4.6323 -4.6323 -2.1314 -2.1314 -1.7263 -1.7263 -1.6734 -1.6734 -0.9036 -0.9036 -0.7837 -0.7837 0.4692 0.4692 4.1168 4.1168 5.0902 5.0902 5.3025 5.3025 6.6586 6.6586 8.4777 8.4777 10.9444 10.9444 k =-0.2068 0.4116 0.6555 ( 8915 PWs) bands (ev): -40.5638 -40.5638 -40.5492 -40.5492 -40.4105 -40.4105 -40.2137 -40.2137 -15.4412 -15.4412 -15.0251 -15.0251 -5.1122 -5.1122 -4.6154 -4.6154 -2.1399 -2.1399 -1.7480 -1.7480 -1.6723 -1.6723 -0.9028 -0.9028 -0.7871 -0.7871 0.4600 0.4600 4.0932 4.0932 5.0691 5.0691 5.2793 5.2793 6.6796 6.6796 8.4534 8.4534 10.9314 10.9314 k =-0.2118 0.4214 0.6711 ( 8909 PWs) bands (ev): -40.5629 -40.5629 -40.5499 -40.5499 -40.4103 -40.4103 -40.2136 -40.2136 -15.4377 -15.4377 -15.0224 -15.0224 -5.1108 -5.1108 -4.5990 -4.5990 -2.1480 -2.1480 -1.7675 -1.7675 -1.6706 -1.6706 -0.9012 -0.9012 -0.7906 -0.7906 0.4506 0.4506 4.0721 4.0721 5.0498 5.0498 5.2555 5.2555 6.7012 6.7012 8.4320 8.4320 10.9206 10.9206 k =-0.2167 0.4312 0.6867 ( 8901 PWs) bands (ev): -40.5620 -40.5620 -40.5506 -40.5506 -40.4102 -40.4102 -40.2136 -40.2136 -15.4346 -15.4346 -15.0201 -15.0201 -5.1105 -5.1105 -4.5834 -4.5834 -2.1554 -2.1554 -1.7847 -1.7847 -1.6683 -1.6683 -0.8989 -0.8989 -0.7941 -0.7941 0.4410 0.4410 4.0538 4.0538 5.0326 5.0326 5.2313 5.2313 6.7233 6.7233 8.4135 8.4135 10.9119 10.9119 k =-0.2216 0.4410 0.7023 ( 8899 PWs) bands (ev): -40.5612 -40.5612 -40.5513 -40.5513 -40.4100 -40.4100 -40.2136 -40.2136 -15.4317 -15.4317 -15.0183 -15.0183 -5.1112 -5.1112 -4.5684 -4.5684 -2.1621 -2.1621 -1.7996 -1.7996 -1.6653 -1.6653 -0.8959 -0.8959 -0.7979 -0.7979 0.4314 0.4314 4.0381 4.0381 5.0177 5.0177 5.2066 5.2066 6.7458 6.7458 8.3980 8.3980 10.9053 10.9053 k =-0.2265 0.4508 0.7179 ( 8889 PWs) bands (ev): -40.5603 -40.5603 -40.5520 -40.5520 -40.4099 -40.4099 -40.2136 -40.2136 -15.4291 -15.4291 -15.0169 -15.0169 -5.1131 -5.1131 -4.5541 -4.5541 -2.1679 -2.1679 -1.8121 -1.8121 -1.6617 -1.6617 -0.8924 -0.8924 -0.8019 -0.8019 0.4217 0.4217 4.0252 4.0252 5.0051 5.0051 5.1814 5.1814 6.7685 6.7685 8.3856 8.3856 10.9010 10.9010 k =-0.2315 0.4606 0.7336 ( 8885 PWs) bands (ev): -40.5595 -40.5595 -40.5527 -40.5527 -40.4098 -40.4098 -40.2135 -40.2135 -15.4267 -15.4267 -15.0161 -15.0161 -5.1161 -5.1161 -4.5406 -4.5406 -2.1726 -2.1726 -1.8222 -1.8222 -1.6575 -1.6575 -0.8885 -0.8885 -0.8060 -0.8060 0.4119 0.4119 4.0152 4.0152 4.9950 4.9950 5.1557 5.1557 6.7914 6.7914 8.3763 8.3763 10.8987 10.8987 k =-0.2364 0.4704 0.7492 ( 8893 PWs) bands (ev): -40.5587 -40.5587 -40.5534 -40.5534 -40.4098 -40.4098 -40.2135 -40.2135 -15.4247 -15.4247 -15.0157 -15.0157 -5.1202 -5.1202 -4.5279 -4.5279 -2.1763 -2.1763 -1.8298 -1.8298 -1.6528 -1.6528 -0.8843 -0.8843 -0.8104 -0.8104 0.4021 0.4021 4.0079 4.0079 4.9875 4.9875 5.1297 5.1297 6.8143 6.8143 8.3701 8.3701 10.8986 10.8986 k =-0.2413 0.4802 0.7648 ( 8888 PWs) bands (ev): -40.5578 -40.5578 -40.5542 -40.5542 -40.4097 -40.4097 -40.2135 -40.2135 -15.4230 -15.4230 -15.0158 -15.0158 -5.1255 -5.1255 -4.5161 -4.5161 -2.1787 -2.1787 -1.8349 -1.8349 -1.6475 -1.6475 -0.8799 -0.8799 -0.8149 -0.8149 0.3922 0.3922 4.0034 4.0034 4.9827 4.9827 5.1035 5.1035 6.8372 6.8372 8.3672 8.3672 10.9006 10.9006 k =-0.2462 0.4900 0.7804 ( 8884 PWs) bands (ev): -40.5570 -40.5570 -40.5549 -40.5549 -40.4097 -40.4097 -40.2135 -40.2135 -15.4215 -15.4215 -15.0164 -15.0164 -5.1318 -5.1318 -4.5051 -4.5051 -2.1798 -2.1798 -1.8376 -1.8376 -1.6416 -1.6416 -0.8752 -0.8752 -0.8196 -0.8196 0.3823 0.3823 4.0016 4.0016 4.9806 4.9806 5.0772 5.0772 6.8600 6.8600 8.3674 8.3674 10.9046 10.9046 k =-0.2512 0.4998 0.7960 ( 8882 PWs) bands (ev): -40.5562 -40.5562 -40.5557 -40.5557 -40.4097 -40.4097 -40.2135 -40.2135 -15.4204 -15.4204 -15.0175 -15.0175 -5.1394 -5.1394 -4.4950 -4.4950 -2.1796 -2.1796 -1.8379 -1.8379 -1.6352 -1.6352 -0.8705 -0.8705 -0.8244 -0.8244 0.3724 0.3724 4.0023 4.0023 4.9813 4.9813 5.0511 5.0511 6.8825 6.8825 8.3708 8.3708 10.9106 10.9106 k =-0.2561 0.5096 0.8116 ( 8886 PWs) bands (ev): -40.5565 -40.5565 -40.5555 -40.5555 -40.4097 -40.4097 -40.2135 -40.2135 -15.4196 -15.4196 -15.0191 -15.0191 -5.1480 -5.1480 -4.4859 -4.4859 -2.1781 -2.1781 -1.8358 -1.8358 -1.6283 -1.6283 -0.8656 -0.8656 -0.8292 -0.8292 0.3625 0.3625 4.0054 4.0054 4.9846 4.9846 5.0254 5.0254 6.9048 6.9048 8.3773 8.3773 10.9185 10.9185 k =-0.2610 0.5194 0.8272 ( 8894 PWs) bands (ev): -40.5573 -40.5573 -40.5547 -40.5547 -40.4098 -40.4098 -40.2135 -40.2135 -15.4191 -15.4191 -15.0212 -15.0212 -5.1577 -5.1577 -4.4776 -4.4776 -2.1751 -2.1751 -1.8315 -1.8315 -1.6208 -1.6208 -0.8607 -0.8607 -0.8340 -0.8340 0.3526 0.3526 4.0107 4.0107 4.9891 4.9891 5.0020 5.0020 6.9268 6.9268 8.3871 8.3871 10.9283 10.9283 k =-0.2659 0.5292 0.8428 ( 8876 PWs) bands (ev): -40.5581 -40.5581 -40.5539 -40.5539 -40.4098 -40.4098 -40.2135 -40.2135 -15.4189 -15.4189 -15.0237 -15.0237 -5.1685 -5.1685 -4.4703 -4.4703 -2.1708 -2.1708 -1.8249 -1.8249 -1.6128 -1.6128 -0.8557 -0.8557 -0.8386 -0.8386 0.3427 0.3427 4.0179 4.0179 4.9737 4.9737 5.0025 5.0025 6.9484 6.9484 8.4000 8.4000 10.9398 10.9399 k =-0.2709 0.5390 0.8584 ( 8870 PWs) bands (ev): -40.5590 -40.5590 -40.5532 -40.5532 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0268 -15.0268 -5.1803 -5.1803 -4.4639 -4.4639 -2.1652 -2.1652 -1.8163 -1.8163 -1.6042 -1.6042 -0.8508 -0.8508 -0.8430 -0.8430 0.3329 0.3329 4.0266 4.0266 4.9511 4.9511 5.0144 5.0144 6.9696 6.9696 8.4160 8.4160 10.9531 10.9531 k =-0.2709 0.5390 0.8584 ( 8870 PWs) bands (ev): -40.5590 -40.5590 -40.5532 -40.5532 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0268 -15.0268 -5.1803 -5.1803 -4.4639 -4.4639 -2.1652 -2.1652 -1.8163 -1.8163 -1.6042 -1.6042 -0.8508 -0.8508 -0.8430 -0.8430 0.3329 0.3329 4.0266 4.0266 4.9511 4.9511 5.0144 5.0144 6.9696 6.9696 8.4160 8.4160 10.9531 10.9531 k =-0.2639 0.5252 0.8693 ( 8863 PWs) bands (ev): -40.5589 -40.5589 -40.5532 -40.5532 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0267 -15.0267 -5.1810 -5.1810 -4.4652 -4.4652 -2.1648 -2.1648 -1.8158 -1.8158 -1.6044 -1.6044 -0.8495 -0.8495 -0.8412 -0.8412 0.3331 0.3331 4.0253 4.0253 4.9493 4.9493 5.0133 5.0133 6.9687 6.9687 8.4209 8.4209 10.9559 10.9560 k =-0.2570 0.5114 0.8801 ( 8866 PWs) bands (ev): -40.5589 -40.5589 -40.5532 -40.5532 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0266 -15.0266 -5.1829 -5.1829 -4.4691 -4.4691 -2.1635 -2.1635 -1.8145 -1.8145 -1.6049 -1.6049 -0.8456 -0.8456 -0.8360 -0.8360 0.3338 0.3338 4.0215 4.0215 4.9439 4.9439 5.0099 5.0099 6.9662 6.9662 8.4356 8.4356 10.9645 10.9645 k =-0.2501 0.4977 0.8909 ( 8862 PWs) bands (ev): -40.5589 -40.5589 -40.5532 -40.5532 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0264 -15.0264 -5.1862 -5.1862 -4.4756 -4.4756 -2.1613 -2.1613 -1.8122 -1.8122 -1.6058 -1.6058 -0.8391 -0.8391 -0.8273 -0.8273 0.3349 0.3349 4.0151 4.0151 4.9352 4.9352 5.0044 5.0044 6.9620 6.9620 8.4599 8.4599 10.9788 10.9788 k =-0.2432 0.4839 0.9018 ( 8856 PWs) bands (ev): -40.5589 -40.5589 -40.5532 -40.5532 -40.4099 -40.4099 -40.2135 -40.2135 -15.4189 -15.4189 -15.0261 -15.0261 -5.1907 -5.1907 -4.4847 -4.4847 -2.1584 -2.1584 -1.8091 -1.8091 -1.6071 -1.6071 -0.8301 -0.8301 -0.8154 -0.8154 0.3366 0.3366 4.0059 4.0059 4.9237 4.9237 4.9967 4.9967 6.9563 6.9563 8.4933 8.4933 10.9656 10.9985 k =-0.2363 0.4701 0.9126 ( 8858 PWs) bands (ev): -40.5589 -40.5589 -40.5533 -40.5533 -40.4099 -40.4099 -40.2135 -40.2135 -15.4189 -15.4189 -15.0257 -15.0257 -5.1965 -5.1965 -4.4960 -4.4960 -2.1545 -2.1545 -1.8051 -1.8051 -1.6088 -1.6088 -0.8187 -0.8187 -0.8003 -0.8003 0.3387 0.3387 3.9938 3.9938 4.9100 4.9100 4.9869 4.9869 6.9490 6.9490 8.5352 8.5352 10.9688 10.9688 k =-0.2293 0.4563 0.9234 ( 8862 PWs) bands (ev): -40.5588 -40.5588 -40.5533 -40.5533 -40.4099 -40.4099 -40.2135 -40.2135 -15.4188 -15.4188 -15.0252 -15.0252 -5.2033 -5.2033 -4.5096 -4.5096 -2.1499 -2.1499 -1.8004 -1.8004 -1.6108 -1.6108 -0.8049 -0.8049 -0.7824 -0.7824 0.3415 0.3415 3.9786 3.9786 4.8948 4.8948 4.9751 4.9751 6.9404 6.9404 8.5851 8.5851 10.9728 10.9728 k =-0.2224 0.4425 0.9343 ( 8853 PWs) bands (ev): -40.5588 -40.5588 -40.5533 -40.5533 -40.4099 -40.4099 -40.2135 -40.2135 -15.4187 -15.4187 -15.0247 -15.0247 -5.2113 -5.2113 -4.5253 -4.5253 -2.1445 -2.1445 -1.7949 -1.7949 -1.6133 -1.6133 -0.7889 -0.7889 -0.7618 -0.7618 0.3449 0.3449 3.9602 3.9602 4.8789 4.8789 4.9615 4.9615 6.9306 6.9306 8.6422 8.6422 10.9777 10.9777 k =-0.2155 0.4288 0.9451 ( 8858 PWs) bands (ev): -40.5587 -40.5587 -40.5534 -40.5534 -40.4099 -40.4099 -40.2135 -40.2135 -15.4186 -15.4186 -15.0241 -15.0241 -5.2202 -5.2202 -4.5428 -4.5428 -2.1383 -2.1383 -1.7887 -1.7887 -1.6161 -1.6161 -0.7707 -0.7707 -0.7388 -0.7388 0.3491 0.3491 3.9383 3.9383 4.8628 4.8628 4.9461 4.9461 6.9196 6.9196 8.7057 8.7057 10.9835 10.9835 k =-0.2086 0.4150 0.9559 ( 8860 PWs) bands (ev): -40.5587 -40.5587 -40.5534 -40.5534 -40.4099 -40.4099 -40.2135 -40.2135 -15.4185 -15.4185 -15.0234 -15.0234 -5.2301 -5.2301 -4.5620 -4.5620 -2.1314 -2.1314 -1.7819 -1.7819 -1.6192 -1.6192 -0.7505 -0.7505 -0.7137 -0.7137 0.3540 0.3540 3.9131 3.9131 4.8474 4.8474 4.9292 4.9292 6.9076 6.9076 8.7749 8.7749 10.9903 10.9903 k =-0.2016 0.4012 0.9668 ( 8868 PWs) bands (ev): -40.5586 -40.5586 -40.5535 -40.5535 -40.4099 -40.4099 -40.2135 -40.2135 -15.4184 -15.4184 -15.0227 -15.0227 -5.2408 -5.2408 -4.5827 -4.5827 -2.1239 -2.1239 -1.7745 -1.7745 -1.6228 -1.6228 -0.7284 -0.7284 -0.6870 -0.6870 0.3599 0.3599 3.8843 3.8843 4.8332 4.8332 4.9108 4.9108 6.8947 6.8947 8.8488 8.8488 10.9983 10.9983 k =-0.1947 0.3874 0.9776 ( 8870 PWs) bands (ev): -40.5586 -40.5586 -40.5535 -40.5535 -40.4099 -40.4099 -40.2135 -40.2135 -15.4183 -15.4183 -15.0219 -15.0219 -5.2521 -5.2521 -4.6046 -4.6046 -2.1156 -2.1156 -1.7666 -1.7666 -1.6267 -1.6267 -0.7047 -0.7047 -0.6589 -0.6589 0.3668 0.3668 3.8523 3.8523 4.8206 4.8206 4.8911 4.8911 6.8812 6.8812 8.9267 8.9267 11.0074 11.0074 k =-0.1878 0.3736 0.9884 ( 8867 PWs) bands (ev): -40.5585 -40.5585 -40.5536 -40.5536 -40.4099 -40.4099 -40.2135 -40.2135 -15.4182 -15.4182 -15.0210 -15.0210 -5.2641 -5.2641 -4.6275 -4.6275 -2.1068 -2.1068 -1.7583 -1.7583 -1.6309 -1.6309 -0.6795 -0.6795 -0.6299 -0.6299 0.3748 0.3748 3.8172 3.8172 4.8100 4.8100 4.8703 4.8703 6.8670 6.8670 9.0077 9.0077 11.0178 11.0178 k =-0.1809 0.3599 0.9993 ( 8867 PWs) bands (ev): -40.5584 -40.5584 -40.5537 -40.5537 -40.4099 -40.4099 -40.2135 -40.2135 -15.4181 -15.4181 -15.0201 -15.0201 -5.2765 -5.2765 -4.6512 -4.6512 -2.0975 -2.0975 -1.7495 -1.7495 -1.6354 -1.6354 -0.6530 -0.6530 -0.6004 -0.6004 0.3840 0.3840 3.7792 3.7792 4.8015 4.8015 4.8486 4.8486 6.8524 6.8524 9.0909 9.0909 11.0298 11.0298 k =-0.1739 0.3461 1.0101 ( 8869 PWs) bands (ev): -40.5583 -40.5583 -40.5538 -40.5538 -40.4099 -40.4099 -40.2135 -40.2135 -15.4180 -15.4180 -15.0192 -15.0192 -5.2894 -5.2894 -4.6756 -4.6756 -2.0876 -2.0876 -1.7405 -1.7405 -1.6402 -1.6402 -0.6254 -0.6254 -0.5708 -0.5708 0.3945 0.3945 3.7388 3.7388 4.7950 4.7950 4.8263 4.8263 6.8375 6.8375 9.1756 9.1756 11.0433 11.0433 k =-0.1670 0.3323 1.0210 ( 8869 PWs) bands (ev): -40.5582 -40.5582 -40.5538 -40.5538 -40.4099 -40.4099 -40.2135 -40.2135 -15.4178 -15.4178 -15.0182 -15.0182 -5.3024 -5.3024 -4.7003 -4.7003 -2.0773 -2.0773 -1.7312 -1.7312 -1.6453 -1.6453 -0.5969 -0.5969 -0.5414 -0.5414 0.4064 0.4064 3.6965 3.6965 4.7897 4.7897 4.8044 4.8044 6.8223 6.8223 9.2609 9.2609 11.0585 11.0585 k =-0.1601 0.3185 1.0318 ( 8877 PWs) bands (ev): -40.5581 -40.5581 -40.5539 -40.5539 -40.4099 -40.4099 -40.2135 -40.2135 -15.4177 -15.4177 -15.0172 -15.0172 -5.3157 -5.3157 -4.7252 -4.7252 -2.0666 -2.0666 -1.7217 -1.7217 -1.6506 -1.6506 -0.5678 -0.5678 -0.5127 -0.5127 0.4198 0.4198 3.6526 3.6526 4.7767 4.7767 4.7920 4.7920 6.8071 6.8071 9.3460 9.3460 11.0757 11.0757 k =-0.1532 0.3048 1.0426 ( 8871 PWs) bands (ev): -40.5580 -40.5580 -40.5540 -40.5540 -40.4099 -40.4099 -40.2135 -40.2135 -15.4176 -15.4176 -15.0162 -15.0162 -5.3290 -5.3290 -4.7501 -4.7501 -2.0556 -2.0556 -1.7120 -1.7120 -1.6561 -1.6561 -0.5383 -0.5383 -0.4850 -0.4850 0.4347 0.4347 3.6077 3.6077 4.7543 4.7543 4.7907 4.7907 6.7918 6.7918 9.4301 9.4301 11.0949 11.0949 k =-0.1462 0.2910 1.0535 ( 8867 PWs) bands (ev): -40.5579 -40.5579 -40.5541 -40.5541 -40.4099 -40.4099 -40.2135 -40.2135 -15.4175 -15.4175 -15.0151 -15.0151 -5.3422 -5.3422 -4.7749 -4.7749 -2.0444 -2.0444 -1.7024 -1.7024 -1.6617 -1.6617 -0.5086 -0.5086 -0.4585 -0.4585 0.4511 0.4511 3.5623 3.5623 4.7308 4.7308 4.7921 4.7921 6.7766 6.7766 9.5124 9.5124 11.1163 11.1163 k =-0.1393 0.2772 1.0643 ( 8861 PWs) bands (ev): -40.5578 -40.5578 -40.5542 -40.5542 -40.4098 -40.4098 -40.2135 -40.2135 -15.4174 -15.4174 -15.0141 -15.0141 -5.3552 -5.3552 -4.7993 -4.7993 -2.0330 -2.0330 -1.6928 -1.6928 -1.6673 -1.6673 -0.4790 -0.4790 -0.4336 -0.4336 0.4689 0.4689 3.5168 3.5168 4.7074 4.7074 4.7952 4.7952 6.7615 6.7615 9.5922 9.5922 11.1400 11.1400 k =-0.1324 0.2634 1.0751 ( 8869 PWs) bands (ev): -40.5577 -40.5577 -40.5543 -40.5543 -40.4098 -40.4098 -40.2135 -40.2135 -15.4173 -15.4173 -15.0130 -15.0130 -5.3680 -5.3680 -4.8232 -4.8232 -2.0216 -2.0216 -1.6838 -1.6838 -1.6724 -1.6724 -0.4496 -0.4496 -0.4104 -0.4104 0.4881 0.4881 3.4717 3.4717 4.6843 4.6843 4.7998 4.7998 6.7466 6.7466 9.6689 9.6689 11.1661 11.1661 k =-0.1255 0.2496 1.0860 ( 8873 PWs) bands (ev): -40.5576 -40.5576 -40.5544 -40.5544 -40.4098 -40.4098 -40.2135 -40.2135 -15.4172 -15.4172 -15.0120 -15.0120 -5.3805 -5.3805 -4.8464 -4.8464 -2.0101 -2.0101 -1.6809 -1.6809 -1.6716 -1.6716 -0.4208 -0.4208 -0.3890 -0.3890 0.5083 0.5083 3.4274 3.4274 4.6617 4.6617 4.8055 4.8055 6.7320 6.7320 9.7417 9.7417 11.1945 11.1945 k =-0.1185 0.2359 1.0968 ( 8873 PWs) bands (ev): -40.5575 -40.5575 -40.5546 -40.5546 -40.4098 -40.4098 -40.2135 -40.2135 -15.4171 -15.4171 -15.0110 -15.0110 -5.3925 -5.3925 -4.8689 -4.8689 -1.9988 -1.9988 -1.6858 -1.6858 -1.6632 -1.6632 -0.3927 -0.3927 -0.3694 -0.3694 0.5296 0.5296 3.3843 3.3843 4.6397 4.6397 4.8121 4.8121 6.7177 6.7177 9.8102 9.8102 11.2252 11.2252 k =-0.1116 0.2221 1.1076 ( 8869 PWs) bands (ev): -40.5574 -40.5574 -40.5547 -40.5547 -40.4098 -40.4098 -40.2135 -40.2135 -15.4170 -15.4170 -15.0100 -15.0100 -5.4039 -5.4039 -4.8904 -4.8904 -1.9876 -1.9876 -1.6914 -1.6914 -1.6544 -1.6544 -0.3656 -0.3656 -0.3518 -0.3518 0.5514 0.5514 3.3426 3.3426 4.6186 4.6186 4.8196 4.8196 6.7039 6.7039 9.8739 9.8739 11.2580 11.2580 k =-0.1047 0.2083 1.1185 ( 8865 PWs) bands (ev): -40.5572 -40.5572 -40.5548 -40.5548 -40.4098 -40.4098 -40.2135 -40.2135 -15.4170 -15.4170 -15.0090 -15.0090 -5.4148 -5.4148 -4.9109 -4.9109 -1.9768 -1.9768 -1.6969 -1.6969 -1.6458 -1.6458 -0.3396 -0.3396 -0.3360 -0.3360 0.5736 0.5736 3.3027 3.3027 4.5984 4.5984 4.8277 4.8277 6.6904 6.6904 9.9324 9.9324 11.2926 11.2926 k =-0.0978 0.1945 1.1293 ( 8867 PWs) bands (ev): -40.5571 -40.5571 -40.5549 -40.5549 -40.4098 -40.4098 -40.2135 -40.2135 -15.4169 -15.4169 -15.0080 -15.0080 -5.4249 -5.4249 -4.9303 -4.9303 -1.9663 -1.9663 -1.7023 -1.7023 -1.6376 -1.6376 -0.3219 -0.3219 -0.3150 -0.3150 0.5958 0.5958 3.2649 3.2649 4.5794 4.5794 4.8363 4.8363 6.6775 6.6775 9.9856 9.9856 11.3284 11.3284 k =-0.0908 0.1808 1.1402 ( 8873 PWs) bands (ev): -40.5570 -40.5570 -40.5550 -40.5550 -40.4098 -40.4098 -40.2135 -40.2135 -15.4169 -15.4169 -15.0071 -15.0071 -5.4343 -5.4343 -4.9484 -4.9484 -1.9564 -1.9564 -1.7075 -1.7075 -1.6298 -1.6298 -0.3094 -0.3094 -0.2920 -0.2920 0.6176 0.6176 3.2295 3.2295 4.5616 4.5616 4.8451 4.8451 6.6651 6.6651 10.0333 10.0333 11.3651 11.3651 k =-0.0839 0.1670 1.1510 ( 8878 PWs) bands (ev): -40.5568 -40.5568 -40.5552 -40.5552 -40.4098 -40.4098 -40.2135 -40.2135 -15.4169 -15.4169 -15.0062 -15.0062 -5.4429 -5.4429 -4.9652 -4.9652 -1.9471 -1.9471 -1.7124 -1.7124 -1.6226 -1.6226 -0.2984 -0.2984 -0.2708 -0.2708 0.6386 0.6386 3.1966 3.1966 4.5452 4.5452 4.8543 4.8543 6.6533 6.6533 10.0756 10.0756 11.4020 11.4020 k =-0.0770 0.1532 1.1618 ( 8876 PWs) bands (ev): -40.5567 -40.5567 -40.5553 -40.5553 -40.4098 -40.4098 -40.2135 -40.2135 -15.4169 -15.4169 -15.0054 -15.0054 -5.4507 -5.4507 -4.9806 -4.9806 -1.9385 -1.9385 -1.7169 -1.7169 -1.6161 -1.6161 -0.2888 -0.2888 -0.2514 -0.2514 0.6586 0.6586 3.1664 3.1664 4.5302 4.5302 4.8635 4.8635 6.6421 6.6421 10.1126 10.1126 11.4383 11.4383 k =-0.0701 0.1394 1.1727 ( 8872 PWs) bands (ev): -40.5566 -40.5566 -40.5554 -40.5554 -40.4098 -40.4098 -40.2135 -40.2135 -15.4170 -15.4170 -15.0047 -15.0047 -5.4575 -5.4575 -4.9946 -4.9946 -1.9308 -1.9308 -1.7209 -1.7209 -1.6102 -1.6102 -0.2803 -0.2803 -0.2341 -0.2341 0.6771 0.6771 3.1392 3.1392 4.5168 4.5168 4.8727 4.8727 6.6315 6.6315 10.1444 10.1444 11.4733 11.4733 k =-0.0631 0.1256 1.1835 ( 8867 PWs) bands (ev): -40.5564 -40.5564 -40.5556 -40.5556 -40.4098 -40.4098 -40.2135 -40.2135 -15.4170 -15.4170 -15.0040 -15.0040 -5.4633 -5.4633 -5.0070 -5.0070 -1.9241 -1.9241 -1.7245 -1.7245 -1.6051 -1.6051 -0.2729 -0.2729 -0.2190 -0.2190 0.6939 0.6939 3.1151 3.1151 4.5051 4.5051 4.8818 4.8818 6.6216 6.6216 10.1713 10.1713 11.5063 11.5063 k =-0.0631 0.1256 1.1835 ( 8867 PWs) bands (ev): -40.5564 -40.5564 -40.5556 -40.5556 -40.4098 -40.4098 -40.2135 -40.2135 -15.4170 -15.4170 -15.0040 -15.0040 -5.4633 -5.4633 -5.0070 -5.0070 -1.9241 -1.9241 -1.7245 -1.7245 -1.6051 -1.6051 -0.2729 -0.2729 -0.2190 -0.2190 0.6939 0.6939 3.1151 3.1151 4.5051 4.5051 4.8818 4.8818 6.6216 6.6216 10.1713 10.1713 11.5063 11.5063 k =-0.0552 0.1099 1.1835 ( 8864 PWs) bands (ev): -40.5562 -40.5562 -40.5557 -40.5557 -40.4098 -40.4098 -40.2134 -40.2134 -15.4166 -15.4166 -15.0023 -15.0023 -5.4632 -5.4632 -5.0139 -5.0139 -1.9216 -1.9216 -1.7309 -1.7309 -1.6084 -1.6084 -0.2660 -0.2660 -0.2094 -0.2094 0.7057 0.7057 3.0883 3.0883 4.4900 4.4900 4.8964 4.8964 6.6128 6.6128 10.1826 10.1826 11.5348 11.5348 k =-0.0474 0.0942 1.1835 ( 8860 PWs) bands (ev): -40.5560 -40.5560 -40.5559 -40.5559 -40.4097 -40.4097 -40.2134 -40.2134 -15.4162 -15.4162 -15.0009 -15.0009 -5.4632 -5.4632 -5.0199 -5.0199 -1.9192 -1.9192 -1.7367 -1.7367 -1.6113 -1.6113 -0.2601 -0.2601 -0.2011 -0.2011 0.7162 0.7162 3.0650 3.0650 4.4769 4.4769 4.9093 4.9093 6.6052 6.6052 10.1920 10.1920 11.5618 11.5618 k =-0.0395 0.0785 1.1835 ( 8852 PWs) bands (ev): -40.5560 -40.5560 -40.5558 -40.5558 -40.4097 -40.4097 -40.2134 -40.2134 -15.4159 -15.4159 -14.9997 -14.9997 -5.4631 -5.4631 -5.0250 -5.0250 -1.9170 -1.9170 -1.7417 -1.7417 -1.6138 -1.6138 -0.2552 -0.2552 -0.1941 -0.1941 0.7252 0.7252 3.0452 3.0452 4.4657 4.4657 4.9204 4.9204 6.5986 6.5986 10.1995 10.1995 11.5865 11.5865 k =-0.0316 0.0628 1.1835 ( 8860 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4097 -40.4097 -40.2134 -40.2134 -15.4156 -15.4156 -14.9987 -14.9987 -5.4631 -5.4631 -5.0292 -5.0292 -1.9151 -1.9151 -1.7459 -1.7459 -1.6158 -1.6158 -0.2512 -0.2512 -0.1882 -0.1882 0.7326 0.7326 3.0290 3.0290 4.4566 4.4566 4.9295 4.9295 6.5932 6.5932 10.2054 10.2054 11.6082 11.6082 k =-0.0237 0.0471 1.1835 ( 8856 PWs) bands (ev): -40.5562 -40.5562 -40.5556 -40.5556 -40.4096 -40.4096 -40.2134 -40.2134 -15.4154 -15.4154 -14.9979 -14.9979 -5.4630 -5.4630 -5.0324 -5.0324 -1.9135 -1.9135 -1.7493 -1.7493 -1.6173 -1.6173 -0.2481 -0.2481 -0.1837 -0.1837 0.7385 0.7385 3.0163 3.0163 4.4494 4.4494 4.9367 4.9367 6.5890 6.5890 10.2098 10.2098 11.6260 11.6260 k =-0.0158 0.0314 1.1835 ( 8864 PWs) bands (ev): -40.5563 -40.5563 -40.5555 -40.5555 -40.4096 -40.4096 -40.2134 -40.2134 -15.4153 -15.4153 -14.9973 -14.9973 -5.4630 -5.4630 -5.0347 -5.0347 -1.9123 -1.9123 -1.7517 -1.7517 -1.6184 -1.6184 -0.2459 -0.2459 -0.1805 -0.1805 0.7427 0.7427 3.0072 3.0072 4.4443 4.4443 4.9418 4.9418 6.5860 6.5860 10.2128 10.2128 11.6393 11.6393 k =-0.0079 0.0157 1.1835 ( 8868 PWs) bands (ev): -40.5563 -40.5563 -40.5554 -40.5554 -40.4096 -40.4096 -40.2134 -40.2134 -15.4152 -15.4152 -14.9970 -14.9970 -5.4630 -5.4630 -5.0361 -5.0361 -1.9116 -1.9116 -1.7532 -1.7532 -1.6191 -1.6191 -0.2446 -0.2446 -0.1785 -0.1785 0.7453 0.7453 3.0018 3.0018 4.4412 4.4412 4.9449 4.9449 6.5842 6.5842 10.2146 10.2146 11.6476 11.6476 k = 0.0000 0.0000 1.1835 ( 8866 PWs) bands (ev): -40.5563 -40.5563 -40.5554 -40.5554 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9114 -1.9114 -1.7537 -1.7537 -1.6193 -1.6193 -0.2442 -0.2442 -0.1779 -0.1779 0.7461 0.7461 2.9999 2.9999 4.4402 4.4402 4.9460 4.9460 6.5836 6.5836 10.2152 10.2152 11.6504 11.6504 k = 0.0000 0.0000 1.1835 ( 8866 PWs) bands (ev): -40.5563 -40.5563 -40.5554 -40.5554 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9114 -1.9114 -1.7537 -1.7537 -1.6193 -1.6193 -0.2442 -0.2442 -0.1779 -0.1779 0.7461 0.7461 2.9999 2.9999 4.4402 4.4402 4.9460 4.9460 6.5836 6.5836 10.2152 10.2152 11.6504 11.6504 k = 0.0167 0.0084 1.1835 ( 8858 PWs) bands (ev): -40.5563 -40.5563 -40.5554 -40.5554 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9114 -1.9114 -1.7537 -1.7537 -1.6193 -1.6193 -0.2443 -0.2443 -0.1778 -0.1778 0.7461 0.7461 3.0006 3.0006 4.4394 4.4394 4.9460 4.9460 6.5836 6.5836 10.2158 10.2158 11.6518 11.6518 k = 0.0333 0.0168 1.1835 ( 8860 PWs) bands (ev): -40.5563 -40.5563 -40.5554 -40.5554 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9113 -1.9113 -1.7536 -1.7536 -1.6194 -1.6194 -0.2448 -0.2448 -0.1776 -0.1776 0.7460 0.7460 3.0027 3.0027 4.4369 4.4369 4.9460 4.9460 6.5835 6.5835 10.2178 10.2178 11.6560 11.6560 k = 0.0500 0.0251 1.1835 ( 8862 PWs) bands (ev): -40.5563 -40.5563 -40.5554 -40.5554 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9111 -1.9111 -1.7535 -1.7535 -1.6194 -1.6194 -0.2456 -0.2456 -0.1773 -0.1773 0.7458 0.7458 3.0060 3.0060 4.4329 4.4329 4.9461 4.9461 6.5833 6.5833 10.2210 10.2210 11.6630 11.6630 k = 0.0667 0.0335 1.1835 ( 8862 PWs) bands (ev): -40.5563 -40.5563 -40.5555 -40.5555 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9110 -1.9110 -1.7534 -1.7534 -1.6195 -1.6195 -0.2466 -0.2466 -0.1769 -0.1769 0.7456 0.7456 3.0104 3.0104 4.4276 4.4276 4.9463 4.9463 6.5831 6.5831 10.2253 10.2253 11.6726 11.6726 k = 0.0833 0.0419 1.1835 ( 8864 PWs) bands (ev): -40.5563 -40.5563 -40.5555 -40.5555 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9107 -1.9107 -1.7533 -1.7533 -1.6196 -1.6196 -0.2478 -0.2478 -0.1765 -0.1765 0.7453 0.7453 3.0158 3.0158 4.4211 4.4211 4.9464 4.9464 6.5828 6.5828 10.2305 10.2305 11.6849 11.6849 k = 0.1000 0.0503 1.1835 ( 8862 PWs) bands (ev): -40.5563 -40.5563 -40.5555 -40.5555 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9105 -1.9105 -1.7532 -1.7532 -1.6198 -1.6198 -0.2492 -0.2492 -0.1760 -0.1760 0.7450 0.7450 3.0220 3.0220 4.4137 4.4137 4.9466 4.9466 6.5825 6.5825 10.2363 10.2363 11.6995 11.6995 k = 0.1167 0.0586 1.1835 ( 8872 PWs) bands (ev): -40.5562 -40.5562 -40.5555 -40.5555 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9102 -1.9102 -1.7531 -1.7531 -1.6199 -1.6199 -0.2506 -0.2506 -0.1755 -0.1755 0.7447 0.7447 3.0286 3.0286 4.4057 4.4057 4.9468 4.9468 6.5822 6.5822 10.2425 10.2425 11.7164 11.7164 k = 0.1333 0.0670 1.1835 ( 8884 PWs) bands (ev): -40.5562 -40.5562 -40.5556 -40.5556 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9100 -1.9100 -1.7529 -1.7529 -1.6201 -1.6201 -0.2520 -0.2520 -0.1750 -0.1750 0.7443 0.7443 3.0355 3.0355 4.3974 4.3974 4.9470 4.9470 6.5818 6.5818 10.2489 10.2489 11.7351 11.7351 k = 0.1500 0.0754 1.1835 ( 8884 PWs) bands (ev): -40.5562 -40.5562 -40.5556 -40.5556 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9097 -1.9097 -1.7528 -1.7528 -1.6202 -1.6202 -0.2534 -0.2534 -0.1745 -0.1745 0.7440 0.7440 3.0423 3.0423 4.3893 4.3893 4.9472 4.9472 6.5815 6.5815 10.2551 10.2551 11.7551 11.7551 k = 0.1667 0.0838 1.1835 ( 8878 PWs) bands (ev): -40.5562 -40.5562 -40.5556 -40.5556 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9095 -1.9095 -1.7527 -1.7527 -1.6204 -1.6204 -0.2547 -0.2547 -0.1741 -0.1741 0.7437 0.7437 3.0487 3.0487 4.3817 4.3817 4.9473 4.9473 6.5812 6.5812 10.2608 10.2608 11.7759 11.7759 k = 0.1833 0.0921 1.1835 ( 8876 PWs) bands (ev): -40.5561 -40.5561 -40.5556 -40.5556 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9092 -1.9092 -1.7525 -1.7525 -1.6205 -1.6205 -0.2558 -0.2558 -0.1737 -0.1737 0.7434 0.7434 3.0545 3.0545 4.3748 4.3748 4.9475 4.9475 6.5809 6.5809 10.2659 10.2659 11.7964 11.7964 k = 0.2000 0.1005 1.1835 ( 8880 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9091 -1.9091 -1.7524 -1.7524 -1.6206 -1.6206 -0.2568 -0.2568 -0.1734 -0.1734 0.7432 0.7432 3.0593 3.0593 4.3691 4.3691 4.9476 4.9476 6.5807 6.5807 10.2701 10.2701 11.8155 11.8155 k = 0.2167 0.1089 1.1835 ( 8880 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0366 -5.0366 -1.9089 -1.9089 -1.7524 -1.7524 -1.6206 -1.6206 -0.2574 -0.2574 -0.1732 -0.1732 0.7430 0.7430 3.0629 3.0629 4.3649 4.3649 4.9477 4.9477 6.5805 6.5805 10.2732 10.2732 11.8314 11.8314 k = 0.2333 0.1173 1.1835 ( 8886 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0367 -5.0367 -1.9088 -1.9088 -1.7523 -1.7523 -1.6207 -1.6207 -0.2579 -0.2579 -0.1730 -0.1730 0.7429 0.7429 3.0651 3.0651 4.3622 4.3622 4.9478 4.9478 6.5804 6.5804 10.2751 10.2751 11.8421 11.8421 k = 0.2500 0.1256 1.1835 ( 8888 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0367 -5.0367 -1.9088 -1.9088 -1.7523 -1.7523 -1.6207 -1.6207 -0.2580 -0.2580 -0.1730 -0.1730 0.7429 0.7429 3.0658 3.0658 4.3613 4.3613 4.9478 4.9478 6.5804 6.5804 10.2758 10.2758 11.8459 11.8459 k = 0.2500 0.1256 1.1835 ( 8888 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0367 -5.0367 -1.9088 -1.9088 -1.7523 -1.7523 -1.6207 -1.6207 -0.2580 -0.2580 -0.1730 -0.1730 0.7429 0.7429 3.0658 3.0658 4.3613 4.3613 4.9478 4.9478 6.5804 6.5804 10.2758 10.2758 11.8459 11.8459 k = 0.2431 0.1395 1.1726 ( 8884 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4152 -15.4152 -14.9969 -14.9969 -5.4624 -5.4624 -5.0358 -5.0358 -1.9090 -1.9090 -1.7530 -1.7530 -1.6206 -1.6206 -0.2582 -0.2582 -0.1743 -0.1743 0.7415 0.7415 3.0676 3.0676 4.3617 4.3617 4.9484 4.9484 6.5806 6.5806 10.2734 10.2734 11.8431 11.8431 k = 0.2361 0.1533 1.1618 ( 8878 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4152 -15.4152 -14.9970 -14.9970 -5.4608 -5.4608 -5.0332 -5.0332 -1.9097 -1.9097 -1.7551 -1.7551 -1.6202 -1.6202 -0.2588 -0.2588 -0.1783 -0.1783 0.7372 0.7372 3.0728 3.0728 4.3628 4.3628 4.9500 4.9500 6.5812 6.5812 10.2663 10.2663 11.8346 11.8346 k = 0.2292 0.1671 1.1509 ( 8878 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4152 -15.4152 -14.9972 -14.9972 -5.4580 -5.4580 -5.0289 -5.0289 -1.9110 -1.9110 -1.7585 -1.7585 -1.6195 -1.6195 -0.2600 -0.2600 -0.1848 -0.1848 0.7301 0.7301 3.0815 3.0815 4.3648 4.3648 4.9528 4.9528 6.5822 6.5822 10.2543 10.2543 11.8208 11.8208 k = 0.2222 0.1809 1.1400 ( 8874 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4153 -15.4153 -14.9975 -14.9975 -5.4542 -5.4542 -5.0229 -5.0229 -1.9128 -1.9128 -1.7632 -1.7632 -1.6185 -1.6185 -0.2617 -0.2617 -0.1939 -0.1939 0.7204 0.7204 3.0937 3.0937 4.3674 4.3674 4.9567 4.9567 6.5836 6.5836 10.2375 10.2375 11.8017 11.8017 k = 0.2153 0.1947 1.1292 ( 8866 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4154 -15.4154 -14.9978 -14.9978 -5.4493 -5.4493 -5.0153 -5.0153 -1.9151 -1.9151 -1.7691 -1.7691 -1.6172 -1.6172 -0.2641 -0.2641 -0.2055 -0.2055 0.7083 0.7083 3.1092 3.1092 4.3707 4.3707 4.9618 4.9618 6.5853 6.5853 10.2158 10.2158 11.7778 11.7778 k = 0.2083 0.2085 1.1183 ( 8862 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4155 -15.4155 -14.9983 -14.9983 -5.4434 -5.4434 -5.0060 -5.0060 -1.9179 -1.9179 -1.7763 -1.7763 -1.6156 -1.6156 -0.2673 -0.2673 -0.2195 -0.2195 0.6939 0.6939 3.1280 3.1280 4.3744 4.3744 4.9683 4.9683 6.5875 6.5875 10.1891 10.1891 11.7494 11.7494 k = 0.2014 0.2224 1.1074 ( 8864 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4156 -15.4156 -14.9987 -14.9987 -5.4365 -5.4365 -4.9951 -4.9951 -1.9212 -1.9212 -1.7845 -1.7845 -1.6138 -1.6138 -0.2715 -0.2715 -0.2358 -0.2358 0.6775 0.6775 3.1501 3.1501 4.3785 4.3785 4.9762 4.9762 6.5900 6.5900 10.1572 10.1572 11.7169 11.7169 k = 0.1944 0.2362 1.0966 ( 8874 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4158 -15.4158 -14.9993 -14.9993 -5.4286 -5.4286 -4.9827 -4.9827 -1.9249 -1.9249 -1.7936 -1.7936 -1.6116 -1.6116 -0.2768 -0.2768 -0.2542 -0.2542 0.6594 0.6594 3.1754 3.1754 4.3828 4.3828 4.9856 4.9856 6.5929 6.5929 10.1203 10.1203 11.6805 11.6805 k = 0.1875 0.2500 1.0857 ( 8870 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4159 -15.4159 -14.9999 -14.9999 -5.4198 -5.4198 -4.9688 -4.9688 -1.9290 -1.9290 -1.8037 -1.8037 -1.6092 -1.6092 -0.2835 -0.2835 -0.2747 -0.2747 0.6400 0.6400 3.2037 3.2037 4.3871 4.3871 4.9966 4.9966 6.5961 6.5961 10.0781 10.0781 11.6407 11.6407 k = 0.1806 0.2638 1.0748 ( 8864 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4161 -15.4161 -15.0005 -15.0005 -5.4101 -5.4101 -4.9535 -4.9535 -1.9335 -1.9335 -1.8146 -1.8146 -1.6066 -1.6066 -0.2971 -0.2971 -0.2917 -0.2917 0.6196 0.6196 3.2350 3.2350 4.3914 4.3914 5.0094 5.0094 6.5997 6.5997 10.0306 10.0306 11.5976 11.5976 k = 0.1736 0.2776 1.0640 ( 8868 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4163 -15.4163 -15.0012 -15.0012 -5.3997 -5.3997 -4.9369 -4.9369 -1.9383 -1.9383 -1.8261 -1.8261 -1.6038 -1.6038 -0.3211 -0.3211 -0.3016 -0.3016 0.5986 0.5986 3.2691 3.2691 4.3953 4.3953 5.0240 5.0240 6.6035 6.6035 9.9781 9.9781 11.5517 11.5517 k = 0.1667 0.2915 1.0531 ( 8880 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4165 -15.4165 -15.0020 -15.0020 -5.3884 -5.3884 -4.9191 -4.9191 -1.9435 -1.9435 -1.8382 -1.8382 -1.6008 -1.6008 -0.3467 -0.3467 -0.3135 -0.3135 0.5775 0.5775 3.3058 3.3058 4.3988 4.3988 5.0405 5.0405 6.6077 6.6077 9.9205 9.9205 11.5031 11.5031 k = 0.1597 0.3053 1.0422 ( 8878 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4167 -15.4167 -15.0028 -15.0028 -5.3766 -5.3766 -4.9001 -4.9001 -1.9489 -1.9489 -1.8508 -1.8508 -1.5977 -1.5977 -0.3736 -0.3736 -0.3274 -0.3274 0.5564 0.5564 3.3451 3.3451 4.4018 4.4018 5.0588 5.0588 6.6122 6.6122 9.8580 9.8580 11.4522 11.4522 k = 0.1528 0.3191 1.0314 ( 8886 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4170 -15.4170 -15.0036 -15.0036 -5.3641 -5.3641 -4.8800 -4.8800 -1.9545 -1.9545 -1.8637 -1.8637 -1.5945 -1.5945 -0.4016 -0.4016 -0.3435 -0.3435 0.5359 0.5359 3.3866 3.3866 4.4042 4.4042 5.0791 5.0791 6.6171 6.6171 9.7910 9.7910 11.3993 11.3993 k = 0.1458 0.3329 1.0205 ( 8884 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2134 -40.2134 -15.4172 -15.4172 -15.0044 -15.0044 -5.3511 -5.3511 -4.8590 -4.8590 -1.9603 -1.9603 -1.8768 -1.8768 -1.5911 -1.5911 -0.4305 -0.4305 -0.3619 -0.3619 0.5162 0.5162 3.4302 3.4302 4.4058 4.4058 5.1012 5.1012 6.6222 6.6222 9.7198 9.7198 11.3447 11.3447 k = 0.1389 0.3467 1.0096 ( 8880 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2134 -40.2134 -15.4174 -15.4174 -15.0053 -15.0053 -5.3376 -5.3376 -4.8373 -4.8373 -1.9662 -1.9662 -1.8900 -1.8900 -1.5877 -1.5877 -0.4601 -0.4601 -0.3825 -0.3825 0.4976 0.4976 3.4756 3.4756 4.4068 4.4068 5.1251 5.1251 6.6276 6.6276 9.6449 9.6449 11.2887 11.2887 k = 0.1319 0.3605 0.9988 ( 8884 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2134 -40.2134 -15.4177 -15.4177 -15.0062 -15.0062 -5.3238 -5.3238 -4.8148 -4.8148 -1.9722 -1.9722 -1.9033 -1.9033 -1.5843 -1.5843 -0.4902 -0.4902 -0.4052 -0.4052 0.4803 0.4803 3.5227 3.5227 4.4070 4.4070 5.1505 5.1505 6.6333 6.6333 9.5667 9.5667 11.2316 11.2316 k = 0.1250 0.3744 0.9879 ( 8890 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4179 -15.4179 -15.0071 -15.0071 -5.3098 -5.3098 -4.7918 -4.7918 -1.9782 -1.9782 -1.9165 -1.9165 -1.5809 -1.5809 -0.5205 -0.5205 -0.4300 -0.4300 0.4644 0.4644 3.5711 3.5711 4.4066 4.4066 5.1774 5.1774 6.6393 6.6393 9.4858 9.4858 11.1738 11.1738 k = 0.1181 0.3882 0.9770 ( 8890 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4181 -15.4181 -15.0080 -15.0080 -5.2956 -5.2956 -4.7685 -4.7685 -1.9842 -1.9842 -1.9294 -1.9294 -1.5776 -1.5776 -0.5508 -0.5508 -0.4567 -0.4567 0.4501 0.4501 3.6205 3.6205 4.4055 4.4055 5.2055 5.2055 6.6456 6.6456 9.4029 9.4029 11.1158 11.1158 k = 0.1111 0.4020 0.9661 ( 8892 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4184 -15.4184 -15.0088 -15.0088 -5.2814 -5.2814 -4.7450 -4.7450 -1.9901 -1.9901 -1.9422 -1.9422 -1.5743 -1.5743 -0.5809 -0.5809 -0.4848 -0.4848 0.4372 0.4372 3.6706 3.6706 4.4038 4.4038 5.2345 5.2345 6.6522 6.6522 9.3186 9.3186 11.0577 11.0577 k = 0.1042 0.4158 0.9553 ( 8888 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4186 -15.4186 -15.0097 -15.0097 -5.2673 -5.2673 -4.7214 -4.7214 -1.9960 -1.9960 -1.9545 -1.9545 -1.5711 -1.5711 -0.6105 -0.6105 -0.5142 -0.5142 0.4259 0.4259 3.7210 3.7210 4.4016 4.4016 5.2641 5.2641 6.6590 6.6590 9.2335 9.2335 11.0002 11.0002 k = 0.0972 0.4296 0.9444 ( 8880 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4188 -15.4188 -15.0106 -15.0106 -5.2533 -5.2533 -4.6980 -4.6980 -2.0016 -2.0016 -1.9665 -1.9665 -1.5681 -1.5681 -0.6394 -0.6394 -0.5444 -0.5444 0.4160 0.4160 3.7715 3.7715 4.3989 4.3989 5.2942 5.2942 6.6662 6.6662 9.1485 9.1485 10.9435 10.9435 k = 0.0903 0.4435 0.9335 ( 8880 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4191 -15.4191 -15.0114 -15.0114 -5.2397 -5.2397 -4.6750 -4.6750 -2.0071 -2.0071 -1.9779 -1.9779 -1.5652 -1.5652 -0.6673 -0.6673 -0.5749 -0.5749 0.4074 0.4074 3.8214 3.8214 4.3960 4.3960 5.3243 5.3243 6.6736 6.6736 9.0642 9.0642 10.8882 10.8882 k = 0.0833 0.4573 0.9227 ( 8882 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4193 -15.4193 -15.0122 -15.0122 -5.2264 -5.2264 -4.6525 -4.6525 -2.0124 -2.0124 -1.9888 -1.9888 -1.5625 -1.5625 -0.6942 -0.6942 -0.6055 -0.6055 0.4001 0.4001 3.8706 3.8706 4.3928 4.3928 5.3541 5.3541 6.6812 6.6812 8.9815 8.9815 10.8346 10.8346 k = 0.0764 0.4711 0.9118 ( 8878 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4195 -15.4195 -15.0129 -15.0129 -5.2137 -5.2137 -4.6308 -4.6308 -2.0173 -2.0173 -1.9990 -1.9990 -1.5601 -1.5601 -0.7196 -0.7196 -0.6355 -0.6355 0.3939 0.3939 3.9183 3.9183 4.3895 4.3895 5.3832 5.3832 6.6891 6.6891 8.9009 8.9009 10.7832 10.7832 k = 0.0694 0.4849 0.9009 ( 8878 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4197 -15.4197 -15.0136 -15.0136 -5.2016 -5.2016 -4.6100 -4.6100 -2.0220 -2.0220 -2.0086 -2.0086 -1.5578 -1.5578 -0.7436 -0.7436 -0.6647 -0.6647 0.3886 0.3886 3.9643 3.9643 4.3861 4.3861 5.4114 5.4114 6.6970 6.6970 8.8235 8.8235 10.7344 10.7344 k = 0.0625 0.4987 0.8901 ( 8870 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4198 -15.4198 -15.0142 -15.0142 -5.1903 -5.1903 -4.5904 -4.5904 -2.0263 -2.0263 -2.0174 -2.0174 -1.5558 -1.5558 -0.7658 -0.7658 -0.6925 -0.6925 0.3842 0.3842 4.0080 4.0080 4.3828 4.3828 5.4382 5.4382 6.7050 6.7050 8.7499 8.7499 10.6887 10.6887 k = 0.0556 0.5125 0.8792 ( 8872 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4200 -15.4200 -15.0148 -15.0148 -5.1798 -5.1798 -4.5722 -4.5722 -2.0303 -2.0303 -2.0254 -2.0254 -1.5540 -1.5540 -0.7861 -0.7861 -0.7186 -0.7186 0.3806 0.3806 4.0489 4.0489 4.3795 4.3795 5.4633 5.4633 6.7129 6.7129 8.6810 8.6810 10.6464 10.6464 k = 0.0486 0.5264 0.8683 ( 8860 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4202 -15.4202 -15.0154 -15.0154 -5.1703 -5.1703 -4.5556 -4.5556 -2.0339 -2.0339 -2.0325 -2.0325 -1.5525 -1.5525 -0.8044 -0.8044 -0.7426 -0.7426 0.3776 0.3776 4.0865 4.0865 4.3765 4.3765 5.4864 5.4864 6.7206 6.7206 8.6175 8.6175 10.6081 10.6081 k = 0.0417 0.5402 0.8575 ( 8866 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4203 -15.4203 -15.0159 -15.0159 -5.1619 -5.1619 -4.5408 -4.5408 -2.0388 -2.0388 -2.0370 -2.0370 -1.5512 -1.5512 -0.8205 -0.8205 -0.7641 -0.7641 0.3752 0.3752 4.1203 4.1203 4.3738 4.3738 5.5071 5.5071 6.7279 6.7279 8.5604 8.5604 10.5739 10.5739 k = 0.0347 0.5540 0.8466 ( 8862 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4204 -15.4204 -15.0163 -15.0163 -5.1546 -5.1546 -4.5279 -4.5279 -2.0442 -2.0442 -2.0397 -2.0397 -1.5502 -1.5502 -0.8343 -0.8343 -0.7829 -0.7829 0.3732 0.3732 4.1498 4.1498 4.3713 4.3713 5.5252 5.5252 6.7347 6.7347 8.5104 8.5104 10.5444 10.5444 k = 0.0278 0.5678 0.8357 ( 8866 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4205 -15.4205 -15.0166 -15.0166 -5.1485 -5.1485 -4.5171 -4.5171 -2.0487 -2.0487 -2.0419 -2.0419 -1.5493 -1.5493 -0.8458 -0.8458 -0.7986 -0.7986 0.3717 0.3717 4.1747 4.1747 4.3693 4.3693 5.5404 5.5404 6.7406 6.7406 8.4682 8.4682 10.5198 10.5198 k = 0.0208 0.5816 0.8249 ( 8868 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4206 -15.4206 -15.0169 -15.0169 -5.1437 -5.1437 -4.5086 -4.5086 -2.0521 -2.0521 -2.0437 -2.0437 -1.5487 -1.5487 -0.8547 -0.8547 -0.8111 -0.8111 0.3706 0.3706 4.1944 4.1944 4.3676 4.3676 5.5525 5.5525 6.7455 6.7455 8.4346 8.4346 10.5004 10.5004 k = 0.0139 0.5955 0.8140 ( 8874 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4206 -15.4206 -15.0170 -15.0170 -5.1403 -5.1403 -4.5024 -4.5024 -2.0546 -2.0546 -2.0449 -2.0449 -1.5482 -1.5482 -0.8612 -0.8612 -0.8202 -0.8202 0.3699 0.3699 4.2087 4.2087 4.3664 4.3664 5.5612 5.5612 6.7492 6.7492 8.4102 8.4102 10.4864 10.4864 k = 0.0069 0.6093 0.8031 ( 8878 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4206 -15.4206 -15.0172 -15.0172 -5.1382 -5.1382 -4.4986 -4.4986 -2.0561 -2.0561 -2.0457 -2.0457 -1.5480 -1.5480 -0.8651 -0.8651 -0.8257 -0.8257 0.3694 0.3694 4.2175 4.2175 4.3657 4.3657 5.5665 5.5665 6.7514 6.7514 8.3953 8.3953 10.4779 10.4779 k = 0.0000 0.6231 0.7923 ( 8880 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4207 -15.4207 -15.0172 -15.0172 -5.1375 -5.1375 -4.4974 -4.4974 -2.0566 -2.0566 -2.0459 -2.0459 -1.5479 -1.5479 -0.8664 -0.8664 -0.8275 -0.8275 0.3693 0.3693 4.2204 4.2204 4.3654 4.3654 5.5683 5.5683 6.7522 6.7522 8.3903 8.3903 10.4751 10.4751 k = 0.0000 0.6231 0.7923 ( 8880 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2135 -40.2135 -15.4207 -15.4207 -15.0172 -15.0172 -5.1375 -5.1375 -4.4974 -4.4974 -2.0566 -2.0566 -2.0459 -2.0459 -1.5479 -1.5479 -0.8664 -0.8664 -0.8275 -0.8275 0.3693 0.3693 4.2204 4.2204 4.3654 4.3654 5.5683 5.5683 6.7522 6.7522 8.3903 8.3903 10.4751 10.4751 k = 0.0169 0.6284 0.7881 ( 8877 PWs) bands (ev): -40.5562 -40.5562 -40.5557 -40.5557 -40.4097 -40.4097 -40.2135 -40.2135 -15.4206 -15.4206 -15.0173 -15.0173 -5.1377 -5.1377 -4.4972 -4.4972 -2.0668 -2.0668 -2.0351 -2.0351 -1.5483 -1.5483 -0.8663 -0.8663 -0.8276 -0.8276 0.3691 0.3691 4.2142 4.2142 4.3733 4.3733 5.5647 5.5647 6.7543 6.7543 8.3904 8.3904 10.4773 10.4773 k = 0.0339 0.6336 0.7840 ( 8867 PWs) bands (ev): -40.5563 -40.5563 -40.5556 -40.5556 -40.4097 -40.4097 -40.2135 -40.2135 -15.4206 -15.4206 -15.0174 -15.0174 -5.1385 -5.1385 -4.4965 -4.4965 -2.0800 -2.0800 -2.0195 -2.0195 -1.5497 -1.5497 -0.8661 -0.8661 -0.8278 -0.8278 0.3684 0.3684 4.1987 4.1987 4.3940 4.3940 5.5541 5.5541 6.7606 6.7606 8.3904 8.3904 10.4839 10.4839 k = 0.0508 0.6389 0.7799 ( 8872 PWs) bands (ev): -40.5565 -40.5565 -40.5555 -40.5555 -40.4097 -40.4097 -40.2135 -40.2135 -15.4205 -15.4205 -15.0176 -15.0176 -5.1397 -5.1397 -4.4953 -4.4953 -2.0927 -2.0927 -2.0031 -2.0031 -1.5519 -1.5519 -0.8658 -0.8658 -0.8281 -0.8281 0.3674 0.3674 4.1789 4.1789 4.4225 4.4225 5.5368 5.5368 6.7706 6.7706 8.3906 8.3906 10.4949 10.4949 k = 0.0677 0.6441 0.7757 ( 8866 PWs) bands (ev): -40.5567 -40.5567 -40.5553 -40.5553 -40.4097 -40.4097 -40.2135 -40.2135 -15.4204 -15.4204 -15.0180 -15.0180 -5.1414 -5.1414 -4.4938 -4.4938 -2.1046 -2.1046 -1.9861 -1.9861 -1.5550 -1.5550 -0.8654 -0.8654 -0.8286 -0.8286 0.3661 0.3661 4.1577 4.1577 4.4556 4.4556 5.5134 5.5134 6.7838 6.7838 8.3908 8.3908 10.5102 10.5102 k = 0.0846 0.6494 0.7716 ( 8868 PWs) bands (ev): -40.5568 -40.5568 -40.5551 -40.5551 -40.4097 -40.4097 -40.2135 -40.2135 -15.4203 -15.4203 -15.0184 -15.0184 -5.1435 -5.1435 -4.4919 -4.4919 -2.1155 -2.1155 -1.9687 -1.9687 -1.5588 -1.5588 -0.8648 -0.8648 -0.8292 -0.8292 0.3643 0.3643 4.1368 4.1368 4.4920 4.4920 5.4844 5.4844 6.7996 6.7996 8.3911 8.3911 10.5296 10.5296 k = 0.1016 0.6546 0.7675 ( 8868 PWs) bands (ev): -40.5570 -40.5570 -40.5550 -40.5550 -40.4097 -40.4097 -40.2135 -40.2135 -15.4201 -15.4201 -15.0189 -15.0189 -5.1460 -5.1460 -4.4896 -4.4896 -2.1255 -2.1255 -1.9510 -1.9510 -1.5633 -1.5633 -0.8641 -0.8641 -0.8300 -0.8300 0.3622 0.3622 4.1170 4.1170 4.5306 4.5306 5.4507 5.4507 6.8174 6.8174 8.3916 8.3916 10.5531 10.5531 k = 0.1185 0.6599 0.7633 ( 8862 PWs) bands (ev): -40.5572 -40.5572 -40.5548 -40.5548 -40.4097 -40.4097 -40.2135 -40.2135 -15.4200 -15.4200 -15.0195 -15.0195 -5.1488 -5.1488 -4.4871 -4.4871 -2.1344 -2.1344 -1.9333 -1.9333 -1.5685 -1.5685 -0.8633 -0.8633 -0.8308 -0.8308 0.3599 0.3599 4.0986 4.0986 4.5711 4.5711 5.4128 5.4128 6.8363 6.8363 8.3924 8.3924 10.5804 10.5804 k = 0.1354 0.6651 0.7592 ( 8860 PWs) bands (ev): -40.5574 -40.5574 -40.5546 -40.5546 -40.4097 -40.4097 -40.2135 -40.2135 -15.4198 -15.4198 -15.0201 -15.0201 -5.1519 -5.1519 -4.4844 -4.4844 -2.1422 -2.1422 -1.9156 -1.9156 -1.5742 -1.5742 -0.8624 -0.8624 -0.8318 -0.8318 0.3572 0.3572 4.0820 4.0820 4.6132 4.6132 5.3716 5.3716 6.8557 6.8557 8.3934 8.3934 10.6113 10.6113 k = 0.1524 0.6704 0.7551 ( 8863 PWs) bands (ev): -40.5575 -40.5575 -40.5545 -40.5545 -40.4098 -40.4098 -40.2135 -40.2135 -15.4196 -15.4196 -15.0208 -15.0208 -5.1552 -5.1552 -4.4815 -4.4815 -2.1490 -2.1490 -1.8982 -1.8982 -1.5801 -1.5801 -0.8613 -0.8613 -0.8329 -0.8329 0.3543 0.3543 4.0673 4.0673 4.6565 4.6565 5.3276 5.3276 6.8751 6.8751 8.3947 8.3947 10.6456 10.6456 k = 0.1693 0.6757 0.7509 ( 8861 PWs) bands (ev): -40.5577 -40.5577 -40.5543 -40.5543 -40.4098 -40.4098 -40.2135 -40.2135 -15.4195 -15.4195 -15.0216 -15.0216 -5.1588 -5.1588 -4.4786 -4.4786 -2.1547 -2.1547 -1.8814 -1.8814 -1.5861 -1.5861 -0.8601 -0.8601 -0.8342 -0.8342 0.3513 0.3513 4.0547 4.0547 4.7008 4.7008 5.2815 5.2815 6.8937 6.8937 8.3964 8.3964 10.6831 10.6831 k = 0.1862 0.6809 0.7468 ( 8862 PWs) bands (ev): -40.5579 -40.5579 -40.5541 -40.5541 -40.4098 -40.4098 -40.2135 -40.2135 -15.4193 -15.4193 -15.0224 -15.0224 -5.1624 -5.1624 -4.4757 -4.4757 -2.1593 -2.1593 -1.8655 -1.8655 -1.5920 -1.5920 -0.8588 -0.8588 -0.8355 -0.8355 0.3482 0.3482 4.0443 4.0443 4.7461 4.7461 5.2337 5.2337 6.9113 6.9113 8.3985 8.3985 10.7234 10.7234 k = 0.2032 0.6862 0.7427 ( 8872 PWs) bands (ev): -40.5581 -40.5581 -40.5539 -40.5539 -40.4098 -40.4098 -40.2135 -40.2135 -15.4192 -15.4192 -15.0233 -15.0233 -5.1661 -5.1661 -4.4729 -4.4729 -2.1627 -2.1627 -1.8510 -1.8510 -1.5973 -1.5973 -0.8573 -0.8573 -0.8369 -0.8369 0.3450 0.3450 4.0360 4.0360 4.7920 4.7920 5.1849 5.1849 6.9272 6.9272 8.4011 8.4011 10.7663 10.7663 k = 0.2201 0.6914 0.7385 ( 8865 PWs) bands (ev): -40.5583 -40.5583 -40.5538 -40.5538 -40.4098 -40.4098 -40.2135 -40.2135 -15.4191 -15.4191 -15.0241 -15.0241 -5.1698 -5.1698 -4.4702 -4.4702 -2.1650 -2.1650 -1.8383 -1.8383 -1.6017 -1.6017 -0.8557 -0.8557 -0.8385 -0.8385 0.3418 0.3418 4.0301 4.0301 4.8382 4.8382 5.1356 5.1356 6.9413 6.9413 8.4041 8.4041 10.8114 10.8114 k = 0.2370 0.6967 0.7344 ( 8869 PWs) bands (ev): -40.5585 -40.5585 -40.5536 -40.5536 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0250 -15.0250 -5.1734 -5.1734 -4.4678 -4.4678 -2.1662 -2.1662 -1.8279 -1.8279 -1.6045 -1.6045 -0.8540 -0.8540 -0.8400 -0.8400 0.3386 0.3386 4.0265 4.0265 4.8841 4.8841 5.0867 5.0867 6.9532 6.9532 8.4076 8.4076 10.8584 10.8584 k = 0.2539 0.7019 0.7303 ( 8870 PWs) bands (ev): -40.5587 -40.5587 -40.5534 -40.5534 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0259 -15.0259 -5.1769 -5.1769 -4.4656 -4.4656 -2.1663 -2.1663 -1.8204 -1.8204 -1.6055 -1.6055 -0.8523 -0.8523 -0.8416 -0.8416 0.3357 0.3357 4.0253 4.0253 4.9275 4.9275 5.0405 5.0405 6.9627 6.9627 8.4115 8.4115 10.9069 10.9069 k = 0.2709 0.7072 0.7261 ( 8870 PWs) bands (ev): -40.5590 -40.5590 -40.5532 -40.5532 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0268 -15.0268 -5.1803 -5.1803 -4.4639 -4.4639 -2.1652 -2.1652 -1.8163 -1.8163 -1.6042 -1.6042 -0.8508 -0.8508 -0.8430 -0.8430 0.3329 0.3329 4.0266 4.0266 4.9511 4.9511 5.0144 5.0144 6.9696 6.9696 8.4160 8.4160 10.9531 10.9531 k = 0.2709 0.7072 0.7261 ( 8870 PWs) bands (ev): -40.5590 -40.5590 -40.5532 -40.5532 -40.4099 -40.4099 -40.2135 -40.2135 -15.4190 -15.4190 -15.0268 -15.0268 -5.1803 -5.1803 -4.4639 -4.4639 -2.1652 -2.1652 -1.8163 -1.8163 -1.6042 -1.6042 -0.8508 -0.8508 -0.8430 -0.8430 0.3329 0.3329 4.0266 4.0266 4.9511 4.9511 5.0144 5.0144 6.9696 6.9696 8.4160 8.4160 10.9531 10.9531 k = 0.2757 0.6975 0.7107 ( 8870 PWs) bands (ev): -40.5598 -40.5598 -40.5525 -40.5525 -40.4100 -40.4100 -40.2136 -40.2136 -15.4194 -15.4194 -15.0302 -15.0302 -5.1930 -5.1930 -4.4584 -4.4584 -2.1584 -2.1584 -1.8058 -1.8058 -1.5951 -1.5951 -0.8470 -0.8470 -0.8457 -0.8457 0.3232 0.3232 4.0362 4.0362 4.9301 4.9301 5.0295 5.0295 6.9900 6.9900 8.4348 8.4348 10.9677 10.9678 k = 0.2806 0.6878 0.6952 ( 8866 PWs) bands (ev): -40.5606 -40.5606 -40.5518 -40.5518 -40.4102 -40.4102 -40.2136 -40.2136 -15.4201 -15.4201 -15.0341 -15.0341 -5.2066 -5.2066 -4.4539 -4.4539 -2.1503 -2.1503 -1.7937 -1.7937 -1.5853 -1.5853 -0.8503 -0.8503 -0.8408 -0.8408 0.3136 0.3136 4.0463 4.0463 4.9113 4.9113 5.0476 5.0476 7.0100 7.0100 8.4566 8.4566 10.9839 10.9839 k = 0.2855 0.6781 0.6798 ( 8866 PWs) bands (ev): -40.5614 -40.5614 -40.5511 -40.5511 -40.4103 -40.4103 -40.2136 -40.2136 -15.4211 -15.4211 -15.0384 -15.0384 -5.2211 -5.2211 -4.4503 -4.4503 -2.1412 -2.1412 -1.7799 -1.7799 -1.5749 -1.5749 -0.8529 -0.8529 -0.8358 -0.8358 0.3040 0.3040 4.0564 4.0564 4.8953 4.8953 5.0685 5.0685 7.0293 7.0293 8.4812 8.4812 10.9781 11.0014 k = 0.2904 0.6684 0.6643 ( 8854 PWs) bands (ev): -40.5623 -40.5623 -40.5504 -40.5504 -40.4105 -40.4105 -40.2136 -40.2136 -15.4224 -15.4224 -15.0432 -15.0432 -5.2364 -5.2364 -4.4476 -4.4476 -2.1310 -2.1310 -1.7649 -1.7649 -1.5637 -1.5637 -0.8546 -0.8546 -0.8308 -0.8308 0.2945 0.2945 4.0657 4.0657 4.8830 4.8830 5.0923 5.0923 7.0482 7.0482 8.5087 8.5087 10.9886 11.0202 k = 0.2952 0.6587 0.6489 ( 8860 PWs) bands (ev): -40.5631 -40.5631 -40.5498 -40.5498 -40.4107 -40.4107 -40.2136 -40.2136 -15.4239 -15.4239 -15.0483 -15.0483 -5.2526 -5.2526 -4.4457 -4.4457 -2.1200 -2.1200 -1.7488 -1.7488 -1.5516 -1.5516 -0.8550 -0.8550 -0.8257 -0.8257 0.2850 0.2850 4.0734 4.0734 4.8751 4.8751 5.1188 5.1188 7.0664 7.0664 8.5389 8.5389 11.0401 11.0401 k = 0.3001 0.6490 0.6334 ( 8876 PWs) bands (ev): -40.5640 -40.5640 -40.5492 -40.5492 -40.4109 -40.4109 -40.2137 -40.2137 -15.4258 -15.4258 -15.0538 -15.0538 -5.2694 -5.2694 -4.4447 -4.4447 -2.1082 -2.1082 -1.7320 -1.7320 -1.5387 -1.5387 -0.8540 -0.8540 -0.8205 -0.8205 0.2757 0.2757 4.0789 4.0789 4.8722 4.8722 5.1481 5.1481 7.0839 7.0839 8.5717 8.5717 11.0162 11.0610 k = 0.3050 0.6393 0.6180 ( 8872 PWs) bands (ev): -40.5649 -40.5649 -40.5486 -40.5486 -40.4112 -40.4112 -40.2137 -40.2137 -15.4278 -15.4278 -15.0597 -15.0597 -5.2870 -5.2870 -4.4446 -4.4446 -2.0959 -2.0959 -1.7147 -1.7147 -1.5249 -1.5249 -0.8513 -0.8513 -0.8153 -0.8153 0.2664 0.2664 4.0815 4.0815 4.8752 4.8752 5.1800 5.1800 7.1008 7.1008 8.6070 8.6070 11.0334 11.0828 k = 0.3099 0.6296 0.6025 ( 8866 PWs) bands (ev): -40.5657 -40.5657 -40.5480 -40.5480 -40.4114 -40.4114 -40.2137 -40.2137 -15.4301 -15.4301 -15.0659 -15.0659 -5.3051 -5.3051 -4.4452 -4.4452 -2.0831 -2.0831 -1.6973 -1.6973 -1.5099 -1.5099 -0.8466 -0.8466 -0.8099 -0.8099 0.2572 0.2572 4.0806 4.0806 4.8844 4.8844 5.2146 5.2146 7.1170 7.1170 8.6447 8.6447 11.0528 11.1054 k = 0.3147 0.6199 0.5871 ( 8858 PWs) bands (ev): -40.5666 -40.5666 -40.5474 -40.5474 -40.4117 -40.4117 -40.2137 -40.2137 -15.4327 -15.4327 -15.0724 -15.0724 -5.3239 -5.3239 -4.4465 -4.4465 -2.0701 -2.0701 -1.6801 -1.6801 -1.4938 -1.4938 -0.8394 -0.8394 -0.8044 -0.8044 0.2480 0.2480 4.0758 4.0758 4.9002 4.9002 5.2516 5.2516 7.1326 7.1326 8.6847 8.6847 11.0745 11.1285 k = 0.3196 0.6102 0.5716 ( 8858 PWs) bands (ev): -40.5674 -40.5674 -40.5468 -40.5468 -40.4120 -40.4120 -40.2138 -40.2138 -15.4354 -15.4354 -15.0793 -15.0793 -5.3431 -5.3431 -4.4486 -4.4486 -2.0570 -2.0570 -1.6635 -1.6635 -1.4765 -1.4765 -0.8296 -0.8296 -0.7987 -0.7987 0.2390 0.2390 4.0672 4.0672 4.9227 4.9227 5.2910 5.2910 7.1474 7.1474 8.7268 8.7268 11.1521 11.1521 k = 0.3245 0.6005 0.5562 ( 8876 PWs) bands (ev): -40.5683 -40.5683 -40.5463 -40.5463 -40.4123 -40.4123 -40.2138 -40.2138 -15.4384 -15.4384 -15.0863 -15.0863 -5.3627 -5.3627 -4.4514 -4.4514 -2.0440 -2.0440 -1.6479 -1.6479 -1.4579 -1.4579 -0.8168 -0.8168 -0.7927 -0.7927 0.2301 0.2301 4.0548 4.0548 4.9516 4.9516 5.3327 5.3327 7.1616 7.1616 8.7709 8.7709 11.1248 11.1760 k = 0.3294 0.5908 0.5407 ( 8872 PWs) bands (ev): -40.5691 -40.5691 -40.5458 -40.5458 -40.4126 -40.4126 -40.2139 -40.2139 -15.4416 -15.4416 -15.0936 -15.0936 -5.3827 -5.3827 -4.4549 -4.4549 -2.0313 -2.0313 -1.6336 -1.6336 -1.4379 -1.4379 -0.8008 -0.8008 -0.7863 -0.7863 0.2212 0.2212 4.0390 4.0390 4.9867 4.9867 5.3765 5.3765 7.1750 7.1750 8.8169 8.8169 11.1999 11.2000 k = 0.3342 0.5811 0.5253 ( 8880 PWs) bands (ev): -40.5700 -40.5700 -40.5453 -40.5453 -40.4130 -40.4130 -40.2139 -40.2139 -15.4449 -15.4449 -15.1012 -15.1012 -5.4030 -5.4030 -4.4589 -4.4589 -2.0190 -2.0190 -1.6209 -1.6209 -1.4165 -1.4165 -0.7822 -0.7822 -0.7788 -0.7788 0.2125 0.2125 4.0201 4.0201 5.0274 5.0274 5.4224 5.4224 7.1878 7.1878 8.8645 8.8645 11.1841 11.1841 k = 0.3391 0.5714 0.5098 ( 8884 PWs) bands (ev): -40.5708 -40.5708 -40.5448 -40.5448 -40.4133 -40.4133 -40.2139 -40.2139 -15.4484 -15.4484 -15.1089 -15.1089 -5.4235 -5.4235 -4.4635 -4.4635 -2.0074 -2.0074 -1.6100 -1.6100 -1.3938 -1.3938 -0.7731 -0.7731 -0.7578 -0.7578 0.2039 0.2039 3.9986 3.9986 5.0732 5.0732 5.4703 5.4703 7.1998 7.1998 8.9135 8.9135 11.2476 11.2476 k = 0.3440 0.5617 0.4944 ( 8884 PWs) bands (ev): -40.5717 -40.5717 -40.5443 -40.5443 -40.4136 -40.4136 -40.2140 -40.2140 -15.4520 -15.4520 -15.1168 -15.1168 -5.4442 -5.4442 -4.4686 -4.4686 -1.9964 -1.9964 -1.6010 -1.6010 -1.3697 -1.3697 -0.7656 -0.7656 -0.7311 -0.7311 0.1954 0.1954 3.9750 3.9750 5.1237 5.1237 5.5199 5.5199 7.2111 7.2111 8.9639 8.9639 11.2709 11.2709 k = 0.3489 0.5520 0.4789 ( 8884 PWs) bands (ev): -40.5725 -40.5725 -40.5439 -40.5439 -40.4140 -40.4140 -40.2140 -40.2140 -15.4558 -15.4558 -15.1248 -15.1248 -5.4650 -5.4650 -4.4742 -4.4742 -1.9862 -1.9862 -1.5939 -1.5939 -1.3443 -1.3443 -0.7576 -0.7576 -0.7006 -0.7006 0.1871 0.1871 3.9497 3.9497 5.1781 5.1781 5.5712 5.5712 7.2218 7.2218 9.0153 9.0153 11.2936 11.2936 k = 0.3537 0.5423 0.4635 ( 8892 PWs) bands (ev): -40.5733 -40.5733 -40.5435 -40.5435 -40.4144 -40.4144 -40.2141 -40.2141 -15.4596 -15.4596 -15.1328 -15.1328 -5.4858 -5.4858 -4.4803 -4.4803 -1.9769 -1.9769 -1.5889 -1.5889 -1.3178 -1.3178 -0.7490 -0.7490 -0.6667 -0.6667 0.1789 0.1789 3.9230 3.9230 5.2362 5.2362 5.6239 5.6239 7.2317 7.2317 9.0676 9.0676 11.3155 11.3155 k = 0.3586 0.5326 0.4480 ( 8892 PWs) bands (ev): -40.5741 -40.5741 -40.5430 -40.5430 -40.4147 -40.4147 -40.2141 -40.2141 -15.4636 -15.4636 -15.1410 -15.1410 -5.5066 -5.5066 -4.4867 -4.4867 -1.9684 -1.9684 -1.5858 -1.5858 -1.2902 -1.2902 -0.7397 -0.7397 -0.6294 -0.6294 0.1709 0.1709 3.8955 3.8955 5.2973 5.2973 5.6780 5.6780 7.2410 7.2410 9.1204 9.1204 11.3363 11.3363 k = 0.3635 0.5229 0.4326 ( 8900 PWs) bands (ev): -40.5749 -40.5749 -40.5427 -40.5427 -40.4151 -40.4151 -40.2142 -40.2142 -15.4676 -15.4676 -15.1492 -15.1492 -5.5272 -5.5272 -4.4934 -4.4934 -1.9609 -1.9609 -1.5845 -1.5845 -1.2619 -1.2619 -0.7296 -0.7296 -0.5890 -0.5890 0.1630 0.1630 3.8672 3.8672 5.3612 5.3612 5.7333 5.7333 7.2496 7.2496 9.1737 9.1737 11.3559 11.3559 k = 0.3684 0.5132 0.4171 ( 8900 PWs) bands (ev): -40.5757 -40.5757 -40.5423 -40.5423 -40.4155 -40.4155 -40.2142 -40.2142 -15.4717 -15.4717 -15.1575 -15.1575 -5.5478 -5.5478 -4.5004 -4.5004 -1.9543 -1.9543 -1.5848 -1.5848 -1.2331 -1.2331 -0.7185 -0.7185 -0.5458 -0.5458 0.1553 0.1553 3.8386 3.8386 5.4273 5.4273 5.7895 5.7895 7.2575 7.2575 9.2270 9.2270 11.3741 11.3741 k = 0.3732 0.5035 0.4017 ( 8896 PWs) bands (ev): -40.5765 -40.5765 -40.5419 -40.5419 -40.4159 -40.4159 -40.2143 -40.2143 -15.4759 -15.4759 -15.1657 -15.1657 -5.5681 -5.5681 -4.5076 -4.5076 -1.9486 -1.9486 -1.5866 -1.5866 -1.2039 -1.2039 -0.7064 -0.7064 -0.5002 -0.5002 0.1479 0.1479 3.8099 3.8099 5.4953 5.4953 5.8465 5.8465 7.2648 7.2648 9.2802 9.2802 11.3906 11.3906 k = 0.3781 0.4938 0.3862 ( 8896 PWs) bands (ev): -40.5772 -40.5772 -40.5416 -40.5416 -40.4163 -40.4163 -40.2143 -40.2143 -15.4800 -15.4800 -15.1738 -15.1738 -5.5881 -5.5881 -4.5150 -4.5150 -1.9437 -1.9437 -1.5896 -1.5896 -1.1749 -1.1749 -0.6931 -0.6931 -0.4524 -0.4524 0.1406 0.1406 3.7812 3.7812 5.5649 5.5649 5.9041 5.9041 7.2715 7.2715 9.3330 9.3330 11.4051 11.4051 k = 0.3830 0.4841 0.3708 ( 8892 PWs) bands (ev): -40.5780 -40.5780 -40.5412 -40.5412 -40.4166 -40.4166 -40.2144 -40.2144 -15.4842 -15.4842 -15.1819 -15.1819 -5.6078 -5.6078 -4.5225 -4.5225 -1.9396 -1.9396 -1.5937 -1.5937 -1.1462 -1.1462 -0.6784 -0.6784 -0.4029 -0.4029 0.1337 0.1337 3.7527 3.7527 5.6358 5.6358 5.9622 5.9622 7.2775 7.2775 9.3850 9.3850 11.4176 11.4176 k = 0.3879 0.4744 0.3553 ( 8896 PWs) bands (ev): -40.5787 -40.5787 -40.5409 -40.5409 -40.4170 -40.4170 -40.2144 -40.2144 -15.4883 -15.4883 -15.1899 -15.1899 -5.6271 -5.6271 -4.5302 -4.5302 -1.9362 -1.9362 -1.5987 -1.5987 -1.1182 -1.1182 -0.6623 -0.6623 -0.3521 -0.3521 0.1270 0.1270 3.7245 3.7245 5.7075 5.7075 6.0204 6.0204 7.2829 7.2829 9.4360 9.4360 11.4276 11.4276 k = 0.3927 0.4647 0.3399 ( 8892 PWs) bands (ev): -40.5794 -40.5794 -40.5406 -40.5406 -40.4174 -40.4174 -40.2145 -40.2145 -15.4924 -15.4924 -15.1978 -15.1978 -5.6460 -5.6460 -4.5378 -4.5378 -1.9336 -1.9336 -1.6044 -1.6044 -1.0912 -1.0912 -0.6446 -0.6446 -0.3002 -0.3002 0.1206 0.1206 3.6969 3.6969 5.7798 5.7798 6.0787 6.0787 7.2878 7.2878 9.4858 9.4858 11.4352 11.4352 k = 0.3976 0.4550 0.3244 ( 8892 PWs) bands (ev): -40.5800 -40.5800 -40.5404 -40.5404 -40.4178 -40.4178 -40.2145 -40.2145 -15.4965 -15.4965 -15.2055 -15.2055 -5.6644 -5.6644 -4.5455 -4.5455 -1.9315 -1.9315 -1.6106 -1.6106 -1.0656 -1.0656 -0.6253 -0.6253 -0.2478 -0.2478 0.1147 0.1147 3.6699 3.6699 5.8523 5.8523 6.1368 6.1368 7.2920 7.2920 9.5339 9.5339 11.4399 11.4399 k = 0.4025 0.4453 0.3090 ( 8882 PWs) bands (ev): -40.5807 -40.5807 -40.5401 -40.5401 -40.4181 -40.4181 -40.2146 -40.2146 -15.5005 -15.5005 -15.2131 -15.2131 -5.6822 -5.6822 -4.5531 -4.5531 -1.9300 -1.9300 -1.6173 -1.6173 -1.0415 -1.0415 -0.6043 -0.6043 -0.1953 -0.1953 0.1094 0.1094 3.6437 3.6437 5.9248 5.9248 6.1945 6.1945 7.2957 7.2957 9.5802 9.5802 11.4418 11.4418 k = 0.4074 0.4356 0.2935 ( 8874 PWs) bands (ev): -40.5813 -40.5813 -40.5398 -40.5398 -40.4185 -40.4185 -40.2146 -40.2146 -15.5044 -15.5044 -15.2204 -15.2204 -5.6995 -5.6995 -4.5606 -4.5606 -1.9290 -1.9290 -1.6243 -1.6243 -1.0191 -1.0191 -0.5817 -0.5817 -0.1433 -0.1433 0.1049 0.1049 3.6182 3.6182 5.9969 5.9969 6.2515 6.2515 7.2988 7.2988 9.6244 9.6244 11.4406 11.4406 k = 0.4122 0.4259 0.2781 ( 8870 PWs) bands (ev): -40.5819 -40.5819 -40.5396 -40.5396 -40.4188 -40.4188 -40.2146 -40.2146 -15.5082 -15.5082 -15.2276 -15.2276 -5.7161 -5.7161 -4.5680 -4.5680 -1.9284 -1.9284 -1.6315 -1.6315 -0.9986 -0.9986 -0.5577 -0.5577 -0.0925 -0.0925 0.1016 0.1016 3.5937 3.5937 6.0682 6.0682 6.3078 6.3078 7.3014 7.3014 9.6662 9.6662 11.4362 11.4362 k = 0.4171 0.4162 0.2626 ( 8882 PWs) bands (ev): -40.5825 -40.5825 -40.5394 -40.5394 -40.4192 -40.4192 -40.2147 -40.2147 -15.5119 -15.5119 -15.2344 -15.2344 -5.7321 -5.7321 -4.5752 -4.5752 -1.9282 -1.9282 -1.6387 -1.6387 -0.9800 -0.9800 -0.5324 -0.5324 -0.0444 -0.0444 0.1007 0.1007 3.5701 3.5701 6.1386 6.1386 6.3629 6.3629 7.3035 7.3035 9.7055 9.7055 11.4288 11.4288 k = 0.4220 0.4065 0.2472 ( 8878 PWs) bands (ev): -40.5830 -40.5830 -40.5392 -40.5392 -40.4195 -40.4195 -40.2147 -40.2147 -15.5155 -15.5155 -15.2410 -15.2410 -5.7474 -5.7474 -4.5823 -4.5823 -1.9283 -1.9283 -1.6460 -1.6460 -0.9632 -0.9632 -0.5062 -0.5062 -0.0020 -0.0020 0.1050 0.1050 3.5476 3.5476 6.2075 6.2075 6.4168 6.4168 7.3050 7.3050 9.7420 9.7420 11.4182 11.4182 k = 0.4269 0.3968 0.2317 ( 8874 PWs) bands (ev): -40.5835 -40.5835 -40.5390 -40.5390 -40.4198 -40.4198 -40.2148 -40.2148 -15.5190 -15.5190 -15.2474 -15.2474 -5.7619 -5.7619 -4.5890 -4.5890 -1.9287 -1.9287 -1.6531 -1.6531 -0.9481 -0.9481 -0.4794 -0.4794 0.0282 0.0282 0.1205 0.1205 3.5262 3.5262 6.2747 6.2747 6.4692 6.4692 7.3060 7.3060 9.7756 9.7756 11.4048 11.4048 k = 0.4317 0.3871 0.2163 ( 8894 PWs) bands (ev): -40.5840 -40.5840 -40.5388 -40.5388 -40.4201 -40.4201 -40.2148 -40.2148 -15.5222 -15.5222 -15.2534 -15.2534 -5.7757 -5.7757 -4.5955 -4.5955 -1.9292 -1.9292 -1.6601 -1.6601 -0.9347 -0.9347 -0.4522 -0.4522 0.0425 0.0425 0.1507 0.1507 3.5059 3.5059 6.3398 6.3398 6.5199 6.5199 7.3064 7.3064 9.8063 9.8063 11.3887 11.3887 k = 0.4366 0.3774 0.2008 ( 8896 PWs) bands (ev): -40.5845 -40.5845 -40.5387 -40.5387 -40.4204 -40.4204 -40.2149 -40.2149 -15.5254 -15.5254 -15.2590 -15.2590 -5.7886 -5.7886 -4.6017 -4.6017 -1.9300 -1.9300 -1.6668 -1.6668 -0.9229 -0.9229 -0.4251 -0.4251 0.0468 0.0468 0.1894 0.1894 3.4869 3.4869 6.4026 6.4026 6.5686 6.5686 7.3064 7.3064 9.8339 9.8339 11.3703 11.3703 k = 0.4415 0.3677 0.1854 ( 8904 PWs) bands (ev): -40.5849 -40.5849 -40.5385 -40.5385 -40.4206 -40.4206 -40.2149 -40.2149 -15.5283 -15.5283 -15.2644 -15.2644 -5.8007 -5.8007 -4.6076 -4.6076 -1.9308 -1.9308 -1.6732 -1.6732 -0.9124 -0.9124 -0.3984 -0.3984 0.0470 0.0470 0.2304 0.2304 3.4691 3.4691 6.4625 6.4625 6.6152 6.6152 7.3059 7.3059 9.8585 9.8585 11.3499 11.3499 k = 0.4464 0.3580 0.1699 ( 8904 PWs) bands (ev): -40.5853 -40.5853 -40.5384 -40.5384 -40.4209 -40.4209 -40.2149 -40.2149 -15.5310 -15.5310 -15.2693 -15.2693 -5.8119 -5.8119 -4.6130 -4.6130 -1.9317 -1.9317 -1.6793 -1.6793 -0.9031 -0.9031 -0.3726 -0.3726 0.0455 0.0455 0.2710 0.2710 3.4525 3.4525 6.5193 6.5193 6.6594 6.6594 7.3050 7.3050 9.8802 9.8802 11.3282 11.3282 k = 0.4512 0.3483 0.1545 ( 8908 PWs) bands (ev): -40.5857 -40.5857 -40.5383 -40.5383 -40.4211 -40.4211 -40.2150 -40.2150 -15.5336 -15.5336 -15.2739 -15.2739 -5.8223 -5.8223 -4.6181 -4.6181 -1.9327 -1.9327 -1.6850 -1.6850 -0.8950 -0.8950 -0.3478 -0.3478 0.0434 0.0434 0.3098 0.3098 3.4374 3.4374 6.5727 6.5727 6.7011 6.7011 7.3036 7.3036 9.8991 9.8991 11.3056 11.3056 k = 0.4561 0.3386 0.1390 ( 8906 PWs) bands (ev): -40.5860 -40.5860 -40.5382 -40.5382 -40.4213 -40.4213 -40.2150 -40.2150 -15.5359 -15.5359 -15.2781 -15.2781 -5.8317 -5.8317 -4.6228 -4.6228 -1.9337 -1.9337 -1.6903 -1.6903 -0.8880 -0.8880 -0.3244 -0.3244 0.0412 0.0412 0.3463 0.3463 3.4235 3.4235 6.6222 6.6222 6.7399 6.7399 7.3018 7.3018 9.9152 9.9152 11.2827 11.2827 k = 0.4610 0.3289 0.1236 ( 8904 PWs) bands (ev): -40.5863 -40.5863 -40.5381 -40.5381 -40.4215 -40.4215 -40.2150 -40.2150 -15.5380 -15.5380 -15.2819 -15.2819 -5.8402 -5.8402 -4.6271 -4.6271 -1.9346 -1.9346 -1.6951 -1.6951 -0.8819 -0.8819 -0.3028 -0.3028 0.0389 0.0389 0.3798 0.3798 3.4111 3.4111 6.6676 6.6676 6.7756 6.7756 7.2997 7.2997 9.9289 9.9289 11.2602 11.2602 k = 0.4659 0.3192 0.1081 ( 8902 PWs) bands (ev): -40.5866 -40.5866 -40.5380 -40.5380 -40.4216 -40.4216 -40.2150 -40.2150 -15.5399 -15.5399 -15.2852 -15.2852 -5.8477 -5.8477 -4.6309 -4.6309 -1.9355 -1.9355 -1.6994 -1.6994 -0.8766 -0.8766 -0.2830 -0.2830 0.0368 0.0368 0.4101 0.4101 3.4000 3.4000 6.7085 6.7085 6.8081 6.8081 7.2973 7.2973 9.9402 9.9402 11.2387 11.2387 k = 0.4707 0.3095 0.0927 ( 8902 PWs) bands (ev): -40.5868 -40.5868 -40.5379 -40.5379 -40.4218 -40.4218 -40.2151 -40.2151 -15.5415 -15.5415 -15.2882 -15.2882 -5.8543 -5.8543 -4.6342 -4.6342 -1.9364 -1.9364 -1.7032 -1.7032 -0.8722 -0.8722 -0.2655 -0.2655 0.0349 0.0349 0.4369 0.4369 3.3904 3.3904 6.7446 6.7446 6.8370 6.8370 7.2948 7.2948 9.9494 9.9494 11.2187 11.2187 k = 0.4756 0.2998 0.0772 ( 8898 PWs) bands (ev): -40.5870 -40.5870 -40.5378 -40.5378 -40.4219 -40.4219 -40.2151 -40.2151 -15.5429 -15.5429 -15.2907 -15.2907 -5.8599 -5.8599 -4.6370 -4.6370 -1.9371 -1.9371 -1.7064 -1.7064 -0.8686 -0.8686 -0.2503 -0.2503 0.0332 0.0332 0.4600 0.4600 3.3823 3.3823 6.7757 6.7757 6.8622 6.8622 7.2922 7.2922 9.9568 9.9568 11.2008 11.2008 k = 0.4805 0.2901 0.0618 ( 8898 PWs) bands (ev): -40.5872 -40.5872 -40.5378 -40.5378 -40.4220 -40.4220 -40.2151 -40.2151 -15.5441 -15.5441 -15.2927 -15.2927 -5.8645 -5.8645 -4.6393 -4.6393 -1.9377 -1.9377 -1.7091 -1.7091 -0.8656 -0.8656 -0.2377 -0.2377 0.0318 0.0318 0.4792 0.4792 3.3756 3.3756 6.8015 6.8015 6.8833 6.8833 7.2898 7.2898 9.9625 9.9625 11.1855 11.1855 k = 0.4854 0.2804 0.0463 ( 8902 PWs) bands (ev): -40.5873 -40.5873 -40.5378 -40.5378 -40.4221 -40.4221 -40.2151 -40.2151 -15.5450 -15.5450 -15.2943 -15.2943 -5.8680 -5.8680 -4.6412 -4.6412 -1.9382 -1.9382 -1.7112 -1.7112 -0.8633 -0.8633 -0.2277 -0.2277 0.0307 0.0307 0.4942 0.4942 3.3704 3.3704 6.8218 6.8218 6.9000 6.9000 7.2876 7.2876 9.9667 9.9667 11.1732 11.1732 k = 0.4902 0.2707 0.0309 ( 8910 PWs) bands (ev): -40.5874 -40.5874 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5457 -15.5457 -15.2955 -15.2955 -5.8706 -5.8706 -4.6425 -4.6425 -1.9386 -1.9386 -1.7127 -1.7127 -0.8617 -0.8617 -0.2205 -0.2205 0.0299 0.0299 0.5051 0.5051 3.3666 3.3666 6.8364 6.8364 6.9122 6.9122 7.2859 7.2859 9.9696 9.9696 11.1641 11.1641 k = 0.4951 0.2610 0.0154 ( 8912 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5460 -15.5460 -15.2962 -15.2962 -5.8721 -5.8721 -4.6433 -4.6433 -1.9388 -1.9388 -1.7136 -1.7136 -0.8608 -0.8608 -0.2161 -0.2161 0.0294 0.0294 0.5116 0.5116 3.3644 3.3644 6.8452 6.8452 6.9196 6.9196 7.2848 7.2848 9.9713 9.9713 11.1586 11.1586 k = 0.5000 0.2513 0.0000 ( 8904 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5462 -15.5462 -15.2964 -15.2964 -5.8726 -5.8726 -4.6435 -4.6435 -1.9389 -1.9389 -1.7139 -1.7139 -0.8605 -0.8605 -0.2147 -0.2147 0.0292 0.0292 0.5138 0.5138 3.3636 3.3636 6.8481 6.8481 6.9221 6.9221 7.2844 7.2844 9.9719 9.9719 11.1567 11.1567 k = 0.5000 0.2513 0.0000 ( 8904 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5462 -15.5462 -15.2964 -15.2964 -5.8726 -5.8726 -4.6435 -4.6435 -1.9389 -1.9389 -1.7139 -1.7139 -0.8605 -0.8605 -0.2147 -0.2147 0.0292 0.0292 0.5138 0.5138 3.3636 3.3636 6.8481 6.8481 6.9221 6.9221 7.2844 7.2844 9.9719 9.9719 11.1567 11.1567 k = 0.4833 0.2429 0.0000 ( 8906 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5464 -15.5464 -15.2962 -15.2962 -5.8720 -5.8720 -4.6446 -4.6446 -1.9389 -1.9389 -1.7143 -1.7143 -0.8619 -0.8619 -0.2143 -0.2143 0.0313 0.0313 0.5133 0.5133 3.3660 3.3660 6.8453 6.8453 6.9250 6.9250 7.2810 7.2810 9.9719 9.9719 11.1556 11.1556 k = 0.4667 0.2345 0.0000 ( 8911 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5470 -15.5470 -15.2955 -15.2955 -5.8700 -5.8700 -4.6477 -4.6477 -1.9389 -1.9389 -1.7156 -1.7156 -0.8659 -0.8659 -0.2131 -0.2131 0.0374 0.0374 0.5118 0.5118 3.3731 3.3731 6.8378 6.8378 6.9327 6.9327 7.2706 7.2706 9.9722 9.9722 11.1522 11.1522 k = 0.4500 0.2262 0.0000 ( 8919 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5480 -15.5480 -15.2943 -15.2943 -5.8668 -5.8668 -4.6529 -4.6529 -1.9389 -1.9389 -1.7177 -1.7177 -0.8726 -0.8726 -0.2110 -0.2110 0.0474 0.0474 0.5093 0.5093 3.3849 3.3849 6.8276 6.8276 6.9432 6.9432 7.2535 7.2535 9.9725 9.9725 11.1467 11.1467 k = 0.4333 0.2178-0.0000 ( 8901 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5495 -15.5495 -15.2928 -15.2928 -5.8622 -5.8622 -4.6601 -4.6601 -1.9390 -1.9390 -1.7206 -1.7206 -0.8815 -0.8815 -0.2081 -0.2081 0.0610 0.0610 0.5058 0.5058 3.4014 3.4014 6.8159 6.8159 6.9552 6.9552 7.2297 7.2297 9.9729 9.9729 11.1396 11.1396 k = 0.4167 0.2094-0.0000 ( 8897 PWs) bands (ev): -40.5876 -40.5876 -40.5376 -40.5376 -40.4222 -40.4222 -40.2151 -40.2151 -15.5512 -15.5512 -15.2908 -15.2908 -5.8564 -5.8564 -4.6694 -4.6694 -1.9392 -1.9392 -1.7241 -1.7241 -0.8924 -0.8924 -0.2045 -0.2045 0.0778 0.0778 0.5013 0.5013 3.4225 3.4225 6.8035 6.8035 6.9681 6.9681 7.1995 7.1995 9.9733 9.9733 11.1312 11.1312 k = 0.4000 0.2010 0.0000 ( 8891 PWs) bands (ev): -40.5876 -40.5876 -40.5376 -40.5376 -40.4222 -40.4222 -40.2151 -40.2151 -15.5533 -15.5533 -15.2885 -15.2885 -5.8493 -5.8493 -4.6806 -4.6806 -1.9396 -1.9396 -1.7282 -1.7282 -0.9050 -0.9050 -0.2000 -0.2000 0.0975 0.0975 0.4958 0.4958 3.4482 3.4482 6.7909 6.7909 6.9813 6.9813 7.1630 7.1630 9.9736 9.9736 11.1220 11.1220 k = 0.3833 0.1926 0.0000 ( 8903 PWs) bands (ev): -40.5876 -40.5876 -40.5376 -40.5376 -40.4221 -40.4221 -40.2151 -40.2151 -15.5557 -15.5557 -15.2859 -15.2859 -5.8409 -5.8409 -4.6936 -4.6936 -1.9402 -1.9402 -1.7327 -1.7327 -0.9189 -0.9189 -0.1948 -0.1948 0.1195 0.1195 0.4894 0.4894 3.4784 3.4784 6.7782 6.7782 6.9947 6.9947 7.1205 7.1205 9.9735 9.9735 11.1127 11.1127 k = 0.3667 0.1843 0.0000 ( 8899 PWs) bands (ev): -40.5877 -40.5877 -40.5376 -40.5376 -40.4221 -40.4221 -40.2151 -40.2151 -15.5583 -15.5583 -15.2830 -15.2830 -5.8313 -5.8313 -4.7085 -4.7085 -1.9411 -1.9411 -1.7375 -1.7375 -0.9338 -0.9338 -0.1888 -0.1888 0.1436 0.1436 0.4822 0.4822 3.5129 3.5129 6.7655 6.7655 7.0079 7.0079 7.0724 7.0724 9.9732 9.9732 11.1037 11.1037 k = 0.3500 0.1759 0.0000 ( 8901 PWs) bands (ev): -40.5877 -40.5877 -40.5375 -40.5375 -40.4221 -40.4221 -40.2151 -40.2151 -15.5611 -15.5611 -15.2799 -15.2799 -5.8204 -5.8204 -4.7251 -4.7251 -1.9424 -1.9424 -1.7424 -1.7424 -0.9494 -0.9494 -0.1821 -0.1821 0.1691 0.1691 0.4740 0.4740 3.5517 3.5517 6.7531 6.7531 7.0152 7.0152 7.0249 7.0249 9.9723 9.9723 11.0957 11.0957 k = 0.3333 0.1675 0.0000 ( 8911 PWs) bands (ev): -40.5878 -40.5878 -40.5375 -40.5375 -40.4221 -40.4221 -40.2151 -40.2151 -15.5640 -15.5640 -15.2765 -15.2765 -5.8084 -5.8084 -4.7434 -4.7434 -1.9442 -1.9442 -1.7473 -1.7473 -0.9654 -0.9654 -0.1746 -0.1746 0.1959 0.1959 0.4650 0.4650 3.5946 3.5946 6.7409 6.7409 6.9595 6.9595 7.0349 7.0349 9.9708 9.9708 11.0891 11.0891 k = 0.3167 0.1591-0.0000 ( 8915 PWs) bands (ev): -40.5879 -40.5879 -40.5374 -40.5374 -40.4221 -40.4221 -40.2151 -40.2151 -15.5671 -15.5671 -15.2731 -15.2731 -5.7951 -5.7951 -4.7631 -4.7631 -1.9466 -1.9466 -1.7519 -1.7519 -0.9816 -0.9816 -0.1665 -0.1665 0.2234 0.2234 0.4552 0.4552 3.6416 3.6416 6.7291 6.7291 6.8962 6.8962 7.0476 7.0476 9.9685 9.9685 11.0845 11.0845 k = 0.3000 0.1508 0.0000 ( 8915 PWs) bands (ev): -40.5879 -40.5879 -40.5374 -40.5374 -40.4221 -40.4221 -40.2151 -40.2151 -15.5702 -15.5702 -15.2696 -15.2696 -5.7807 -5.7807 -4.7844 -4.7844 -1.9496 -1.9496 -1.7562 -1.7562 -0.9978 -0.9978 -0.1577 -0.1577 0.2514 0.2514 0.4447 0.4447 3.6925 3.6925 6.7175 6.7175 6.8286 6.8286 7.0601 7.0601 9.9655 9.9655 11.0823 11.0823 k = 0.2833 0.1424-0.0000 ( 8927 PWs) bands (ev): -40.5880 -40.5880 -40.5374 -40.5374 -40.4220 -40.4220 -40.2152 -40.2152 -15.5734 -15.5734 -15.2660 -15.2660 -5.7652 -5.7652 -4.8069 -4.8069 -1.9533 -1.9533 -1.7598 -1.7598 -1.0138 -1.0138 -0.1482 -0.1482 0.2795 0.2795 0.4335 0.4335 3.7471 3.7471 6.7061 6.7061 6.7572 6.7572 7.0722 7.0722 9.9616 9.9616 11.0828 11.0828 k = 0.2667 0.1340 0.0000 ( 8931 PWs) bands (ev): -40.5880 -40.5880 -40.5373 -40.5373 -40.4220 -40.4220 -40.2152 -40.2152 -15.5766 -15.5766 -15.2624 -15.2624 -5.7486 -5.7486 -4.8307 -4.8307 -1.9577 -1.9577 -1.7629 -1.7629 -1.0295 -1.0295 -0.1382 -0.1382 0.3075 0.3075 0.4217 0.4217 3.8052 3.8052 6.6792 6.6792 6.6982 6.6982 7.0838 7.0838 9.9569 9.9569 11.0863 11.0863 k = 0.2500 0.1256 0.0000 ( 8913 PWs) bands (ev): -40.5881 -40.5881 -40.5373 -40.5373 -40.4220 -40.4220 -40.2152 -40.2152 -15.5797 -15.5797 -15.2589 -15.2589 -5.7309 -5.7309 -4.8556 -4.8556 -1.9628 -1.9628 -1.7652 -1.7652 -1.0447 -1.0447 -0.1276 -0.1276 0.3350 0.3350 0.4093 0.4093 3.8668 3.8668 6.6021 6.6021 6.6866 6.6866 7.0950 7.0950 9.9513 9.9513 11.0928 11.0928 k = 0.2333 0.1173-0.0000 ( 8903 PWs) bands (ev): -40.5882 -40.5882 -40.5372 -40.5372 -40.4220 -40.4220 -40.2152 -40.2152 -15.5828 -15.5828 -15.2554 -15.2554 -5.7123 -5.7123 -4.8814 -4.8814 -1.9685 -1.9685 -1.7668 -1.7668 -1.0594 -1.0594 -0.1165 -0.1165 0.3618 0.3618 0.3965 0.3965 3.9315 3.9315 6.5208 6.5208 6.6768 6.6768 7.1057 7.1057 9.9450 9.9450 11.1025 11.1025 k = 0.2167 0.1089 0.0000 ( 8911 PWs) bands (ev): -40.5882 -40.5882 -40.5372 -40.5372 -40.4219 -40.4219 -40.2152 -40.2152 -15.5857 -15.5857 -15.2520 -15.2520 -5.6927 -5.6927 -4.9081 -4.9081 -1.9747 -1.9747 -1.7678 -1.7678 -1.0734 -1.0734 -0.1049 -0.1049 0.3818 0.3818 0.3890 0.3890 3.9993 3.9993 6.4368 6.4368 6.6678 6.6678 7.1158 7.1158 9.9380 9.9380 11.1153 11.1153 k = 0.2000 0.1005 0.0000 ( 8917 PWs) bands (ev): -40.5883 -40.5883 -40.5371 -40.5371 -40.4219 -40.4219 -40.2152 -40.2152 -15.5886 -15.5886 -15.2487 -15.2487 -5.6722 -5.6722 -4.9354 -4.9354 -1.9812 -1.9812 -1.7680 -1.7680 -1.0867 -1.0867 -0.0929 -0.0929 0.3690 0.3690 0.4130 0.4130 4.0698 4.0698 6.3507 6.3507 6.6593 6.6593 7.1253 7.1253 9.9306 9.9306 11.1310 11.1310 k = 0.1833 0.0921-0.0000 ( 8917 PWs) bands (ev): -40.5884 -40.5884 -40.5371 -40.5371 -40.4219 -40.4219 -40.2152 -40.2152 -15.5913 -15.5913 -15.2456 -15.2456 -5.6509 -5.6509 -4.9633 -4.9633 -1.9879 -1.9879 -1.7678 -1.7678 -1.0992 -1.0992 -0.0807 -0.0807 0.3552 0.3552 0.4365 0.4365 4.1428 4.1428 6.2628 6.2628 6.6514 6.6514 7.1342 7.1342 9.9228 9.9228 11.1494 11.1494 k = 0.1667 0.0838 0.0000 ( 8929 PWs) bands (ev): -40.5884 -40.5884 -40.5371 -40.5371 -40.4219 -40.4219 -40.2152 -40.2152 -15.5938 -15.5938 -15.2427 -15.2427 -5.6289 -5.6289 -4.9916 -4.9916 -1.9946 -1.9946 -1.7670 -1.7670 -1.1109 -1.1109 -0.0682 -0.0682 0.3411 0.3411 0.4586 0.4586 4.2180 4.2180 6.1737 6.1737 6.6442 6.6442 7.1424 7.1424 9.9149 9.9149 11.1702 11.1702 k = 0.1500 0.0754 0.0000 ( 8945 PWs) bands (ev): -40.5885 -40.5885 -40.5370 -40.5370 -40.4219 -40.4219 -40.2152 -40.2152 -15.5962 -15.5962 -15.2400 -15.2400 -5.6064 -5.6064 -5.0200 -5.0200 -2.0013 -2.0013 -1.7660 -1.7660 -1.1216 -1.1216 -0.0557 -0.0557 0.3270 0.3270 0.4790 0.4790 4.2951 4.2951 6.0836 6.0836 6.6376 6.6376 7.1499 7.1499 9.9071 9.9071 11.1929 11.1929 k = 0.1333 0.0670 0.0000 ( 8951 PWs) bands (ev): -40.5885 -40.5885 -40.5370 -40.5370 -40.4219 -40.4219 -40.2152 -40.2152 -15.5983 -15.5983 -15.2375 -15.2375 -5.5834 -5.5834 -5.0485 -5.0485 -2.0076 -2.0076 -1.7646 -1.7646 -1.1314 -1.1314 -0.0432 -0.0432 0.3131 0.3131 0.4977 0.4977 4.3736 4.3736 5.9932 5.9932 6.6317 6.6317 7.1567 7.1567 9.8995 9.8995 11.2170 11.2170 k = 0.1167 0.0586 0.0000 ( 8961 PWs) bands (ev): -40.5886 -40.5886 -40.5370 -40.5370 -40.4218 -40.4218 -40.2152 -40.2152 -15.6002 -15.6002 -15.2353 -15.2353 -5.5602 -5.5602 -5.0766 -5.0766 -2.0135 -2.0135 -1.7632 -1.7632 -1.1402 -1.1402 -0.0309 -0.0309 0.2995 0.2995 0.5145 0.5145 4.4530 4.4530 5.9031 5.9031 6.6264 6.6264 7.1628 7.1628 9.8923 9.8923 11.2418 11.2418 k = 0.1000 0.0503 0.0000 ( 8979 PWs) bands (ev): -40.5886 -40.5886 -40.5369 -40.5369 -40.4218 -40.4218 -40.2152 -40.2152 -15.6019 -15.6019 -15.2334 -15.2334 -5.5371 -5.5371 -5.1041 -5.1041 -2.0189 -2.0189 -1.7617 -1.7617 -1.1480 -1.1480 -0.0190 -0.0190 0.2865 0.2865 0.5293 0.5293 4.5326 4.5326 5.8141 5.8141 6.6218 6.6218 7.1681 7.1681 9.8857 9.8857 11.2664 11.2664 k = 0.0833 0.0419 0.0000 ( 8987 PWs) bands (ev): -40.5887 -40.5887 -40.5369 -40.5369 -40.4218 -40.4218 -40.2152 -40.2152 -15.6034 -15.6034 -15.2317 -15.2317 -5.5145 -5.5145 -5.1305 -5.1305 -2.0237 -2.0237 -1.7603 -1.7603 -1.1546 -1.1546 -0.0079 -0.0079 0.2744 0.2744 0.5420 0.5420 4.6113 4.6113 5.7274 5.7274 6.6179 6.6179 7.1726 7.1726 9.8799 9.8799 11.2901 11.2901 k = 0.0667 0.0335 0.0000 ( 8975 PWs) bands (ev): -40.5887 -40.5887 -40.5369 -40.5369 -40.4218 -40.4218 -40.2152 -40.2152 -15.6046 -15.6046 -15.2303 -15.2303 -5.4930 -5.4930 -5.1551 -5.1551 -2.0277 -2.0277 -1.7590 -1.7590 -1.1600 -1.1600 0.0022 0.0022 0.2635 0.2635 0.5525 0.5525 4.6874 4.6874 5.6447 5.6447 6.6147 6.6147 7.1763 7.1763 9.8749 9.8749 11.3117 11.3117 k = 0.0500 0.0251 0.0000 ( 8957 PWs) bands (ev): -40.5887 -40.5887 -40.5369 -40.5369 -40.4218 -40.4218 -40.2152 -40.2152 -15.6055 -15.6055 -15.2292 -15.2292 -5.4735 -5.4735 -5.1771 -5.1771 -2.0309 -2.0309 -1.7580 -1.7580 -1.1643 -1.1643 0.0108 0.0108 0.2543 0.2543 0.5607 0.5607 4.7580 4.7580 5.5688 5.5688 6.6122 6.6122 7.1792 7.1792 9.8709 9.8709 11.3302 11.3302 k = 0.0333 0.0168-0.0000 ( 8961 PWs) bands (ev): -40.5887 -40.5887 -40.5369 -40.5369 -40.4218 -40.4218 -40.2152 -40.2152 -15.6062 -15.6062 -15.2284 -15.2284 -5.4575 -5.4575 -5.1949 -5.1949 -2.0332 -2.0332 -1.7572 -1.7572 -1.1674 -1.1674 0.0174 0.0174 0.2472 0.2472 0.5666 0.5666 4.8184 4.8184 5.5046 5.5046 6.6104 6.6104 7.1813 7.1813 9.8681 9.8681 11.3444 11.3444 k = 0.0167 0.0084 0.0000 ( 8957 PWs) bands (ev): -40.5887 -40.5887 -40.5369 -40.5369 -40.4218 -40.4218 -40.2152 -40.2152 -15.6066 -15.6066 -15.2279 -15.2279 -5.4466 -5.4466 -5.2068 -5.2068 -2.0346 -2.0346 -1.7567 -1.7567 -1.1693 -1.1693 0.0216 0.0216 0.2427 0.2427 0.5702 0.5702 4.8611 4.8611 5.4597 5.4597 6.6093 6.6093 7.1825 7.1825 9.8663 9.8663 11.3534 11.3534 k = 0.0000 0.0000 0.0000 ( 8949 PWs) bands (ev): -40.5887 -40.5887 -40.5368 -40.5368 -40.4218 -40.4218 -40.2152 -40.2152 -15.6067 -15.6067 -15.2278 -15.2278 -5.4428 -5.4428 -5.2110 -5.2110 -2.0351 -2.0351 -1.7565 -1.7565 -1.1699 -1.1699 0.0231 0.0231 0.2412 0.2412 0.5714 0.5714 4.8768 4.8768 5.4432 5.4432 6.6090 6.6090 7.1830 7.1830 9.8657 9.8657 11.3564 11.3564 k = 0.0000 0.0000 0.0000 ( 8949 PWs) bands (ev): -40.5887 -40.5887 -40.5368 -40.5368 -40.4218 -40.4218 -40.2152 -40.2152 -15.6067 -15.6067 -15.2278 -15.2278 -5.4428 -5.4428 -5.2110 -5.2110 -2.0351 -2.0351 -1.7565 -1.7565 -1.1699 -1.1699 0.0231 0.0231 0.2412 0.2412 0.5714 0.5714 4.8768 4.8768 5.4432 5.4432 6.6090 6.6090 7.1830 7.1830 9.8657 9.8657 11.3564 11.3564 k = 0.0070-0.0138 0.0109 ( 8953 PWs) bands (ev): -40.5887 -40.5887 -40.5369 -40.5369 -40.4218 -40.4218 -40.2152 -40.2152 -15.6067 -15.6067 -15.2278 -15.2278 -5.4441 -5.4441 -5.2121 -5.2121 -2.0346 -2.0346 -1.7546 -1.7546 -1.1676 -1.1676 0.0231 0.0231 0.2414 0.2414 0.5709 0.5709 4.8761 4.8761 5.4439 5.4439 6.6083 6.6083 7.1823 7.1823 9.8654 9.8654 11.3558 11.3558 k = 0.0139-0.0277 0.0218 ( 8965 PWs) bands (ev): -40.5886 -40.5886 -40.5370 -40.5370 -40.4218 -40.4218 -40.2152 -40.2152 -15.6065 -15.6065 -15.2277 -15.2277 -5.4483 -5.4483 -5.2155 -5.2155 -2.0331 -2.0331 -1.7487 -1.7487 -1.1608 -1.1608 0.0233 0.0233 0.2421 0.2421 0.5697 0.5697 4.8738 4.8738 5.4459 5.4459 6.6063 6.6063 7.1804 7.1804 9.8647 9.8647 11.3538 11.3538 k = 0.0209-0.0415 0.0327 ( 8947 PWs) bands (ev): -40.5885 -40.5885 -40.5371 -40.5371 -40.4217 -40.4217 -40.2153 -40.2153 -15.6063 -15.6063 -15.2276 -15.2276 -5.4551 -5.4551 -5.2209 -5.2209 -2.0309 -2.0309 -1.7390 -1.7390 -1.1494 -1.1494 0.0235 0.0235 0.2433 0.2433 0.5677 0.5677 4.8701 4.8701 5.4492 5.4492 6.6030 6.6030 7.1772 7.1772 9.8633 9.8633 11.3503 11.3503 k = 0.0278-0.0554 0.0436 ( 8935 PWs) bands (ev): -40.5883 -40.5883 -40.5372 -40.5372 -40.4217 -40.4217 -40.2153 -40.2153 -15.6059 -15.6059 -15.2275 -15.2275 -5.4645 -5.4645 -5.2285 -5.2285 -2.0279 -2.0279 -1.7253 -1.7253 -1.1337 -1.1337 0.0239 0.0239 0.2450 0.2450 0.5648 0.5648 4.8649 4.8649 5.4539 5.4539 6.5984 6.5984 7.1727 7.1727 9.8613 9.8613 11.3453 11.3453 k = 0.0348-0.0692 0.0544 ( 8925 PWs) bands (ev): -40.5881 -40.5881 -40.5374 -40.5374 -40.4216 -40.4216 -40.2153 -40.2153 -15.6054 -15.6054 -15.2273 -15.2273 -5.4765 -5.4765 -5.2380 -5.2380 -2.0243 -2.0243 -1.7077 -1.7077 -1.1138 -1.1138 0.0244 0.0244 0.2472 0.2472 0.5613 0.5613 4.8583 4.8583 5.4599 5.4599 6.5925 6.5925 7.1670 7.1670 9.8585 9.8585 11.3386 11.3386 k = 0.0418-0.0831 0.0653 ( 8923 PWs) bands (ev): -40.5878 -40.5878 -40.5377 -40.5377 -40.4216 -40.4216 -40.2154 -40.2154 -15.6049 -15.6049 -15.2272 -15.2272 -5.4907 -5.4907 -5.2494 -5.2494 -2.0203 -2.0203 -1.6861 -1.6861 -1.0898 -1.0898 0.0249 0.0249 0.2498 0.2498 0.5569 0.5569 4.8502 4.8502 5.4672 5.4672 6.5855 6.5855 7.1601 7.1601 9.8548 9.8548 11.3298 11.3298 k = 0.0487-0.0969 0.0762 ( 8923 PWs) bands (ev): -40.5875 -40.5875 -40.5380 -40.5380 -40.4215 -40.4215 -40.2155 -40.2155 -15.6042 -15.6042 -15.2269 -15.2269 -5.5072 -5.5072 -5.2625 -5.2625 -2.0161 -2.0161 -1.6607 -1.6607 -1.0621 -1.0621 0.0255 0.0255 0.2528 0.2528 0.5519 0.5519 4.8407 4.8407 5.4758 5.4758 6.5774 6.5774 7.1521 7.1521 9.8500 9.8500 11.3188 11.3188 k = 0.0557-0.1108 0.0871 ( 8927 PWs) bands (ev): -40.5872 -40.5872 -40.5384 -40.5384 -40.4214 -40.4214 -40.2156 -40.2156 -15.6035 -15.6035 -15.2267 -15.2267 -5.5256 -5.5256 -5.2771 -5.2771 -2.0116 -2.0116 -1.6317 -1.6317 -1.0309 -1.0309 0.0262 0.0262 0.2563 0.2563 0.5462 0.5462 4.8299 4.8299 5.4858 5.4858 6.5682 6.5682 7.1430 7.1430 9.8438 9.8438 11.3052 11.3052 k = 0.0626-0.1246 0.0980 ( 8931 PWs) bands (ev): -40.5868 -40.5868 -40.5388 -40.5388 -40.4213 -40.4213 -40.2157 -40.2157 -15.6027 -15.6027 -15.2265 -15.2265 -5.5458 -5.5458 -5.2930 -5.2930 -2.0071 -2.0071 -1.5991 -1.5991 -0.9965 -0.9965 0.0269 0.0269 0.2602 0.2602 0.5400 0.5400 4.8177 4.8177 5.4971 5.4971 6.5582 6.5582 7.1329 7.1329 9.8362 9.8362 11.2887 11.2887 k = 0.0696-0.1385 0.1089 ( 8923 PWs) bands (ev): -40.5863 -40.5863 -40.5392 -40.5392 -40.4212 -40.4212 -40.2158 -40.2158 -15.6017 -15.6017 -15.2262 -15.2262 -5.5677 -5.5677 -5.3101 -5.3101 -2.0025 -2.0025 -1.5633 -1.5633 -0.9592 -0.9592 0.0277 0.0277 0.2645 0.2645 0.5332 0.5332 4.8043 4.8043 5.5097 5.5097 6.5472 6.5472 7.1218 7.1218 9.8267 9.8267 11.2688 11.2688 k = 0.0765-0.1523 0.1198 ( 8913 PWs) bands (ev): -40.5858 -40.5858 -40.5397 -40.5397 -40.4211 -40.4211 -40.2159 -40.2159 -15.6007 -15.6007 -15.2259 -15.2259 -5.5909 -5.5909 -5.3281 -5.3281 -1.9979 -1.9979 -1.5246 -1.5246 -0.9194 -0.9194 0.0284 0.0284 0.2693 0.2693 0.5260 0.5260 4.7896 4.7896 5.5236 5.5236 6.5356 6.5356 7.1099 7.1099 9.8152 9.8152 11.2452 11.2452 k = 0.0835-0.1662 0.1307 ( 8923 PWs) bands (ev): -40.5853 -40.5853 -40.5402 -40.5402 -40.4210 -40.4210 -40.2160 -40.2160 -15.5997 -15.5997 -15.2257 -15.2257 -5.6152 -5.6152 -5.3468 -5.3468 -1.9932 -1.9932 -1.4832 -1.4832 -0.8776 -0.8776 0.0292 0.0292 0.2743 0.2743 0.5184 0.5184 4.7738 4.7738 5.5387 5.5387 6.5233 6.5233 7.0971 7.0971 9.8014 9.8014 11.2177 11.2177 k = 0.0905-0.1800 0.1416 ( 8925 PWs) bands (ev): -40.5847 -40.5847 -40.5408 -40.5408 -40.4209 -40.4209 -40.2161 -40.2161 -15.5985 -15.5985 -15.2254 -15.2254 -5.6405 -5.6405 -5.3660 -5.3660 -1.9884 -1.9884 -1.4394 -1.4394 -0.8341 -0.8341 0.0299 0.0299 0.2798 0.2798 0.5106 0.5106 4.7568 4.7568 5.5552 5.5552 6.5105 6.5105 7.0837 7.0837 9.7851 9.7851 11.1858 11.1858 k = 0.0974-0.1939 0.1525 ( 8931 PWs) bands (ev): -40.5841 -40.5841 -40.5414 -40.5414 -40.4207 -40.4207 -40.2163 -40.2163 -15.5973 -15.5973 -15.2252 -15.2252 -5.6665 -5.6665 -5.3856 -5.3856 -1.9836 -1.9836 -1.3938 -1.3938 -0.7894 -0.7894 0.0305 0.0305 0.2855 0.2855 0.5027 0.5027 4.7387 4.7387 5.5729 5.5729 6.4973 6.4973 7.0696 7.0696 9.7660 9.7660 11.1496 11.1496 k = 0.1044-0.2077 0.1633 ( 8923 PWs) bands (ev): -40.5834 -40.5834 -40.5421 -40.5421 -40.4206 -40.4206 -40.2164 -40.2164 -15.5960 -15.5960 -15.2250 -15.2250 -5.6931 -5.6931 -5.4053 -5.4053 -1.9786 -1.9786 -1.3464 -1.3464 -0.7439 -0.7439 0.0311 0.0311 0.2916 0.2916 0.4947 0.4947 4.7196 4.7196 5.5919 5.5919 6.4839 6.4839 7.0550 7.0550 9.7439 9.7439 11.1090 11.1090 k = 0.1113-0.2215 0.1742 ( 8911 PWs) bands (ev): -40.5827 -40.5827 -40.5428 -40.5428 -40.4205 -40.4205 -40.2165 -40.2165 -15.5946 -15.5946 -15.2248 -15.2248 -5.7200 -5.7200 -5.4249 -5.4249 -1.9736 -1.9736 -1.2979 -1.2979 -0.6981 -0.6981 0.0316 0.0316 0.2979 0.2979 0.4870 0.4870 4.6994 4.6994 5.6121 5.6121 6.4703 6.4703 7.0400 7.0400 9.7187 9.7187 11.0642 11.0642 k = 0.1183-0.2354 0.1851 ( 8903 PWs) bands (ev): -40.5820 -40.5820 -40.5435 -40.5435 -40.4203 -40.4203 -40.2167 -40.2167 -15.5932 -15.5932 -15.2246 -15.2246 -5.7471 -5.7471 -5.4442 -5.4442 -1.9684 -1.9684 -1.2483 -1.2483 -0.6525 -0.6525 0.0320 0.0320 0.3045 0.3045 0.4796 0.4796 4.6784 4.6784 5.6335 5.6335 6.4567 6.4567 7.0246 7.0246 9.6904 9.6904 11.0156 11.0156 k = 0.1253-0.2492 0.1960 ( 8895 PWs) bands (ev): -40.5812 -40.5812 -40.5442 -40.5442 -40.4202 -40.4202 -40.2168 -40.2168 -15.5918 -15.5918 -15.2245 -15.2245 -5.7741 -5.7741 -5.4631 -5.4631 -1.9631 -1.9631 -1.1982 -1.1982 -0.6077 -0.6077 0.0322 0.0322 0.3114 0.3114 0.4727 0.4727 4.6564 4.6564 5.6561 5.6561 6.4432 6.4432 7.0089 7.0089 9.6591 9.6591 10.9636 10.9636 k = 0.1322-0.2631 0.2069 ( 8889 PWs) bands (ev): -40.5804 -40.5804 -40.5450 -40.5450 -40.4200 -40.4200 -40.2169 -40.2169 -15.5903 -15.5903 -15.2244 -15.2244 -5.8010 -5.8010 -5.4814 -5.4814 -1.9575 -1.9575 -1.1479 -1.1479 -0.5643 -0.5643 0.0322 0.0322 0.3184 0.3184 0.4665 0.4665 4.6336 4.6336 5.6798 5.6798 6.4300 6.4300 6.9932 6.9932 9.6247 9.6247 10.9090 10.9090 k = 0.1392-0.2769 0.2178 ( 8889 PWs) bands (ev): -40.5795 -40.5795 -40.5459 -40.5459 -40.4199 -40.4199 -40.2171 -40.2171 -15.5888 -15.5888 -15.2244 -15.2244 -5.8275 -5.8275 -5.4990 -5.4990 -1.9518 -1.9518 -1.0977 -1.0977 -0.5226 -0.5226 0.0321 0.0321 0.3256 0.3256 0.4614 0.4614 4.6100 4.6100 5.7048 5.7048 6.4172 6.4172 6.9773 6.9773 9.5877 9.5877 10.8524 10.8524 k = 0.1461-0.2908 0.2287 ( 8891 PWs) bands (ev): -40.5787 -40.5787 -40.5467 -40.5467 -40.4198 -40.4198 -40.2172 -40.2172 -15.5872 -15.5872 -15.2244 -15.2244 -5.8535 -5.8535 -5.5156 -5.5156 -1.9459 -1.9459 -1.0479 -1.0479 -0.4835 -0.4835 0.0317 0.0317 0.3330 0.3330 0.4574 0.4574 4.5856 4.5856 5.7308 5.7308 6.4048 6.4048 6.9615 6.9615 9.5482 9.5482 10.7948 10.7948 k = 0.1531-0.3046 0.2396 ( 8887 PWs) bands (ev): -40.5777 -40.5777 -40.5476 -40.5476 -40.4196 -40.4196 -40.2173 -40.2173 -15.5856 -15.5856 -15.2246 -15.2246 -5.8789 -5.8789 -5.5311 -5.5311 -1.9398 -1.9398 -0.9988 -0.9988 -0.4473 -0.4473 0.0311 0.0311 0.3405 0.3405 0.4548 0.4548 4.5605 4.5605 5.7579 5.7579 6.3930 6.3930 6.9459 6.9459 9.5068 9.5068 10.7370 10.7370 k = 0.1601-0.3185 0.2505 ( 8885 PWs) bands (ev): -40.5768 -40.5768 -40.5486 -40.5486 -40.4195 -40.4195 -40.2175 -40.2175 -15.5840 -15.5840 -15.2247 -15.2247 -5.9036 -5.9036 -5.5455 -5.5455 -1.9335 -1.9335 -0.9508 -0.9508 -0.4147 -0.4147 0.0302 0.0302 0.3480 0.3480 0.4539 0.4539 4.5348 4.5348 5.7861 5.7861 6.3820 6.3820 6.9304 6.9304 9.4639 9.4639 10.6799 10.6799 k = 0.1670-0.3323 0.2614 ( 8893 PWs) bands (ev): -40.5759 -40.5759 -40.5495 -40.5495 -40.4194 -40.4194 -40.2176 -40.2176 -15.5824 -15.5824 -15.2250 -15.2250 -5.9275 -5.9275 -5.5586 -5.5586 -1.9269 -1.9269 -0.9041 -0.9041 -0.3860 -0.3860 0.0291 0.0291 0.3556 0.3556 0.4547 0.4547 4.5084 4.5084 5.8153 5.8153 6.3717 6.3717 6.9153 6.9153 9.4200 9.4200 10.6242 10.6242 k = 0.1740-0.3462 0.2722 ( 8893 PWs) bands (ev): -40.5749 -40.5749 -40.5505 -40.5505 -40.4193 -40.4193 -40.2177 -40.2177 -15.5808 -15.5808 -15.2254 -15.2254 -5.9503 -5.9503 -5.5703 -5.5703 -1.9202 -1.9202 -0.8590 -0.8590 -0.3617 -0.3617 0.0277 0.0277 0.3633 0.3633 0.4573 0.4573 4.4814 4.4814 5.8454 5.8454 6.3624 6.3624 6.9006 6.9006 9.3758 9.3758 10.5708 10.5708 k = 0.1809-0.3600 0.2831 ( 8889 PWs) bands (ev): -40.5739 -40.5739 -40.5515 -40.5515 -40.4192 -40.4192 -40.2178 -40.2178 -15.5792 -15.5792 -15.2258 -15.2258 -5.9722 -5.9722 -5.5805 -5.5805 -1.9132 -1.9132 -0.8159 -0.8159 -0.3421 -0.3421 0.0259 0.0259 0.3709 0.3709 0.4617 0.4617 4.4538 4.4538 5.8766 5.8766 6.3540 6.3540 6.8863 6.8863 9.3320 9.3320 10.5204 10.5204 k = 0.1879-0.3739 0.2940 ( 8897 PWs) bands (ev): -40.5729 -40.5729 -40.5525 -40.5525 -40.4191 -40.4191 -40.2179 -40.2179 -15.5776 -15.5776 -15.2263 -15.2263 -5.9929 -5.9929 -5.5890 -5.5890 -1.9060 -1.9060 -0.7749 -0.7749 -0.3273 -0.3273 0.0238 0.0238 0.3786 0.3786 0.4677 0.4677 4.4256 4.4256 5.9086 5.9086 6.3468 6.3468 6.8726 6.8726 9.2889 9.2889 10.4737 10.4737 k = 0.1948-0.3877 0.3049 ( 8883 PWs) bands (ev): -40.5718 -40.5718 -40.5535 -40.5535 -40.4190 -40.4190 -40.2180 -40.2180 -15.5760 -15.5760 -15.2270 -15.2270 -6.0125 -6.0125 -5.5959 -5.5959 -1.8986 -1.8986 -0.7363 -0.7363 -0.3172 -0.3172 0.0214 0.0214 0.3861 0.3861 0.4751 0.4751 4.3970 4.3970 5.9415 5.9415 6.3407 6.3407 6.8595 6.8595 9.2474 9.2474 10.4313 10.4313 k = 0.2018-0.4016 0.3158 ( 8875 PWs) bands (ev): -40.5707 -40.5707 -40.5546 -40.5546 -40.4189 -40.4189 -40.2181 -40.2181 -15.5744 -15.5744 -15.2277 -15.2277 -6.0307 -6.0307 -5.6011 -5.6011 -1.8911 -1.8911 -0.7004 -0.7004 -0.3119 -0.3119 0.0186 0.0186 0.3936 0.3936 0.4834 0.4834 4.3679 4.3679 5.9753 5.9753 6.3359 6.3359 6.8471 6.8471 9.2079 9.2079 10.3939 10.3939 k = 0.2088-0.4154 0.3267 ( 8877 PWs) bands (ev): -40.5697 -40.5697 -40.5556 -40.5556 -40.4188 -40.4188 -40.2182 -40.2182 -15.5728 -15.5728 -15.2286 -15.2286 -6.0477 -6.0477 -5.6044 -5.6044 -1.8834 -1.8834 -0.6673 -0.6673 -0.3110 -0.3110 0.0155 0.0155 0.4010 0.4010 0.4922 0.4922 4.3383 4.3383 6.0098 6.0098 6.3323 6.3323 6.8355 6.8355 9.1710 9.1710 10.3618 10.3618 k = 0.2157-0.4292 0.3376 ( 8875 PWs) bands (ev): -40.5686 -40.5686 -40.5567 -40.5567 -40.4188 -40.4188 -40.2183 -40.2183 -15.5713 -15.5713 -15.2295 -15.2295 -6.0633 -6.0633 -5.6059 -5.6059 -1.8755 -1.8755 -0.6371 -0.6371 -0.3142 -0.3142 0.0120 0.0120 0.4083 0.4083 0.5009 0.5009 4.3083 4.3083 6.0451 6.0451 6.3301 6.3301 6.8246 6.8246 9.1372 9.1372 10.3356 10.3356 k = 0.2227-0.4431 0.3485 ( 8875 PWs) bands (ev): -40.5675 -40.5675 -40.5578 -40.5578 -40.4187 -40.4187 -40.2183 -40.2183 -15.5697 -15.5697 -15.2306 -15.2306 -6.0774 -6.0774 -5.6054 -5.6054 -1.8675 -1.8675 -0.6102 -0.6102 -0.3213 -0.3213 0.0081 0.0081 0.4154 0.4154 0.5092 0.5092 4.2780 4.2780 6.0810 6.0810 6.3292 6.3292 6.8146 6.8146 9.1069 9.1069 10.3156 10.3156 k = 0.2296-0.4569 0.3594 ( 8876 PWs) bands (ev): -40.5664 -40.5664 -40.5589 -40.5589 -40.4187 -40.4187 -40.2183 -40.2183 -15.5683 -15.5683 -15.2318 -15.2318 -6.0902 -6.0902 -5.6030 -5.6030 -1.8594 -1.8594 -0.5864 -0.5864 -0.3319 -0.3319 0.0039 0.0039 0.4223 0.4223 0.5164 0.5164 4.2472 4.2472 6.1177 6.1177 6.3298 6.3298 6.8056 6.8056 9.0804 9.0804 10.3022 10.3022 k = 0.2366-0.4708 0.3703 ( 8870 PWs) bands (ev): -40.5653 -40.5653 -40.5600 -40.5600 -40.4187 -40.4187 -40.2184 -40.2184 -15.5668 -15.5668 -15.2330 -15.2330 -6.1014 -6.1014 -5.5986 -5.5986 -1.8513 -1.8513 -0.5661 -0.5661 -0.3457 -0.3457 -0.0007 -0.0007 0.4290 0.4290 0.5222 0.5222 4.2162 4.2162 6.1549 6.1549 6.3318 6.3318 6.7974 6.7974 9.0581 9.0581 10.2955 10.2955 k = 0.2436-0.4846 0.3811 ( 8876 PWs) bands (ev): -40.5642 -40.5642 -40.5611 -40.5611 -40.4186 -40.4186 -40.2184 -40.2184 -15.5654 -15.5654 -15.2344 -15.2344 -6.1112 -6.1112 -5.5922 -5.5922 -1.8432 -1.8432 -0.5492 -0.5492 -0.3625 -0.3625 -0.0056 -0.0056 0.4355 0.4355 0.5261 0.5261 4.1849 4.1849 6.1927 6.1927 6.3352 6.3352 6.7902 6.7902 9.0403 9.0403 10.2958 10.2958 k = 0.2505-0.4985 0.3920 ( 8874 PWs) bands (ev): -40.5630 -40.5630 -40.5622 -40.5622 -40.4186 -40.4186 -40.2184 -40.2184 -15.5640 -15.5640 -15.2359 -15.2359 -6.1195 -6.1195 -5.5838 -5.5838 -1.8351 -1.8351 -0.5357 -0.5357 -0.3819 -0.3819 -0.0109 -0.0109 0.4418 0.4418 0.5279 0.5279 4.1533 4.1533 6.2310 6.2310 6.3401 6.3401 6.7840 6.7840 9.0271 9.0271 10.3033 10.3033 k = 0.2575-0.5123 0.4029 ( 8880 PWs) bands (ev): -40.5633 -40.5633 -40.5619 -40.5619 -40.4187 -40.4187 -40.2184 -40.2184 -15.5627 -15.5627 -15.2375 -15.2375 -6.1263 -6.1263 -5.5734 -5.5734 -1.8270 -1.8270 -0.5257 -0.5257 -0.4038 -0.4038 -0.0166 -0.0166 0.4478 0.4478 0.5274 0.5274 4.1216 4.1216 6.2697 6.2697 6.3466 6.3466 6.7788 6.7788 9.0187 9.0187 10.3178 10.3178 k = 0.2644-0.5262 0.4138 ( 8874 PWs) bands (ev): -40.5644 -40.5644 -40.5608 -40.5608 -40.4187 -40.4187 -40.2184 -40.2184 -15.5615 -15.5615 -15.2392 -15.2392 -6.1316 -6.1316 -5.5610 -5.5610 -1.8191 -1.8191 -0.5191 -0.5191 -0.4281 -0.4281 -0.0225 -0.0225 0.4535 0.4535 0.5244 0.5244 4.0897 4.0897 6.3086 6.3086 6.3546 6.3546 6.7746 6.7746 9.0151 9.0151 10.3396 10.3396 k = 0.2714-0.5400 0.4247 ( 8880 PWs) bands (ev): -40.5655 -40.5655 -40.5597 -40.5597 -40.4187 -40.4187 -40.2183 -40.2183 -15.5603 -15.5603 -15.2410 -15.2410 -6.1354 -6.1354 -5.5466 -5.5466 -1.8114 -1.8114 -0.5158 -0.5158 -0.4545 -0.4545 -0.0288 -0.0288 0.4590 0.4590 0.5188 0.5188 4.0577 4.0577 6.3464 6.3464 6.3655 6.3655 6.7715 6.7715 9.0165 9.0165 10.3684 10.3684 k = 0.2784-0.5539 0.4356 ( 8880 PWs) bands (ev): -40.5666 -40.5666 -40.5586 -40.5586 -40.4188 -40.4188 -40.2183 -40.2183 -15.5591 -15.5591 -15.2428 -15.2428 -6.1377 -6.1377 -5.5301 -5.5301 -1.8040 -1.8040 -0.5157 -0.5157 -0.4830 -0.4830 -0.0353 -0.0353 0.4642 0.4642 0.5107 0.5107 4.0257 4.0257 6.3706 6.3706 6.3916 6.3916 6.7693 6.7693 9.0227 9.0227 10.4041 10.4041 k = 0.2853-0.5677 0.4465 ( 8886 PWs) bands (ev): -40.5677 -40.5677 -40.5575 -40.5575 -40.4189 -40.4189 -40.2182 -40.2182 -15.5580 -15.5580 -15.2448 -15.2448 -6.1386 -6.1386 -5.5117 -5.5117 -1.7969 -1.7969 -0.5187 -0.5187 -0.5135 -0.5135 -0.0421 -0.0421 0.4691 0.4691 0.5002 0.5002 3.9937 3.9937 6.3838 6.3838 6.4304 6.4304 6.7681 6.7681 9.0336 9.0336 10.4465 10.4465 k = 0.2923-0.5816 0.4574 ( 8888 PWs) bands (ev): -40.5688 -40.5688 -40.5564 -40.5564 -40.4189 -40.4189 -40.2182 -40.2182 -15.5570 -15.5570 -15.2468 -15.2468 -6.1381 -6.1381 -5.4914 -5.4914 -1.7902 -1.7902 -0.5459 -0.5459 -0.5245 -0.5245 -0.0491 -0.0491 0.4737 0.4737 0.4873 0.4873 3.9618 3.9618 6.3970 6.3970 6.4704 6.4704 6.7679 6.7679 9.0492 9.0492 10.4952 10.4952 k = 0.2923-0.5816 0.4574 ( 8888 PWs) bands (ev): -40.5688 -40.5688 -40.5564 -40.5564 -40.4189 -40.4189 -40.2182 -40.2182 -15.5570 -15.5570 -15.2468 -15.2468 -6.1381 -6.1381 -5.4914 -5.4914 -1.7902 -1.7902 -0.5459 -0.5459 -0.5245 -0.5245 -0.0491 -0.0491 0.4737 0.4737 0.4873 0.4873 3.9618 3.9618 6.3970 6.3970 6.4704 6.4704 6.7679 6.7679 9.0492 9.0492 10.4952 10.4952 k = 0.3053-0.5685 0.4532 ( 8881 PWs) bands (ev): -40.5684 -40.5684 -40.5568 -40.5568 -40.4189 -40.4189 -40.2182 -40.2182 -15.5574 -15.5574 -15.2460 -15.2460 -6.1382 -6.1382 -5.4996 -5.4996 -1.7928 -1.7928 -0.5366 -0.5366 -0.5187 -0.5187 -0.0463 -0.0463 0.4719 0.4719 0.4924 0.4924 3.9749 3.9749 6.3917 6.3917 6.4539 6.4539 6.7680 6.7680 9.0435 9.0435 10.4751 10.4751 k = 0.3182-0.5553 0.4491 ( 8884 PWs) bands (ev): -40.5680 -40.5680 -40.5572 -40.5572 -40.4189 -40.4189 -40.2182 -40.2182 -15.5579 -15.5579 -15.2451 -15.2451 -6.1379 -6.1379 -5.5080 -5.5080 -1.7957 -1.7957 -0.5333 -0.5333 -0.5074 -0.5074 -0.0433 -0.0433 0.4697 0.4697 0.4971 0.4971 3.9899 3.9899 6.3863 6.3863 6.4352 6.4352 6.7685 6.7685 9.0398 9.0398 10.4541 10.4541 k = 0.3312-0.5422 0.4450 ( 8882 PWs) bands (ev): -40.5676 -40.5676 -40.5577 -40.5577 -40.4189 -40.4189 -40.2182 -40.2182 -15.5584 -15.5584 -15.2442 -15.2442 -6.1370 -6.1370 -5.5164 -5.5164 -1.7987 -1.7987 -0.5318 -0.5318 -0.4948 -0.4948 -0.0401 -0.0401 0.4673 0.4673 0.5014 0.5014 4.0064 4.0064 6.3806 6.3806 6.4148 6.4148 6.7693 6.7693 9.0381 9.0381 10.4324 10.4324 k = 0.3442-0.5291 0.4408 ( 8881 PWs) bands (ev): -40.5672 -40.5672 -40.5581 -40.5581 -40.4188 -40.4188 -40.2183 -40.2183 -15.5590 -15.5590 -15.2432 -15.2432 -6.1357 -6.1357 -5.5249 -5.5249 -1.8017 -1.8017 -0.5307 -0.5307 -0.4827 -0.4827 -0.0369 -0.0369 0.4647 0.4647 0.5052 0.5052 4.0243 4.0243 6.3741 6.3741 6.3937 6.3937 6.7704 6.7704 9.0381 9.0381 10.4104 10.4104 k = 0.3572-0.5160 0.4367 ( 8887 PWs) bands (ev): -40.5668 -40.5668 -40.5584 -40.5584 -40.4188 -40.4188 -40.2183 -40.2183 -15.5597 -15.5597 -15.2423 -15.2423 -6.1341 -6.1341 -5.5332 -5.5332 -1.8048 -1.8048 -0.5295 -0.5295 -0.4714 -0.4714 -0.0336 -0.0336 0.4619 0.4619 0.5086 0.5086 4.0430 4.0430 6.3627 6.3627 6.3768 6.3768 6.7716 6.7716 9.0396 9.0396 10.3884 10.3884 k = 0.3702-0.5029 0.4326 ( 8882 PWs) bands (ev): -40.5664 -40.5664 -40.5588 -40.5588 -40.4188 -40.4188 -40.2183 -40.2183 -15.5603 -15.5603 -15.2413 -15.2413 -6.1322 -6.1322 -5.5413 -5.5413 -1.8078 -1.8078 -0.5282 -0.5282 -0.4611 -0.4611 -0.0303 -0.0303 0.4591 0.4591 0.5116 0.5116 4.0623 4.0623 6.3419 6.3419 6.3688 6.3688 6.7729 6.7729 9.0423 9.0423 10.3665 10.3665 k = 0.3832-0.4898 0.4284 ( 8875 PWs) bands (ev): -40.5660 -40.5660 -40.5592 -40.5592 -40.4188 -40.4188 -40.2183 -40.2183 -15.5609 -15.5609 -15.2404 -15.2404 -6.1302 -6.1302 -5.5491 -5.5491 -1.8107 -1.8107 -0.5268 -0.5268 -0.4518 -0.4518 -0.0271 -0.0271 0.4563 0.4563 0.5142 0.5142 4.0818 4.0818 6.3187 6.3187 6.3635 6.3635 6.7743 6.7743 9.0461 9.0461 10.3452 10.3452 k = 0.3961-0.4767 0.4243 ( 8878 PWs) bands (ev): -40.5656 -40.5656 -40.5596 -40.5596 -40.4187 -40.4187 -40.2183 -40.2183 -15.5615 -15.5615 -15.2395 -15.2395 -6.1280 -6.1280 -5.5565 -5.5565 -1.8135 -1.8135 -0.5253 -0.5253 -0.4436 -0.4436 -0.0240 -0.0240 0.4536 0.4536 0.5164 0.5164 4.1010 4.1010 6.2955 6.2955 6.3591 6.3591 6.7757 6.7757 9.0507 9.0507 10.3249 10.3249 k = 0.4091-0.4636 0.4202 ( 8886 PWs) bands (ev): -40.5653 -40.5653 -40.5600 -40.5600 -40.4187 -40.4187 -40.2184 -40.2184 -15.5621 -15.5621 -15.2387 -15.2387 -6.1258 -6.1258 -5.5634 -5.5634 -1.8159 -1.8159 -0.5239 -0.5239 -0.4363 -0.4363 -0.0211 -0.0211 0.4510 0.4510 0.5183 0.5183 4.1194 4.1194 6.2732 6.2732 6.3551 6.3551 6.7770 6.7770 9.0557 9.0557 10.3057 10.3057 k = 0.4221-0.4505 0.4160 ( 8879 PWs) bands (ev): -40.5649 -40.5649 -40.5604 -40.5604 -40.4187 -40.4187 -40.2184 -40.2184 -15.5626 -15.5626 -15.2380 -15.2380 -6.1237 -6.1237 -5.5696 -5.5696 -1.8182 -1.8182 -0.5226 -0.5226 -0.4301 -0.4301 -0.0185 -0.0185 0.4486 0.4486 0.5199 0.5199 4.1366 4.1366 6.2524 6.2524 6.3517 6.3517 6.7782 6.7782 9.0608 9.0608 10.2882 10.2882 k = 0.4351-0.4374 0.4119 ( 8881 PWs) bands (ev): -40.5645 -40.5645 -40.5607 -40.5607 -40.4187 -40.4187 -40.2184 -40.2184 -15.5631 -15.5631 -15.2373 -15.2373 -6.1217 -6.1217 -5.5750 -5.5750 -1.8201 -1.8201 -0.5213 -0.5213 -0.4249 -0.4249 -0.0161 -0.0161 0.4465 0.4465 0.5212 0.5212 4.1521 4.1521 6.2337 6.2337 6.3487 6.3487 6.7792 6.7792 9.0657 9.0657 10.2727 10.2727 k = 0.4481-0.4243 0.4078 ( 8884 PWs) bands (ev): -40.5641 -40.5641 -40.5611 -40.5611 -40.4187 -40.4187 -40.2184 -40.2184 -15.5634 -15.5634 -15.2368 -15.2368 -6.1200 -6.1200 -5.5797 -5.5797 -1.8217 -1.8217 -0.5202 -0.5202 -0.4207 -0.4207 -0.0142 -0.0142 0.4447 0.4447 0.5222 0.5222 4.1655 4.1655 6.2176 6.2176 6.3463 6.3463 6.7802 6.7802 9.0702 9.0702 10.2595 10.2595 k = 0.4611-0.4111 0.4036 ( 8886 PWs) bands (ev): -40.5638 -40.5638 -40.5615 -40.5615 -40.4187 -40.4187 -40.2184 -40.2184 -15.5637 -15.5637 -15.2364 -15.2364 -6.1186 -6.1186 -5.5833 -5.5833 -1.8230 -1.8230 -0.5193 -0.5193 -0.4174 -0.4174 -0.0126 -0.0126 0.4432 0.4432 0.5229 0.5229 4.1764 4.1764 6.2046 6.2046 6.3444 6.3444 6.7809 6.7809 9.0740 9.0740 10.2488 10.2488 k = 0.4740-0.3980 0.3995 ( 8884 PWs) bands (ev): -40.5634 -40.5634 -40.5619 -40.5619 -40.4187 -40.4187 -40.2184 -40.2184 -15.5640 -15.5640 -15.2361 -15.2361 -6.1175 -6.1175 -5.5860 -5.5860 -1.8239 -1.8239 -0.5187 -0.5187 -0.4151 -0.4151 -0.0114 -0.0114 0.4421 0.4421 0.5235 0.5235 4.1845 4.1845 6.1950 6.1950 6.3430 6.3430 6.7814 6.7814 9.0769 9.0769 10.2411 10.2411 k = 0.4870-0.3849 0.3954 ( 8885 PWs) bands (ev): -40.5631 -40.5631 -40.5622 -40.5622 -40.4187 -40.4187 -40.2184 -40.2184 -15.5641 -15.5641 -15.2359 -15.2359 -6.1168 -6.1168 -5.5877 -5.5877 -1.8245 -1.8245 -0.5183 -0.5183 -0.4137 -0.4137 -0.0107 -0.0107 0.4414 0.4414 0.5238 0.5238 4.1894 4.1894 6.1891 6.1891 6.3422 6.3422 6.7817 6.7817 9.0787 9.0787 10.2363 10.2363 k = 0.5000-0.3718 0.3912 ( 8892 PWs) bands (ev): -40.5629 -40.5629 -40.5624 -40.5624 -40.4187 -40.4187 -40.2184 -40.2184 -15.5641 -15.5641 -15.2358 -15.2358 -6.1166 -6.1166 -5.5882 -5.5882 -1.8247 -1.8247 -0.5181 -0.5181 -0.4132 -0.4132 -0.0105 -0.0105 0.4412 0.4412 0.5239 0.5239 4.1911 4.1911 6.1871 6.1871 6.3419 6.3419 6.7819 6.7819 9.0793 9.0793 10.2347 10.2347 k = 0.5000-0.3718 0.3912 ( 8892 PWs) bands (ev): -40.5629 -40.5629 -40.5624 -40.5624 -40.4187 -40.4187 -40.2184 -40.2184 -15.5641 -15.5641 -15.2358 -15.2358 -6.1166 -6.1166 -5.5882 -5.5882 -1.8247 -1.8247 -0.5181 -0.5181 -0.4132 -0.4132 -0.0105 -0.0105 0.4412 0.4412 0.5239 0.5239 4.1911 4.1911 6.1871 6.1871 6.3419 6.3419 6.7819 6.7819 9.0793 9.0793 10.2347 10.2347 k = 0.4951-0.3621 0.4068 ( 8894 PWs) bands (ev): -40.5629 -40.5629 -40.5624 -40.5624 -40.4186 -40.4186 -40.2184 -40.2184 -15.5640 -15.5640 -15.2356 -15.2356 -6.1161 -6.1161 -5.5878 -5.5878 -1.8247 -1.8247 -0.5187 -0.5187 -0.4132 -0.4132 -0.0115 -0.0115 0.4353 0.4353 0.5278 0.5278 4.1915 4.1915 6.1873 6.1873 6.3366 6.3366 6.7790 6.7790 9.0830 9.0830 10.2364 10.2364 k = 0.4902-0.3523 0.4223 ( 8888 PWs) bands (ev): -40.5628 -40.5628 -40.5624 -40.5624 -40.4186 -40.4186 -40.2184 -40.2184 -15.5636 -15.5636 -15.2349 -15.2349 -6.1145 -6.1145 -5.5864 -5.5864 -1.8249 -1.8249 -0.5204 -0.5204 -0.4132 -0.4132 -0.0146 -0.0146 0.4200 0.4200 0.5373 0.5373 4.1927 4.1927 6.1877 6.1877 6.3211 6.3211 6.7704 6.7704 9.0938 9.0938 10.2416 10.2416 k = 0.4853-0.3426 0.4378 ( 8886 PWs) bands (ev): -40.5628 -40.5628 -40.5623 -40.5623 -40.4186 -40.4186 -40.2184 -40.2184 -15.5629 -15.5629 -15.2339 -15.2339 -6.1118 -6.1118 -5.5841 -5.5841 -1.8252 -1.8252 -0.5233 -0.5233 -0.4131 -0.4131 -0.0196 -0.0196 0.3988 0.3988 0.5490 0.5490 4.1948 4.1948 6.1883 6.1883 6.2956 6.2956 6.7562 6.7562 9.1114 9.1114 10.2500 10.2500 k = 0.4804-0.3328 0.4534 ( 8884 PWs) bands (ev): -40.5628 -40.5628 -40.5623 -40.5623 -40.4185 -40.4185 -40.2183 -40.2183 -15.5620 -15.5620 -15.2324 -15.2324 -6.1081 -6.1081 -5.5809 -5.5809 -1.8255 -1.8255 -0.5274 -0.5274 -0.4131 -0.4131 -0.0265 -0.0265 0.3735 0.3735 0.5609 0.5609 4.1978 4.1978 6.1890 6.1890 6.2606 6.2606 6.7366 6.7366 9.1355 9.1355 10.2618 10.2618 k = 0.4755-0.3230 0.4689 ( 8882 PWs) bands (ev): -40.5627 -40.5627 -40.5622 -40.5622 -40.4184 -40.4184 -40.2183 -40.2183 -15.5608 -15.5608 -15.2304 -15.2304 -6.1034 -6.1034 -5.5767 -5.5767 -1.8260 -1.8260 -0.5329 -0.5329 -0.4131 -0.4131 -0.0350 -0.0350 0.3450 0.3450 0.5725 0.5725 4.2015 4.2015 6.1891 6.1891 6.2177 6.2177 6.7118 6.7118 9.1653 9.1653 10.2767 10.2767 k = 0.4706-0.3133 0.4844 ( 8876 PWs) bands (ev): -40.5626 -40.5626 -40.5622 -40.5622 -40.4183 -40.4183 -40.2182 -40.2182 -15.5593 -15.5593 -15.2281 -15.2281 -6.0976 -6.0976 -5.5717 -5.5717 -1.8266 -1.8266 -0.5399 -0.5399 -0.4133 -0.4133 -0.0450 -0.0450 0.3139 0.3139 0.5833 0.5833 4.2060 4.2060 6.1628 6.1628 6.1930 6.1930 6.6823 6.6823 9.2003 9.2003 10.2945 10.2945 k = 0.4657-0.3035 0.5000 ( 8882 PWs) bands (ev): -40.5625 -40.5625 -40.5621 -40.5621 -40.4182 -40.4182 -40.2182 -40.2182 -15.5575 -15.5575 -15.2253 -15.2253 -6.0908 -6.0908 -5.5658 -5.5658 -1.8272 -1.8272 -0.5485 -0.5485 -0.4136 -0.4136 -0.0562 -0.0562 0.2803 0.2803 0.5933 0.5933 4.2112 4.2112 6.1045 6.1045 6.1929 6.1929 6.6485 6.6485 9.2397 9.2397 10.3152 10.3152 k = 0.4608-0.2938 0.5155 ( 8888 PWs) bands (ev): -40.5625 -40.5625 -40.5620 -40.5620 -40.4181 -40.4181 -40.2181 -40.2181 -15.5556 -15.5556 -15.2222 -15.2222 -6.0829 -6.0829 -5.5591 -5.5591 -1.8280 -1.8280 -0.5589 -0.5589 -0.4141 -0.4141 -0.0684 -0.0684 0.2444 0.2444 0.6026 0.6026 4.2171 4.2171 6.0392 6.0392 6.1930 6.1930 6.6109 6.6109 9.2829 9.2829 10.3385 10.3385 k = 0.4559-0.2840 0.5310 ( 8894 PWs) bands (ev): -40.5624 -40.5624 -40.5619 -40.5619 -40.4180 -40.4180 -40.2180 -40.2180 -15.5533 -15.5533 -15.2187 -15.2187 -6.0741 -6.0741 -5.5515 -5.5515 -1.8289 -1.8289 -0.5713 -0.5713 -0.4151 -0.4151 -0.0811 -0.0811 0.2066 0.2066 0.6112 0.6112 4.2236 4.2236 5.9683 5.9683 6.1922 6.1922 6.5705 6.5705 9.3291 9.3291 10.3643 10.3643 k = 0.4510-0.2743 0.5466 ( 8888 PWs) bands (ev): -40.5622 -40.5622 -40.5618 -40.5618 -40.4178 -40.4178 -40.2179 -40.2179 -15.5509 -15.5509 -15.2148 -15.2148 -6.0644 -6.0644 -5.5430 -5.5430 -1.8299 -1.8299 -0.5859 -0.5859 -0.4166 -0.4166 -0.0940 -0.0940 0.1671 0.1671 0.6191 0.6191 4.2306 4.2306 5.8926 5.8926 6.1897 6.1897 6.5282 6.5282 9.3778 9.3778 10.3923 10.3923 k = 0.4461-0.2645 0.5621 ( 8880 PWs) bands (ev): -40.5621 -40.5621 -40.5617 -40.5617 -40.4177 -40.4177 -40.2178 -40.2178 -15.5482 -15.5482 -15.2105 -15.2105 -6.0536 -6.0536 -5.5338 -5.5338 -1.8310 -1.8310 -0.6028 -0.6028 -0.4188 -0.4188 -0.1069 -0.1069 0.1263 0.1263 0.6264 0.6264 4.2381 4.2381 5.8131 5.8131 6.1843 6.1843 6.4857 6.4857 9.4283 9.4283 10.4224 10.4224 k = 0.4412-0.2548 0.5776 ( 8884 PWs) bands (ev): -40.5620 -40.5620 -40.5615 -40.5615 -40.4175 -40.4175 -40.2177 -40.2177 -15.5453 -15.5453 -15.2059 -15.2059 -6.0420 -6.0420 -5.5238 -5.5238 -1.8322 -1.8322 -0.6221 -0.6221 -0.4220 -0.4220 -0.1195 -0.1195 0.0845 0.0845 0.6333 0.6333 4.2459 4.2459 5.7305 5.7305 6.1740 6.1740 6.4451 6.4451 9.4801 9.4801 10.4544 10.4544 k = 0.4363-0.2450 0.5932 ( 8884 PWs) bands (ev): -40.5618 -40.5618 -40.5614 -40.5614 -40.4173 -40.4173 -40.2176 -40.2176 -15.5421 -15.5421 -15.2009 -15.2009 -6.0295 -6.0295 -5.5130 -5.5130 -1.8335 -1.8335 -0.6441 -0.6441 -0.4266 -0.4266 -0.1314 -0.1314 0.0422 0.0422 0.6396 0.6396 4.2539 4.2539 5.6456 5.6456 6.1563 6.1563 6.4094 6.4094 9.5328 9.5328 10.4880 10.4880 k = 0.4314-0.2353 0.6087 ( 8880 PWs) bands (ev): -40.5617 -40.5617 -40.5612 -40.5612 -40.4171 -40.4171 -40.2175 -40.2175 -15.5388 -15.5388 -15.1956 -15.1956 -6.0162 -6.0162 -5.5015 -5.5015 -1.8350 -1.8350 -0.6686 -0.6686 -0.4331 -0.4331 -0.1425 -0.1425 0.0002 0.0002 0.6456 0.6456 4.2619 4.2619 5.5591 5.5591 6.1286 6.1286 6.3815 6.3815 9.5861 9.5861 10.5232 10.5232 k = 0.4265-0.2255 0.6243 ( 8892 PWs) bands (ev): -40.5615 -40.5615 -40.5611 -40.5611 -40.4169 -40.4169 -40.2174 -40.2174 -15.5353 -15.5353 -15.1901 -15.1901 -6.0020 -6.0020 -5.4894 -5.4894 -1.8365 -1.8365 -0.6957 -0.6957 -0.4421 -0.4421 -0.1525 -0.1525 -0.0408 -0.0408 0.6513 0.6513 4.2696 4.2696 5.4717 5.4717 6.0899 6.0899 6.3628 6.3628 9.6394 9.6394 10.5598 10.5598 k = 0.4216-0.2158 0.6398 ( 8896 PWs) bands (ev): -40.5613 -40.5613 -40.5609 -40.5609 -40.4166 -40.4166 -40.2173 -40.2173 -15.5317 -15.5317 -15.1842 -15.1842 -5.9871 -5.9871 -5.4765 -5.4765 -1.8381 -1.8381 -0.7253 -0.7253 -0.4544 -0.4544 -0.1615 -0.1615 -0.0797 -0.0797 0.6566 0.6566 4.2767 4.2767 5.3843 5.3843 6.0414 6.0414 6.3523 6.3523 9.6927 9.6927 10.5975 10.5975 k = 0.4167-0.2060 0.6553 ( 8890 PWs) bands (ev): -40.5612 -40.5612 -40.5607 -40.5607 -40.4164 -40.4164 -40.2171 -40.2171 -15.5278 -15.5278 -15.1781 -15.1781 -5.9714 -5.9714 -5.4631 -5.4631 -1.8399 -1.8399 -0.7572 -0.7572 -0.4710 -0.4710 -0.1694 -0.1694 -0.1155 -0.1155 0.6617 0.6617 4.2828 4.2828 5.2976 5.2976 5.9854 5.9854 6.3480 6.3480 9.7455 9.7455 10.6364 10.6364 k = 0.4118-0.1962 0.6709 ( 8886 PWs) bands (ev): -40.5610 -40.5610 -40.5605 -40.5605 -40.4162 -40.4162 -40.2170 -40.2170 -15.5238 -15.5238 -15.1718 -15.1718 -5.9550 -5.9550 -5.4491 -5.4491 -1.8417 -1.8417 -0.7912 -0.7912 -0.4926 -0.4926 -0.1762 -0.1762 -0.1471 -0.1471 0.6665 0.6665 4.2873 4.2873 5.2126 5.2126 5.9243 5.9243 6.3479 6.3479 9.7976 9.7976 10.6763 10.6763 k = 0.4069-0.1865 0.6864 ( 8882 PWs) bands (ev): -40.5608 -40.5608 -40.5604 -40.5604 -40.4159 -40.4159 -40.2169 -40.2169 -15.5197 -15.5197 -15.1652 -15.1652 -5.9380 -5.9380 -5.4345 -5.4345 -1.8437 -1.8437 -0.8271 -0.8271 -0.5199 -0.5199 -0.1825 -0.1825 -0.1733 -0.1733 0.6712 0.6712 4.2895 4.2895 5.1304 5.1304 5.8595 5.8595 6.3508 6.3508 9.8488 9.8488 10.7170 10.7170 k = 0.4020-0.1767 0.7019 ( 8874 PWs) bands (ev): -40.5606 -40.5606 -40.5602 -40.5602 -40.4156 -40.4156 -40.2167 -40.2167 -15.5155 -15.5155 -15.1585 -15.1585 -5.9204 -5.9204 -5.4195 -5.4195 -1.8457 -1.8457 -0.8647 -0.8647 -0.5529 -0.5529 -0.1965 -0.1965 -0.1856 -0.1856 0.6756 0.6756 4.2882 4.2882 5.0523 5.0523 5.7922 5.7922 6.3557 6.3557 9.8990 9.8990 10.7585 10.7585 k = 0.3971-0.1670 0.7175 ( 8874 PWs) bands (ev): -40.5604 -40.5604 -40.5600 -40.5600 -40.4154 -40.4154 -40.2166 -40.2166 -15.5112 -15.5112 -15.1516 -15.1516 -5.9023 -5.9023 -5.4040 -5.4040 -1.8479 -1.8479 -0.9036 -0.9036 -0.5912 -0.5912 -0.2129 -0.2129 -0.1897 -0.1897 0.6799 0.6799 4.2823 4.2823 4.9799 4.9799 5.7234 5.7234 6.3620 6.3620 9.9479 9.9479 10.8007 10.8007 k = 0.3922-0.1572 0.7330 ( 8868 PWs) bands (ev): -40.5602 -40.5602 -40.5598 -40.5598 -40.4151 -40.4151 -40.2164 -40.2164 -15.5068 -15.5068 -15.1445 -15.1445 -5.8836 -5.8836 -5.3882 -5.3882 -1.8501 -1.8501 -0.9437 -0.9437 -0.6338 -0.6338 -0.2254 -0.2254 -0.1927 -0.1927 0.6840 0.6840 4.2701 4.2701 4.9151 4.9151 5.6536 5.6536 6.3694 6.3694 9.9953 9.9953 10.8434 10.8434 k = 0.3873-0.1475 0.7485 ( 8878 PWs) bands (ev): -40.5600 -40.5600 -40.5596 -40.5596 -40.4148 -40.4148 -40.2163 -40.2163 -15.5023 -15.5023 -15.1374 -15.1374 -5.8646 -5.8646 -5.3720 -5.3720 -1.8524 -1.8524 -0.9846 -0.9846 -0.6797 -0.6797 -0.2346 -0.2346 -0.1949 -0.1949 0.6880 0.6880 4.2499 4.2499 4.8596 4.8596 5.5832 5.5832 6.3777 6.3777 10.0409 10.0409 10.8866 10.8866 k = 0.3824-0.1377 0.7641 ( 8882 PWs) bands (ev): -40.5598 -40.5598 -40.5594 -40.5594 -40.4146 -40.4146 -40.2161 -40.2161 -15.4978 -15.4978 -15.1301 -15.1301 -5.8452 -5.8452 -5.3555 -5.3555 -1.8548 -1.8548 -1.0261 -1.0261 -0.7281 -0.7281 -0.2412 -0.2412 -0.1964 -0.1964 0.6918 0.6918 4.2205 4.2205 4.8151 4.8151 5.5128 5.5128 6.3865 6.3865 10.0847 10.0847 10.9302 10.9302 k = 0.3775-0.1280 0.7796 ( 8886 PWs) bands (ev): -40.5596 -40.5596 -40.5592 -40.5592 -40.4143 -40.4143 -40.2160 -40.2160 -15.4932 -15.4932 -15.1228 -15.1228 -5.8255 -5.8255 -5.3388 -5.3388 -1.8573 -1.8573 -1.0680 -1.0680 -0.7781 -0.7781 -0.2459 -0.2459 -0.1973 -0.1973 0.6955 0.6955 4.1814 4.1814 4.7821 4.7821 5.4427 5.4427 6.3958 6.3958 10.1264 10.1264 10.9741 10.9741 k = 0.3725-0.1182 0.7951 ( 8888 PWs) bands (ev): -40.5594 -40.5594 -40.5590 -40.5590 -40.4140 -40.4140 -40.2158 -40.2158 -15.4886 -15.4886 -15.1155 -15.1155 -5.8056 -5.8056 -5.3219 -5.3219 -1.8598 -1.8598 -1.1100 -1.1100 -0.8290 -0.8290 -0.2492 -0.2492 -0.1978 -0.1978 0.6990 0.6990 4.1335 4.1335 4.7599 4.7599 5.3731 5.3731 6.4054 6.4054 10.1657 10.1657 11.0183 11.0183 k = 0.3676-0.1085 0.8107 ( 8888 PWs) bands (ev): -40.5591 -40.5591 -40.5588 -40.5588 -40.4137 -40.4137 -40.2157 -40.2157 -15.4840 -15.4840 -15.1081 -15.1081 -5.7855 -5.7855 -5.3050 -5.3050 -1.8624 -1.8624 -1.1519 -1.1519 -0.8802 -0.8802 -0.2514 -0.2514 -0.1978 -0.1978 0.7024 0.7024 4.0783 4.0783 4.7472 4.7472 5.3043 5.3043 6.4153 6.4153 10.2023 10.2023 11.0626 11.0626 k = 0.3627-0.0987 0.8262 ( 8882 PWs) bands (ev): -40.5589 -40.5589 -40.5585 -40.5585 -40.4135 -40.4135 -40.2155 -40.2155 -15.4794 -15.4794 -15.1008 -15.1008 -5.7653 -5.7653 -5.2880 -5.2880 -1.8650 -1.8650 -1.1935 -1.1935 -0.9315 -0.9315 -0.2528 -0.2528 -0.1975 -0.1975 0.7057 0.7057 4.0179 4.0179 4.7420 4.7420 5.2366 5.2366 6.4254 6.4254 10.2361 10.2361 11.1071 11.1071 k = 0.3578-0.0889 0.8417 ( 8888 PWs) bands (ev): -40.5587 -40.5587 -40.5583 -40.5583 -40.4132 -40.4132 -40.2154 -40.2154 -15.4749 -15.4749 -15.0935 -15.0935 -5.7451 -5.7451 -5.2710 -5.2710 -1.8677 -1.8677 -1.2346 -1.2346 -0.9823 -0.9823 -0.2538 -0.2538 -0.1968 -0.1968 0.7089 0.7089 3.9542 3.9542 4.7425 4.7425 5.1703 5.1703 6.4356 6.4356 10.2667 10.2667 11.1515 11.1515 k = 0.3529-0.0792 0.8573 ( 8892 PWs) bands (ev): -40.5585 -40.5585 -40.5581 -40.5581 -40.4129 -40.4129 -40.2152 -40.2152 -15.4704 -15.4704 -15.0863 -15.0863 -5.7250 -5.7250 -5.2541 -5.2541 -1.8704 -1.8704 -1.2750 -1.2750 -1.0323 -1.0323 -0.2543 -0.2543 -0.1959 -0.1959 0.7119 0.7119 3.8888 3.8888 4.7472 4.7472 5.1055 5.1055 6.4458 6.4458 10.2938 10.2938 11.1958 11.1958 k = 0.3480-0.0694 0.8728 ( 8886 PWs) bands (ev): -40.5583 -40.5583 -40.5579 -40.5579 -40.4126 -40.4126 -40.2151 -40.2151 -15.4660 -15.4660 -15.0792 -15.0792 -5.7051 -5.7051 -5.2373 -5.2373 -1.8731 -1.8731 -1.3147 -1.3147 -1.0814 -1.0814 -0.2545 -0.2545 -0.1948 -0.1948 0.7148 0.7148 3.8228 3.8228 4.7551 4.7551 5.0424 5.0424 6.4560 6.4560 10.3173 10.3173 11.2399 11.2399 k = 0.3431-0.0597 0.8883 ( 8884 PWs) bands (ev): -40.5581 -40.5581 -40.5578 -40.5578 -40.4124 -40.4124 -40.2149 -40.2149 -15.4617 -15.4617 -15.0722 -15.0722 -5.6854 -5.6854 -5.2208 -5.2208 -1.8758 -1.8758 -1.3533 -1.3533 -1.1292 -1.1292 -0.2546 -0.2546 -0.1935 -0.1935 0.7175 0.7175 3.7573 3.7573 4.7652 4.7652 4.9812 4.9812 6.4661 6.4661 10.3368 10.3368 11.2837 11.2837 k = 0.3382-0.0499 0.9039 ( 8884 PWs) bands (ev): -40.5579 -40.5579 -40.5576 -40.5576 -40.4121 -40.4121 -40.2148 -40.2148 -15.4574 -15.4574 -15.0654 -15.0654 -5.6660 -5.6660 -5.2046 -5.2046 -1.8785 -1.8785 -1.3907 -1.3907 -1.1756 -1.1756 -0.2546 -0.2546 -0.1921 -0.1921 0.7201 0.7201 3.6930 3.6930 4.7768 4.7768 4.9222 4.9222 6.4761 6.4761 10.3524 10.3524 11.3272 11.3272 k = 0.3333-0.0402 0.9194 ( 8878 PWs) bands (ev): -40.5578 -40.5578 -40.5574 -40.5574 -40.4119 -40.4119 -40.2146 -40.2146 -15.4533 -15.4533 -15.0587 -15.0587 -5.6470 -5.6470 -5.1888 -5.1888 -1.8812 -1.8812 -1.4269 -1.4269 -1.2203 -1.2203 -0.2546 -0.2546 -0.1907 -0.1907 0.7226 0.7226 3.6304 3.6304 4.7894 4.7894 4.8655 4.8655 6.4859 6.4859 10.3638 10.3638 11.3702 11.3702 k = 0.3284-0.0304 0.9349 ( 8884 PWs) bands (ev): -40.5576 -40.5576 -40.5572 -40.5572 -40.4117 -40.4117 -40.2145 -40.2145 -15.4494 -15.4494 -15.0523 -15.0523 -5.6285 -5.6285 -5.1734 -5.1734 -1.8839 -1.8839 -1.4616 -1.4616 -1.2633 -1.2633 -0.2545 -0.2545 -0.1891 -0.1891 0.7250 0.7250 3.5700 3.5700 4.8006 4.8006 4.8133 4.8133 6.4954 6.4954 10.3713 10.3713 11.4125 11.4125 k = 0.3235-0.0207 0.9505 ( 8876 PWs) bands (ev): -40.5574 -40.5574 -40.5570 -40.5570 -40.4114 -40.4114 -40.2144 -40.2144 -15.4456 -15.4456 -15.0462 -15.0462 -5.6106 -5.6106 -5.1585 -5.1585 -1.8865 -1.8865 -1.4949 -1.4949 -1.3043 -1.3043 -0.2545 -0.2545 -0.1876 -0.1876 0.7271 0.7271 3.5121 3.5121 4.7585 4.7585 4.8174 4.8174 6.5046 6.5046 10.3750 10.3750 11.4541 11.4541 k = 0.3186-0.0109 0.9660 ( 8882 PWs) bands (ev): -40.5572 -40.5572 -40.5569 -40.5569 -40.4112 -40.4112 -40.2142 -40.2142 -15.4419 -15.4419 -15.0403 -15.0403 -5.5934 -5.5934 -5.1442 -5.1442 -1.8890 -1.8890 -1.5264 -1.5264 -1.3433 -1.3433 -0.2546 -0.2546 -0.1860 -0.1860 0.7292 0.7292 3.4571 3.4571 4.7096 4.7096 4.8310 4.8310 6.5135 6.5135 10.3751 10.3751 11.4948 11.4948 k = 0.3137-0.0012 0.9815 ( 8882 PWs) bands (ev): -40.5571 -40.5571 -40.5567 -40.5567 -40.4110 -40.4110 -40.2141 -40.2141 -15.4384 -15.4384 -15.0347 -15.0347 -5.5769 -5.5769 -5.1305 -5.1305 -1.8914 -1.8914 -1.5563 -1.5563 -1.3801 -1.3801 -0.2547 -0.2547 -0.1845 -0.1845 0.7311 0.7311 3.4051 3.4051 4.6634 4.6634 4.8447 4.8447 6.5220 6.5220 10.3721 10.3721 11.5345 11.5345 k = 0.3088 0.0086 0.9971 ( 8886 PWs) bands (ev): -40.5569 -40.5569 -40.5566 -40.5566 -40.4108 -40.4108 -40.2140 -40.2140 -15.4352 -15.4352 -15.0294 -15.0294 -5.5612 -5.5612 -5.1175 -5.1175 -1.8938 -1.8938 -1.5842 -1.5842 -1.4145 -1.4145 -0.2549 -0.2549 -0.1830 -0.1830 0.7329 0.7329 3.3563 3.3563 4.6200 4.6200 4.8580 4.8580 6.5301 6.5301 10.3665 10.3665 11.5730 11.5730 k = 0.3039 0.0183 1.0126 ( 8884 PWs) bands (ev): -40.5568 -40.5568 -40.5565 -40.5565 -40.4106 -40.4106 -40.2139 -40.2139 -15.4321 -15.4321 -15.0244 -15.0244 -5.5464 -5.5464 -5.1053 -5.1053 -1.8960 -1.8960 -1.6103 -1.6103 -1.4466 -1.4466 -0.2551 -0.2551 -0.1815 -0.1815 0.7345 0.7345 3.3110 3.3110 4.5798 4.5798 4.8709 4.8709 6.5377 6.5377 10.3588 10.3588 11.6101 11.6101 k = 0.2990 0.0281 1.0282 ( 8888 PWs) bands (ev): -40.5567 -40.5567 -40.5563 -40.5563 -40.4105 -40.4105 -40.2138 -40.2138 -15.4293 -15.4293 -15.0198 -15.0198 -5.5327 -5.5327 -5.0939 -5.0939 -1.8981 -1.8981 -1.6344 -1.6344 -1.4761 -1.4761 -0.2554 -0.2554 -0.1801 -0.1801 0.7360 0.7360 3.2693 3.2693 4.5426 4.5426 4.8831 4.8831 6.5447 6.5447 10.3495 10.3495 11.6455 11.6455 k = 0.2941 0.0379 1.0437 ( 8892 PWs) bands (ev): -40.5566 -40.5566 -40.5562 -40.5562 -40.4103 -40.4103 -40.2138 -40.2138 -15.4267 -15.4267 -15.0156 -15.0156 -5.5199 -5.5199 -5.0835 -5.0835 -1.9000 -1.9000 -1.6563 -1.6563 -1.5031 -1.5031 -0.2557 -0.2557 -0.1789 -0.1789 0.7373 0.7373 3.2312 3.2312 4.5088 4.5088 4.8946 4.8946 6.5513 6.5513 10.3393 10.3393 11.6791 11.6791 k = 0.2892 0.0476 1.0592 ( 8890 PWs) bands (ev): -40.5565 -40.5565 -40.5561 -40.5561 -40.4102 -40.4102 -40.2137 -40.2137 -15.4243 -15.4243 -15.0117 -15.0117 -5.5084 -5.5084 -5.0739 -5.0739 -1.9018 -1.9018 -1.6762 -1.6762 -1.5275 -1.5275 -0.2560 -0.2560 -0.1777 -0.1777 0.7385 0.7385 3.1969 3.1969 4.4782 4.4782 4.9052 4.9052 6.5572 6.5572 10.3287 10.3287 11.7106 11.7106 k = 0.2843 0.0574 1.0748 ( 8890 PWs) bands (ev): -40.5564 -40.5564 -40.5560 -40.5560 -40.4100 -40.4100 -40.2136 -40.2136 -15.4222 -15.4222 -15.0083 -15.0083 -5.4980 -5.4980 -5.0654 -5.0654 -1.9034 -1.9034 -1.6938 -1.6938 -1.5491 -1.5491 -0.2564 -0.2564 -0.1766 -0.1766 0.7395 0.7395 3.1664 3.1664 4.4511 4.4511 4.9148 4.9148 6.5625 6.5625 10.3181 10.3181 11.7397 11.7397 k = 0.2794 0.0671 1.0903 ( 8882 PWs) bands (ev): -40.5563 -40.5563 -40.5559 -40.5559 -40.4099 -40.4099 -40.2135 -40.2135 -15.4203 -15.4203 -15.0053 -15.0053 -5.4889 -5.4889 -5.0579 -5.0579 -1.9048 -1.9048 -1.7092 -1.7092 -1.5680 -1.5680 -0.2568 -0.2568 -0.1757 -0.1757 0.7404 0.7404 3.1399 3.1399 4.4275 4.4275 4.9233 4.9233 6.5672 6.5672 10.3080 10.3080 11.7660 11.7660 k = 0.2745 0.0769 1.1058 ( 8882 PWs) bands (ev): -40.5562 -40.5562 -40.5559 -40.5559 -40.4098 -40.4098 -40.2135 -40.2135 -15.4188 -15.4188 -15.0028 -15.0028 -5.4811 -5.4811 -5.0515 -5.0515 -1.9060 -1.9060 -1.7223 -1.7223 -1.5840 -1.5840 -0.2571 -0.2571 -0.1749 -0.1749 0.7412 0.7412 3.1174 3.1174 4.4074 4.4074 4.9306 4.9306 6.5712 6.5712 10.2988 10.2988 11.7892 11.7892 k = 0.2696 0.0866 1.1214 ( 8876 PWs) bands (ev): -40.5562 -40.5562 -40.5558 -40.5558 -40.4098 -40.4098 -40.2134 -40.2134 -15.4175 -15.4175 -15.0007 -15.0007 -5.4746 -5.4746 -5.0462 -5.0462 -1.9070 -1.9070 -1.7331 -1.7331 -1.5972 -1.5972 -0.2574 -0.2574 -0.1742 -0.1742 0.7418 0.7418 3.0989 3.0989 4.3908 4.3908 4.9367 4.9367 6.5745 6.5745 10.2909 10.2909 11.8089 11.8089 k = 0.2647 0.0964 1.1369 ( 8884 PWs) bands (ev): -40.5561 -40.5561 -40.5558 -40.5558 -40.4097 -40.4097 -40.2134 -40.2134 -15.4165 -15.4165 -14.9990 -14.9990 -5.4695 -5.4695 -5.0420 -5.0420 -1.9078 -1.9078 -1.7415 -1.7415 -1.6074 -1.6074 -0.2577 -0.2577 -0.1737 -0.1737 0.7423 0.7423 3.0844 3.0844 4.3779 4.3779 4.9415 4.9415 6.5770 6.5770 10.2844 10.2844 11.8248 11.8248 k = 0.2598 0.1061 1.1524 ( 8890 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4097 -40.4097 -40.2134 -40.2134 -15.4157 -15.4157 -14.9978 -14.9978 -5.4659 -5.4659 -5.0390 -5.0390 -1.9084 -1.9084 -1.7475 -1.7475 -1.6148 -1.6148 -0.2578 -0.2578 -0.1733 -0.1733 0.7426 0.7426 3.0741 3.0741 4.3687 4.3687 4.9450 4.9450 6.5789 6.5789 10.2797 10.2797 11.8364 11.8364 k = 0.2549 0.1159 1.1680 ( 8886 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4153 -15.4153 -14.9971 -14.9971 -5.4637 -5.4637 -5.0373 -5.0373 -1.9087 -1.9087 -1.7511 -1.7511 -1.6192 -1.6192 -0.2580 -0.2580 -0.1731 -0.1731 0.7428 0.7428 3.0679 3.0679 4.3632 4.3632 4.9471 4.9471 6.5800 6.5800 10.2768 10.2768 11.8435 11.8435 k = 0.2500 0.1256 1.1835 ( 8888 PWs) bands (ev): -40.5561 -40.5561 -40.5557 -40.5557 -40.4096 -40.4096 -40.2134 -40.2134 -15.4151 -15.4151 -14.9969 -14.9969 -5.4630 -5.4630 -5.0367 -5.0367 -1.9088 -1.9088 -1.7523 -1.7523 -1.6207 -1.6207 -0.2580 -0.2580 -0.1730 -0.1730 0.7429 0.7429 3.0658 3.0658 4.3613 4.3613 4.9478 4.9478 6.5804 6.5804 10.2758 10.2758 11.8459 11.8459 k = 0.0631-0.1256 1.1835 ( 8867 PWs) bands (ev): -40.5564 -40.5564 -40.5556 -40.5556 -40.4098 -40.4098 -40.2135 -40.2135 -15.4170 -15.4170 -15.0040 -15.0040 -5.4633 -5.4633 -5.0070 -5.0070 -1.9241 -1.9241 -1.7245 -1.7245 -1.6051 -1.6051 -0.2729 -0.2729 -0.2190 -0.2190 0.6939 0.6939 3.1151 3.1151 4.5051 4.5051 4.8818 4.8818 6.6216 6.6216 10.1713 10.1713 11.5063 11.5063 k = 0.0680-0.1353 1.1681 ( 8865 PWs) bands (ev): -40.5567 -40.5567 -40.5554 -40.5554 -40.4099 -40.4099 -40.2135 -40.2135 -15.4181 -15.4181 -15.0065 -15.0065 -5.4717 -5.4717 -5.0105 -5.0105 -1.9199 -1.9199 -1.7153 -1.7153 -1.5904 -1.5904 -0.2766 -0.2766 -0.2180 -0.2180 0.6931 0.6931 3.1382 3.1382 4.5212 4.5212 4.8650 4.8650 6.6252 6.6252 10.1838 10.1838 11.4970 11.4970 k = 0.0729-0.1450 1.1526 ( 8873 PWs) bands (ev): -40.5570 -40.5570 -40.5553 -40.5553 -40.4100 -40.4100 -40.2136 -40.2136 -15.4195 -15.4195 -15.0095 -15.0095 -5.4815 -5.4815 -5.0150 -5.0150 -1.9154 -1.9154 -1.7041 -1.7041 -1.5729 -1.5729 -0.2804 -0.2804 -0.2173 -0.2173 0.6921 0.6921 3.1655 3.1655 4.5406 4.5406 4.8469 4.8469 6.6281 6.6281 10.1979 10.1979 11.4870 11.4870 k = 0.0778-0.1547 1.1372 ( 8877 PWs) bands (ev): -40.5572 -40.5572 -40.5552 -40.5552 -40.4101 -40.4101 -40.2136 -40.2136 -15.4211 -15.4211 -15.0129 -15.0129 -5.4924 -5.4924 -5.0206 -5.0206 -1.9107 -1.9107 -1.6907 -1.6907 -1.5526 -1.5526 -0.2840 -0.2840 -0.2167 -0.2167 0.6910 0.6910 3.1970 3.1970 4.5635 4.5635 4.8276 4.8276 6.6304 6.6304 10.2133 10.2133 11.4768 11.4768 k = 0.0826-0.1644 1.1217 ( 8879 PWs) bands (ev): -40.5575 -40.5575 -40.5551 -40.5551 -40.4102 -40.4102 -40.2137 -40.2137 -15.4230 -15.4230 -15.0167 -15.0167 -5.5046 -5.5046 -5.0272 -5.0272 -1.9058 -1.9058 -1.6750 -1.6750 -1.5297 -1.5297 -0.2876 -0.2876 -0.2162 -0.2162 0.6897 0.6897 3.2325 3.2325 4.5896 4.5896 4.8073 4.8073 6.6321 6.6321 10.2295 10.2295 11.4670 11.4670 k = 0.0875-0.1741 1.1063 ( 8883 PWs) bands (ev): -40.5578 -40.5578 -40.5550 -40.5550 -40.4104 -40.4104 -40.2138 -40.2138 -15.4252 -15.4252 -15.0209 -15.0209 -5.5179 -5.5179 -5.0348 -5.0348 -1.9008 -1.9008 -1.6572 -1.6572 -1.5042 -1.5042 -0.2912 -0.2912 -0.2159 -0.2159 0.6882 0.6882 3.2721 3.2721 4.6190 4.6190 4.7860 4.7860 6.6332 6.6332 10.2460 10.2460 11.4581 11.4581 k = 0.0924-0.1838 1.0908 ( 8883 PWs) bands (ev): -40.5581 -40.5581 -40.5549 -40.5549 -40.4105 -40.4105 -40.2138 -40.2138 -15.4276 -15.4276 -15.0255 -15.0255 -5.5323 -5.5323 -5.0434 -5.0434 -1.8957 -1.8957 -1.6371 -1.6371 -1.4762 -1.4762 -0.2946 -0.2946 -0.2158 -0.2158 0.6866 0.6866 3.3156 3.3156 4.6515 4.6515 4.7639 4.7639 6.6336 6.6336 10.2624 10.2624 11.4507 11.4507 k = 0.0973-0.1935 1.0754 ( 8881 PWs) bands (ev): -40.5585 -40.5585 -40.5549 -40.5549 -40.4107 -40.4107 -40.2139 -40.2139 -15.4302 -15.4302 -15.0304 -15.0304 -5.5476 -5.5476 -5.0528 -5.0528 -1.8907 -1.8907 -1.6148 -1.6148 -1.4457 -1.4457 -0.2979 -0.2979 -0.2158 -0.2158 0.6849 0.6849 3.3628 3.3628 4.6870 4.6870 4.7413 4.7413 6.6335 6.6335 10.2779 10.2779 11.4454 11.4454 k = 0.1021-0.2032 1.0599 ( 8879 PWs) bands (ev): -40.5588 -40.5588 -40.5548 -40.5548 -40.4109 -40.4109 -40.2140 -40.2140 -15.4331 -15.4331 -15.0357 -15.0357 -5.5639 -5.5639 -5.0631 -5.0631 -1.8857 -1.8857 -1.5904 -1.5904 -1.4129 -1.4129 -0.3010 -0.3010 -0.2160 -0.2160 0.6830 0.6830 3.4138 3.4138 4.7150 4.7150 4.7285 4.7285 6.6328 6.6328 10.2920 10.2920 11.4431 11.4431 k = 0.1070-0.2129 1.0445 ( 8879 PWs) bands (ev): -40.5591 -40.5591 -40.5548 -40.5548 -40.4111 -40.4111 -40.2141 -40.2141 -15.4361 -15.4361 -15.0414 -15.0414 -5.5810 -5.5810 -5.0742 -5.0742 -1.8808 -1.8808 -1.5640 -1.5640 -1.3779 -1.3779 -0.3040 -0.3040 -0.2163 -0.2163 0.6810 0.6810 3.4683 3.4683 4.6930 4.6930 4.7683 4.7683 6.6315 6.6315 10.3038 10.3038 11.4444 11.4444 k = 0.1119-0.2226 1.0290 ( 8886 PWs) bands (ev): -40.5595 -40.5595 -40.5547 -40.5547 -40.4113 -40.4113 -40.2142 -40.2142 -15.4394 -15.4394 -15.0473 -15.0473 -5.5989 -5.5989 -5.0859 -5.0859 -1.8760 -1.8760 -1.5356 -1.5356 -1.3407 -1.3407 -0.3068 -0.3068 -0.2167 -0.2167 0.6788 0.6788 3.5261 3.5261 4.6689 4.6689 4.8127 4.8127 6.6297 6.6297 10.3128 10.3128 11.4500 11.4500 k = 0.1168-0.2323 1.0136 ( 8896 PWs) bands (ev): -40.5598 -40.5598 -40.5547 -40.5547 -40.4116 -40.4116 -40.2144 -40.2144 -15.4428 -15.4428 -15.0535 -15.0535 -5.6174 -5.6174 -5.0984 -5.0984 -1.8714 -1.8714 -1.5052 -1.5052 -1.3016 -1.3016 -0.3094 -0.3094 -0.2172 -0.2172 0.6765 0.6765 3.5871 3.5871 4.6446 4.6446 4.8600 4.8600 6.6274 6.6274 10.3183 10.3183 11.4605 11.4605 k = 0.1216-0.2420 0.9981 ( 8902 PWs) bands (ev): -40.5602 -40.5602 -40.5547 -40.5547 -40.4118 -40.4118 -40.2145 -40.2145 -15.4465 -15.4465 -15.0599 -15.0599 -5.6365 -5.6365 -5.1114 -5.1114 -1.8668 -1.8668 -1.4731 -1.4731 -1.2607 -1.2607 -0.3117 -0.3117 -0.2178 -0.2178 0.6740 0.6740 3.6511 3.6511 4.6204 4.6204 4.9100 4.9100 6.6247 6.6247 10.3198 10.3198 11.4764 11.4764 k = 0.1265-0.2517 0.9827 ( 8908 PWs) bands (ev): -40.5605 -40.5605 -40.5547 -40.5547 -40.4120 -40.4120 -40.2146 -40.2146 -15.4502 -15.4502 -15.0666 -15.0666 -5.6561 -5.6561 -5.1250 -5.1250 -1.8623 -1.8623 -1.4394 -1.4394 -1.2180 -1.2180 -0.3137 -0.3137 -0.2184 -0.2184 0.6715 0.6715 3.7176 3.7176 4.5966 4.5966 4.9625 4.9625 6.6215 6.6215 10.3169 10.3169 11.4980 11.4980 k = 0.1314-0.2614 0.9672 ( 8907 PWs) bands (ev): -40.5609 -40.5609 -40.5547 -40.5547 -40.4123 -40.4123 -40.2147 -40.2147 -15.4541 -15.4541 -15.0735 -15.0735 -5.6762 -5.6762 -5.1390 -5.1390 -1.8580 -1.8580 -1.4041 -1.4041 -1.1740 -1.1740 -0.3152 -0.3152 -0.2190 -0.2190 0.6688 0.6688 3.7864 3.7864 4.5736 4.5736 5.0174 5.0174 6.6179 6.6179 10.3094 10.3094 11.5254 11.5254 k = 0.1363-0.2711 0.9518 ( 8902 PWs) bands (ev): -40.5612 -40.5612 -40.5547 -40.5547 -40.4125 -40.4125 -40.2149 -40.2149 -15.4582 -15.4582 -15.0806 -15.0806 -5.6966 -5.6966 -5.1535 -5.1535 -1.8538 -1.8538 -1.3674 -1.3674 -1.1286 -1.1286 -0.3162 -0.3162 -0.2197 -0.2197 0.6660 0.6660 3.8569 3.8569 4.5517 4.5517 5.0745 5.0745 6.6138 6.6138 10.2972 10.2972 11.5585 11.5585 k = 0.1411-0.2808 0.9363 ( 8906 PWs) bands (ev): -40.5616 -40.5616 -40.5548 -40.5548 -40.4128 -40.4128 -40.2150 -40.2150 -15.4623 -15.4623 -15.0878 -15.0878 -5.7172 -5.7172 -5.1682 -5.1682 -1.8498 -1.8498 -1.3295 -1.3295 -1.0823 -1.0823 -0.3166 -0.3166 -0.2203 -0.2203 0.6630 0.6630 3.9282 3.9282 4.5319 4.5319 5.1338 5.1338 6.6095 6.6095 10.2806 10.2806 11.5123 11.5123 k = 0.1460-0.2905 0.9209 ( 8908 PWs) bands (ev): -40.5619 -40.5619 -40.5548 -40.5548 -40.4131 -40.4131 -40.2151 -40.2151 -15.4665 -15.4665 -15.0951 -15.0951 -5.7380 -5.7380 -5.1833 -5.1833 -1.8458 -1.8458 -1.2905 -1.2905 -1.0353 -1.0353 -0.3163 -0.3163 -0.2208 -0.2208 0.6600 0.6600 3.9990 3.9990 4.5154 4.5154 5.1950 5.1950 6.6048 6.6048 10.2596 10.2596 11.4626 11.4626 k = 0.1509-0.3002 0.9054 ( 8900 PWs) bands (ev): -40.5623 -40.5623 -40.5548 -40.5548 -40.4134 -40.4134 -40.2153 -40.2153 -15.4708 -15.4708 -15.1025 -15.1025 -5.7589 -5.7589 -5.1985 -5.1985 -1.8420 -1.8420 -1.2506 -1.2506 -0.9879 -0.9879 -0.3149 -0.3149 -0.2212 -0.2212 0.6569 0.6569 4.0671 4.0671 4.5043 4.5043 5.2579 5.2579 6.5998 6.5998 10.2345 10.2345 11.4134 11.4134 k = 0.1558-0.3099 0.8900 ( 8897 PWs) bands (ev): -40.5627 -40.5627 -40.5549 -40.5549 -40.4136 -40.4136 -40.2154 -40.2154 -15.4752 -15.4752 -15.1100 -15.1100 -5.7799 -5.7799 -5.2139 -5.2139 -1.8383 -1.8383 -1.2099 -1.2099 -0.9405 -0.9405 -0.3123 -0.3123 -0.2215 -0.2215 0.6537 0.6537 4.1288 4.1288 4.5024 4.5024 5.3225 5.3225 6.5946 6.5946 10.2058 10.2058 11.3647 11.3647 k = 0.1606-0.3196 0.8745 ( 8897 PWs) bands (ev): -40.5630 -40.5630 -40.5549 -40.5549 -40.4139 -40.4139 -40.2156 -40.2156 -15.4795 -15.4795 -15.1175 -15.1175 -5.8007 -5.8007 -5.2293 -5.2293 -1.8348 -1.8348 -1.1686 -1.1686 -0.8936 -0.8936 -0.3081 -0.3081 -0.2215 -0.2215 0.6504 0.6504 4.1783 4.1783 4.5150 4.5150 5.3885 5.3885 6.5892 6.5892 10.1736 10.1736 11.3165 11.3165 k = 0.1655-0.3293 0.8591 ( 8897 PWs) bands (ev): -40.5634 -40.5634 -40.5550 -40.5550 -40.4142 -40.4142 -40.2157 -40.2157 -15.4839 -15.4839 -15.1250 -15.1250 -5.8214 -5.8214 -5.2448 -5.2448 -1.8314 -1.8314 -1.1270 -1.1270 -0.8478 -0.8478 -0.3020 -0.3020 -0.2213 -0.2213 0.6470 0.6470 4.2102 4.2102 4.5477 4.5477 5.4557 5.4557 6.5835 6.5835 10.1383 10.1383 11.2689 11.2689 k = 0.1704-0.3390 0.8436 ( 8901 PWs) bands (ev): -40.5637 -40.5637 -40.5551 -40.5551 -40.4145 -40.4145 -40.2159 -40.2159 -15.4884 -15.4884 -15.1325 -15.1325 -5.8420 -5.8420 -5.2602 -5.2602 -1.8281 -1.8281 -1.0852 -1.0852 -0.8036 -0.8036 -0.2934 -0.2934 -0.2208 -0.2208 0.6436 0.6436 4.2239 4.2239 4.6008 4.6008 5.5239 5.5239 6.5778 6.5778 10.1003 10.1003 11.2220 11.2220 k = 0.1753-0.3487 0.8282 ( 8897 PWs) bands (ev): -40.5641 -40.5641 -40.5551 -40.5551 -40.4148 -40.4148 -40.2160 -40.2160 -15.4928 -15.4928 -15.1400 -15.1400 -5.8622 -5.8622 -5.2754 -5.2754 -1.8250 -1.8250 -1.0434 -1.0434 -0.7619 -0.7619 -0.2819 -0.2819 -0.2199 -0.2199 0.6400 0.6400 4.2240 4.2240 4.6697 4.6697 5.5929 5.5929 6.5719 6.5719 10.0597 10.0597 11.1759 11.1759 k = 0.1801-0.3585 0.8127 ( 8897 PWs) bands (ev): -40.5644 -40.5644 -40.5552 -40.5552 -40.4151 -40.4151 -40.2162 -40.2162 -15.4971 -15.4971 -15.1474 -15.1474 -5.8821 -5.8821 -5.2906 -5.2906 -1.8220 -1.8220 -1.0019 -1.0019 -0.7233 -0.7233 -0.2669 -0.2669 -0.2185 -0.2185 0.6364 0.6364 4.2158 4.2158 4.7488 4.7488 5.6624 5.6624 6.5660 6.5660 10.0169 10.0169 11.1305 11.1305 k = 0.1850-0.3682 0.7973 ( 8893 PWs) bands (ev): -40.5647 -40.5647 -40.5553 -40.5553 -40.4153 -40.4153 -40.2163 -40.2163 -15.5014 -15.5014 -15.1546 -15.1546 -5.9016 -5.9016 -5.3055 -5.3055 -1.8192 -1.8192 -0.9609 -0.9609 -0.6887 -0.6887 -0.2478 -0.2478 -0.2165 -0.2165 0.6328 0.6328 4.2029 4.2029 4.8344 4.8344 5.7323 5.7323 6.5600 6.5600 9.9721 9.9721 11.0859 11.0859 k = 0.1899-0.3779 0.7818 ( 8897 PWs) bands (ev): -40.5650 -40.5650 -40.5554 -40.5554 -40.4156 -40.4156 -40.2164 -40.2164 -15.5057 -15.5057 -15.1618 -15.1618 -5.9206 -5.9206 -5.3201 -5.3201 -1.8165 -1.8165 -0.9207 -0.9207 -0.6584 -0.6584 -0.2245 -0.2245 -0.2135 -0.2135 0.6290 0.6290 4.1876 4.1876 4.9241 4.9241 5.8022 5.8022 6.5541 6.5541 9.9254 9.9254 11.0422 11.0422 k = 0.1948-0.3876 0.7664 ( 8897 PWs) bands (ev): -40.5654 -40.5654 -40.5554 -40.5554 -40.4159 -40.4159 -40.2166 -40.2166 -15.5099 -15.5099 -15.1688 -15.1688 -5.9391 -5.9391 -5.3343 -5.3343 -1.8139 -1.8139 -0.8815 -0.8815 -0.6329 -0.6329 -0.2113 -0.2113 -0.1955 -0.1955 0.6252 0.6252 4.1709 4.1709 5.0165 5.0165 5.8719 5.8719 6.5482 6.5482 9.8772 9.8772 10.9994 10.9994 k = 0.1996-0.3973 0.7509 ( 8905 PWs) bands (ev): -40.5657 -40.5657 -40.5555 -40.5555 -40.4162 -40.4162 -40.2167 -40.2167 -15.5140 -15.5140 -15.1756 -15.1756 -5.9571 -5.9571 -5.3482 -5.3482 -1.8115 -1.8115 -0.8435 -0.8435 -0.6119 -0.6119 -0.2070 -0.2070 -0.1634 -0.1634 0.6213 0.6213 4.1537 4.1537 5.1105 5.1105 5.9411 5.9411 6.5424 6.5424 9.8275 9.8275 10.9577 10.9577 k = 0.2045-0.4070 0.7355 ( 8906 PWs) bands (ev): -40.5660 -40.5660 -40.5556 -40.5556 -40.4164 -40.4164 -40.2169 -40.2169 -15.5179 -15.5179 -15.1823 -15.1823 -5.9744 -5.9744 -5.3617 -5.3617 -1.8092 -1.8092 -0.8071 -0.8071 -0.5952 -0.5952 -0.2020 -0.2020 -0.1275 -0.1275 0.6174 0.6174 4.1365 4.1365 5.2055 5.2055 6.0095 6.0095 6.5368 6.5368 9.7766 9.7766 10.9170 10.9170 k = 0.2094-0.4167 0.7200 ( 8906 PWs) bands (ev): -40.5662 -40.5662 -40.5557 -40.5557 -40.4167 -40.4167 -40.2170 -40.2170 -15.5218 -15.5218 -15.1887 -15.1887 -5.9910 -5.9910 -5.3747 -5.3747 -1.8071 -1.8071 -0.7725 -0.7725 -0.5822 -0.5822 -0.1960 -0.1960 -0.0886 -0.0886 0.6133 0.6133 4.1194 4.1194 5.3008 5.3008 6.0768 6.0768 6.5313 6.5313 9.7246 9.7246 10.8775 10.8775 k = 0.2143-0.4264 0.7046 ( 8908 PWs) bands (ev): -40.5665 -40.5665 -40.5557 -40.5557 -40.4169 -40.4169 -40.2171 -40.2171 -15.5255 -15.5255 -15.1948 -15.1948 -6.0070 -6.0070 -5.3872 -5.3872 -1.8051 -1.8051 -0.7399 -0.7399 -0.5721 -0.5721 -0.1891 -0.1891 -0.0478 -0.0478 0.6091 0.6091 4.1028 4.1028 5.3959 5.3959 6.1427 6.1427 6.5261 6.5261 9.6719 9.6719 10.8392 10.8392 k = 0.2191-0.4361 0.6891 ( 8910 PWs) bands (ev): -40.5668 -40.5668 -40.5558 -40.5558 -40.4171 -40.4171 -40.2172 -40.2172 -15.5290 -15.5290 -15.2007 -15.2007 -6.0221 -6.0221 -5.3991 -5.3991 -1.8032 -1.8032 -0.7096 -0.7096 -0.5645 -0.5645 -0.1811 -0.1811 -0.0056 -0.0056 0.6048 0.6048 4.0868 4.0868 5.4904 5.4904 6.2068 6.2068 6.5213 6.5213 9.6186 9.6186 10.8023 10.8023 k = 0.2240-0.4458 0.6737 ( 8912 PWs) bands (ev): -40.5670 -40.5670 -40.5559 -40.5559 -40.4174 -40.4174 -40.2173 -40.2173 -15.5324 -15.5324 -15.2064 -15.2064 -6.0365 -6.0365 -5.4104 -5.4104 -1.8015 -1.8015 -0.6817 -0.6817 -0.5588 -0.5588 -0.1721 -0.1721 0.0370 0.0370 0.6003 0.6003 4.0715 4.0715 5.5836 5.5836 6.2685 6.2685 6.5170 6.5170 9.5650 9.5650 10.7669 10.7669 k = 0.2289-0.4555 0.6582 ( 8918 PWs) bands (ev): -40.5673 -40.5673 -40.5560 -40.5560 -40.4176 -40.4176 -40.2175 -40.2175 -15.5356 -15.5356 -15.2117 -15.2117 -6.0500 -6.0500 -5.4211 -5.4211 -1.7999 -1.7999 -0.6563 -0.6563 -0.5546 -0.5546 -0.1622 -0.1622 0.0796 0.0796 0.5957 0.5957 4.0571 4.0571 5.6751 5.6751 6.3274 6.3274 6.5136 6.5136 9.5114 9.5114 10.7329 10.7329 k = 0.2338-0.4652 0.6428 ( 8910 PWs) bands (ev): -40.5675 -40.5675 -40.5560 -40.5560 -40.4178 -40.4178 -40.2176 -40.2176 -15.5386 -15.5386 -15.2167 -15.2167 -6.0627 -6.0627 -5.4312 -5.4312 -1.7984 -1.7984 -0.6335 -0.6335 -0.5516 -0.5516 -0.1514 -0.1514 0.1216 0.1216 0.5908 0.5908 4.0434 4.0434 5.7643 5.7643 6.3822 6.3822 6.5118 6.5118 9.4581 9.4581 10.7007 10.7007 k = 0.2386-0.4749 0.6273 ( 8900 PWs) bands (ev): -40.5677 -40.5677 -40.5561 -40.5561 -40.4179 -40.4179 -40.2176 -40.2176 -15.5415 -15.5415 -15.2213 -15.2213 -6.0744 -6.0744 -5.4405 -5.4405 -1.7971 -1.7971 -0.6134 -0.6134 -0.5494 -0.5494 -0.1399 -0.1399 0.1625 0.1625 0.5856 0.5856 4.0308 4.0308 5.8506 5.8506 6.4302 6.4302 6.5141 6.5141 9.4057 9.4057 10.6703 10.6703 k = 0.2435-0.4846 0.6119 ( 8900 PWs) bands (ev): -40.5679 -40.5679 -40.5561 -40.5561 -40.4181 -40.4181 -40.2177 -40.2177 -15.5441 -15.5441 -15.2256 -15.2256 -6.0853 -6.0853 -5.4491 -5.4491 -1.7959 -1.7959 -0.5957 -0.5957 -0.5479 -0.5479 -0.1280 -0.1280 0.2020 0.2020 0.5800 0.5800 4.0191 4.0191 5.9334 5.9334 6.4631 6.4631 6.5286 6.5286 9.3545 9.3545 10.6418 10.6418 k = 0.2484-0.4943 0.5964 ( 8898 PWs) bands (ev): -40.5680 -40.5680 -40.5562 -40.5562 -40.4183 -40.4183 -40.2178 -40.2178 -15.5465 -15.5465 -15.2296 -15.2296 -6.0951 -6.0951 -5.4570 -5.4570 -1.7948 -1.7948 -0.5805 -0.5805 -0.5469 -0.5469 -0.1159 -0.1159 0.2398 0.2398 0.5741 0.5741 4.0084 4.0084 6.0119 6.0119 6.4752 6.4752 6.5606 6.5606 9.3050 9.3050 10.6154 10.6154 k = 0.2533-0.5040 0.5810 ( 8894 PWs) bands (ev): -40.5682 -40.5682 -40.5562 -40.5562 -40.4184 -40.4184 -40.2179 -40.2179 -15.5486 -15.5486 -15.2331 -15.2331 -6.1040 -6.1040 -5.4641 -5.4641 -1.7938 -1.7938 -0.5675 -0.5675 -0.5462 -0.5462 -0.1040 -0.1040 0.2756 0.2756 0.5676 0.5676 3.9987 3.9987 6.0854 6.0854 6.4774 6.4774 6.5988 6.5988 9.2579 9.2579 10.5913 10.5913 k = 0.2581-0.5137 0.5655 ( 8897 PWs) bands (ev): -40.5683 -40.5683 -40.5563 -40.5563 -40.4185 -40.4185 -40.2179 -40.2179 -15.5506 -15.5506 -15.2363 -15.2363 -6.1119 -6.1119 -5.4704 -5.4704 -1.7930 -1.7930 -0.5566 -0.5566 -0.5458 -0.5458 -0.0927 -0.0927 0.3093 0.3093 0.5605 0.5605 3.9902 3.9902 6.1532 6.1532 6.4769 6.4769 6.6358 6.6358 9.2139 9.2139 10.5695 10.5695 k = 0.2630-0.5234 0.5501 ( 8904 PWs) bands (ev): -40.5684 -40.5684 -40.5563 -40.5563 -40.4186 -40.4186 -40.2180 -40.2180 -15.5522 -15.5522 -15.2391 -15.2391 -6.1188 -6.1188 -5.4760 -5.4760 -1.7922 -1.7922 -0.5479 -0.5479 -0.5453 -0.5453 -0.0821 -0.0821 0.3407 0.3407 0.5526 0.5526 3.9827 3.9827 6.2143 6.2143 6.4756 6.4756 6.6694 6.6694 9.1735 9.1735 10.5503 10.5503 k = 0.2679-0.5331 0.5346 ( 8900 PWs) bands (ev): -40.5685 -40.5685 -40.5564 -40.5564 -40.4187 -40.4187 -40.2181 -40.2181 -15.5537 -15.5537 -15.2414 -15.2414 -6.1247 -6.1247 -5.4807 -5.4807 -1.7916 -1.7916 -0.5459 -0.5459 -0.5399 -0.5399 -0.0726 -0.0726 0.3697 0.3697 0.5439 0.5439 3.9764 3.9764 6.2679 6.2679 6.4741 6.4741 6.6988 6.6988 9.1376 9.1376 10.5338 10.5338 k = 0.2728-0.5428 0.5192 ( 8896 PWs) bands (ev): -40.5686 -40.5686 -40.5564 -40.5564 -40.4188 -40.4188 -40.2181 -40.2181 -15.5548 -15.5548 -15.2434 -15.2434 -6.1295 -6.1295 -5.4845 -5.4845 -1.7911 -1.7911 -0.5458 -0.5458 -0.5342 -0.5342 -0.0644 -0.0644 0.3963 0.3963 0.5341 0.5341 3.9711 3.9711 6.3132 6.3132 6.4728 6.4728 6.7233 6.7233 9.1070 9.1070 10.5201 10.5201 k = 0.2776-0.5525 0.5037 ( 8891 PWs) bands (ev): -40.5687 -40.5687 -40.5564 -40.5564 -40.4189 -40.4189 -40.2181 -40.2181 -15.5558 -15.5558 -15.2449 -15.2449 -6.1332 -6.1332 -5.4875 -5.4875 -1.7907 -1.7907 -0.5458 -0.5458 -0.5299 -0.5299 -0.0579 -0.0579 0.4205 0.4205 0.5232 0.5232 3.9671 3.9671 6.3494 6.3494 6.4717 6.4717 6.7426 6.7426 9.0822 9.0822 10.5093 10.5093 k = 0.2825-0.5622 0.4883 ( 8889 PWs) bands (ev): -40.5687 -40.5687 -40.5564 -40.5564 -40.4189 -40.4189 -40.2181 -40.2181 -15.5564 -15.5564 -15.2459 -15.2459 -6.1359 -6.1359 -5.4897 -5.4897 -1.7904 -1.7904 -0.5458 -0.5458 -0.5269 -0.5269 -0.0530 -0.0530 0.4423 0.4423 0.5110 0.5110 3.9642 3.9642 6.3757 6.3757 6.4709 6.4709 6.7566 6.7566 9.0641 9.0641 10.5015 10.5015 k = 0.2874-0.5719 0.4728 ( 8887 PWs) bands (ev): -40.5688 -40.5688 -40.5564 -40.5564 -40.4189 -40.4189 -40.2182 -40.2182 -15.5568 -15.5568 -15.2466 -15.2466 -6.1375 -6.1375 -5.4910 -5.4910 -1.7903 -1.7903 -0.5459 -0.5459 -0.5251 -0.5251 -0.0501 -0.0501 0.4615 0.4615 0.4976 0.4976 3.9624 3.9624 6.3917 6.3917 6.4705 6.4705 6.7650 6.7650 9.0529 9.0529 10.4968 10.4968 k = 0.2923-0.5816 0.4574 ( 8888 PWs) bands (ev): -40.5688 -40.5688 -40.5564 -40.5564 -40.4189 -40.4189 -40.2182 -40.2182 -15.5570 -15.5570 -15.2468 -15.2468 -6.1381 -6.1381 -5.4914 -5.4914 -1.7902 -1.7902 -0.5459 -0.5459 -0.5245 -0.5245 -0.0491 -0.0491 0.4737 0.4737 0.4873 0.4873 3.9618 3.9618 6.3970 6.3970 6.4704 6.4704 6.7679 6.7679 9.0492 9.0492 10.4952 10.4952 k = 0.7077-0.1621 0.3251 ( 8888 PWs) bands (ev): -40.5688 -40.5688 -40.5564 -40.5564 -40.4189 -40.4189 -40.2182 -40.2182 -15.5570 -15.5570 -15.2468 -15.2468 -6.1381 -6.1381 -5.4914 -5.4914 -1.7902 -1.7902 -0.5459 -0.5459 -0.5245 -0.5245 -0.0491 -0.0491 0.4737 0.4737 0.4873 0.4873 3.9618 3.9618 6.3970 6.3970 6.4704 6.4704 6.7679 6.7679 9.0492 9.0492 10.4952 10.4952 k = 0.7008-0.1483 0.3142 ( 8886 PWs) bands (ev): -40.5698 -40.5698 -40.5554 -40.5554 -40.4190 -40.4190 -40.2181 -40.2181 -15.5560 -15.5560 -15.2489 -15.2489 -6.1361 -6.1361 -5.4693 -5.4693 -1.7841 -1.7841 -0.5801 -0.5801 -0.5330 -0.5330 -0.0563 -0.0563 0.4723 0.4723 0.4780 0.4780 3.9302 3.9302 6.4112 6.4112 6.5105 6.5105 6.7686 6.7686 9.0691 9.0691 10.5496 10.5496 k = 0.6939-0.1345 0.3034 ( 8880 PWs) bands (ev): -40.5709 -40.5709 -40.5543 -40.5543 -40.4191 -40.4191 -40.2180 -40.2180 -15.5550 -15.5550 -15.2510 -15.2510 -6.1329 -6.1329 -5.4454 -5.4454 -1.7786 -1.7786 -0.6161 -0.6161 -0.5439 -0.5439 -0.0637 -0.0637 0.4553 0.4553 0.4820 0.4820 3.8988 3.8988 6.4264 6.4264 6.5507 6.5507 6.7702 6.7702 9.0931 9.0931 10.6095 10.6095 k = 0.6870-0.1207 0.2926 ( 8878 PWs) bands (ev): -40.5719 -40.5719 -40.5533 -40.5533 -40.4192 -40.4192 -40.2179 -40.2179 -15.5542 -15.5542 -15.2532 -15.2532 -6.1284 -6.1284 -5.4197 -5.4197 -1.7737 -1.7737 -0.6539 -0.6539 -0.5569 -0.5569 -0.0712 -0.0712 0.4367 0.4367 0.4857 0.4857 3.8677 3.8677 6.4426 6.4426 6.5909 6.5909 6.7727 6.7727 9.1211 9.1211 10.6740 10.6740 k = 0.6800-0.1070 0.2817 ( 8878 PWs) bands (ev): -40.5729 -40.5729 -40.5523 -40.5523 -40.4194 -40.4194 -40.2178 -40.2178 -15.5534 -15.5534 -15.2555 -15.2555 -6.1227 -6.1227 -5.3924 -5.3924 -1.7697 -1.7697 -0.6935 -0.6935 -0.5718 -0.5718 -0.0789 -0.0789 0.4166 0.4166 0.4892 0.4892 3.8369 3.8369 6.4597 6.4597 6.6309 6.6309 6.7760 6.7760 9.1526 9.1526 10.7425 10.7425 k = 0.6731-0.0932 0.2709 ( 8882 PWs) bands (ev): -40.5739 -40.5739 -40.5513 -40.5513 -40.4195 -40.4195 -40.2177 -40.2177 -15.5526 -15.5526 -15.2577 -15.2577 -6.1158 -6.1158 -5.3635 -5.3635 -1.7666 -1.7666 -0.7349 -0.7349 -0.5882 -0.5882 -0.0866 -0.0866 0.3954 0.3954 0.4923 0.4923 3.8065 3.8065 6.4776 6.4776 6.6707 6.6707 6.7800 6.7800 9.1874 9.1874 10.8140 10.8140 k = 0.6662-0.0794 0.2601 ( 8898 PWs) bands (ev): -40.5749 -40.5749 -40.5503 -40.5503 -40.4196 -40.4196 -40.2176 -40.2176 -15.5519 -15.5519 -15.2600 -15.2600 -6.1078 -6.1078 -5.3330 -5.3330 -1.7644 -1.7644 -0.7780 -0.7780 -0.6059 -0.6059 -0.0943 -0.0943 0.3733 0.3733 0.4952 0.4952 3.7766 3.7766 6.4963 6.4963 6.7102 6.7102 6.7848 6.7848 9.2250 9.2250 10.8870 10.8870 k = 0.6593-0.0656 0.2492 ( 8906 PWs) bands (ev): -40.5758 -40.5758 -40.5494 -40.5494 -40.4198 -40.4198 -40.2174 -40.2174 -15.5513 -15.5513 -15.2623 -15.2623 -6.0989 -6.0989 -5.3011 -5.3011 -1.7634 -1.7634 -0.8227 -0.8227 -0.6244 -0.6244 -0.1021 -0.1021 0.3506 0.3506 0.4978 0.4978 3.7473 3.7473 6.5155 6.5155 6.7492 6.7492 6.7902 6.7902 9.2651 9.2651 10.9599 10.9599 k = 0.6523-0.0518 0.2384 ( 8906 PWs) bands (ev): -40.5767 -40.5767 -40.5485 -40.5485 -40.4199 -40.4199 -40.2173 -40.2173 -15.5507 -15.5507 -15.2646 -15.2646 -6.0890 -6.0890 -5.2680 -5.2680 -1.7636 -1.7636 -0.8688 -0.8688 -0.6436 -0.6436 -0.1099 -0.1099 0.3275 0.3275 0.5001 0.5001 3.7185 3.7185 6.5353 6.5353 6.7877 6.7877 6.7962 6.7962 9.3072 9.3072 11.0305 11.0305 k = 0.6454-0.0381 0.2276 ( 8906 PWs) bands (ev): -40.5776 -40.5776 -40.5476 -40.5476 -40.4201 -40.4201 -40.2172 -40.2172 -15.5501 -15.5501 -15.2669 -15.2669 -6.0783 -6.0783 -5.2337 -5.2337 -1.7650 -1.7650 -0.9164 -0.9164 -0.6630 -0.6630 -0.1176 -0.1176 0.3044 0.3044 0.5022 0.5022 3.6904 3.6904 6.5554 6.5554 6.8027 6.8027 6.8256 6.8256 9.3510 9.3510 11.0960 11.0960 k = 0.6385-0.0243 0.2167 ( 8902 PWs) bands (ev): -40.5785 -40.5785 -40.5467 -40.5467 -40.4202 -40.4202 -40.2170 -40.2170 -15.5496 -15.5496 -15.2692 -15.2692 -6.0669 -6.0669 -5.1983 -5.1983 -1.7678 -1.7678 -0.9652 -0.9652 -0.6823 -0.6823 -0.1253 -0.1253 0.2814 0.2814 0.5040 0.5040 3.6631 3.6631 6.5758 6.5758 6.8096 6.8096 6.8627 6.8627 9.3958 9.3958 11.1534 11.1534 k = 0.6316-0.0105 0.2059 ( 8904 PWs) bands (ev): -40.5793 -40.5793 -40.5459 -40.5459 -40.4204 -40.4204 -40.2169 -40.2169 -15.5492 -15.5492 -15.2714 -15.2714 -6.0548 -6.0548 -5.1621 -5.1621 -1.7719 -1.7719 -1.0151 -1.0151 -0.7013 -0.7013 -0.1328 -0.1328 0.2588 0.2588 0.5057 0.5057 3.6365 3.6365 6.5964 6.5964 6.8169 6.8169 6.8990 6.8990 9.4414 9.4414 11.1999 11.1999 k = 0.6246 0.0033 0.1951 ( 8904 PWs) bands (ev): -40.5801 -40.5801 -40.5451 -40.5451 -40.4205 -40.4205 -40.2167 -40.2167 -15.5488 -15.5488 -15.2736 -15.2736 -6.0422 -6.0422 -5.1252 -5.1252 -1.7775 -1.7775 -1.0658 -1.0658 -0.7197 -0.7197 -0.1401 -0.1401 0.2367 0.2367 0.5071 0.5071 3.6109 3.6109 6.6169 6.6169 6.8245 6.8245 6.9342 6.9342 9.4872 9.4872 11.2340 11.2340 k = 0.6177 0.0170 0.1842 ( 8902 PWs) bands (ev): -40.5808 -40.5808 -40.5443 -40.5443 -40.4207 -40.4207 -40.2166 -40.2166 -15.5484 -15.5484 -15.2758 -15.2758 -6.0293 -6.0293 -5.0878 -5.0878 -1.7844 -1.7844 -1.1170 -1.1170 -0.7372 -0.7372 -0.1473 -0.1473 0.2154 0.2154 0.5084 0.5084 3.5862 3.5862 6.6374 6.6374 6.8323 6.8323 6.9684 6.9684 9.5328 9.5328 11.2557 11.2557 k = 0.6108 0.0308 0.1734 ( 8906 PWs) bands (ev): -40.5816 -40.5816 -40.5436 -40.5436 -40.4208 -40.4208 -40.2165 -40.2165 -15.5481 -15.5481 -15.2779 -15.2779 -6.0160 -6.0160 -5.0501 -5.0501 -1.7926 -1.7926 -1.1686 -1.1686 -0.7537 -0.7537 -0.1542 -0.1542 0.1949 0.1949 0.5094 0.5094 3.5625 3.5625 6.6575 6.6575 6.8402 6.8402 7.0014 7.0014 9.5777 9.5777 11.2668 11.2668 k = 0.6039 0.0446 0.1625 ( 8912 PWs) bands (ev): -40.5823 -40.5823 -40.5429 -40.5429 -40.4210 -40.4210 -40.2163 -40.2163 -15.5478 -15.5478 -15.2799 -15.2799 -6.0027 -6.0027 -5.0124 -5.0124 -1.8020 -1.8020 -1.2201 -1.2201 -0.7691 -0.7691 -0.1609 -0.1609 0.1753 0.1753 0.5103 0.5103 3.5398 3.5398 6.6773 6.6773 6.8481 6.8481 7.0330 7.0330 9.6215 9.6215 11.2696 11.2696 k = 0.5969 0.0584 0.1517 ( 8904 PWs) bands (ev): -40.5829 -40.5829 -40.5423 -40.5423 -40.4211 -40.4211 -40.2162 -40.2162 -15.5475 -15.5475 -15.2819 -15.2819 -5.9893 -5.9893 -4.9748 -4.9748 -1.8125 -1.8125 -1.2712 -1.2712 -0.7831 -0.7831 -0.1674 -0.1674 0.1568 0.1568 0.5111 0.5111 3.5183 3.5183 6.6966 6.6966 6.8560 6.8560 7.0632 7.0632 9.6638 9.6638 11.2665 11.2665 k = 0.5900 0.0722 0.1409 ( 8900 PWs) bands (ev): -40.5835 -40.5835 -40.5417 -40.5417 -40.4212 -40.4212 -40.2160 -40.2160 -15.5473 -15.5473 -15.2837 -15.2837 -5.9760 -5.9760 -4.9377 -4.9377 -1.8238 -1.8238 -1.3215 -1.3215 -0.7958 -0.7958 -0.1735 -0.1735 0.1395 0.1395 0.5117 0.5117 3.4979 3.4979 6.7153 6.7153 6.8637 6.8637 7.0919 7.0919 9.7043 9.7043 11.2594 11.2594 k = 0.5831 0.0859 0.1300 ( 8904 PWs) bands (ev): -40.5841 -40.5841 -40.5411 -40.5411 -40.4214 -40.4214 -40.2159 -40.2159 -15.5471 -15.5471 -15.2855 -15.2855 -5.9630 -5.9630 -4.9014 -4.9014 -1.8358 -1.8358 -1.3707 -1.3707 -0.8072 -0.8072 -0.1792 -0.1792 0.1233 0.1233 0.5122 0.5122 3.4789 3.4789 6.7331 6.7331 6.8713 6.8713 7.1190 7.1190 9.7426 9.7426 11.2498 11.2498 k = 0.5762 0.0997 0.1192 ( 8908 PWs) bands (ev): -40.5846 -40.5846 -40.5406 -40.5406 -40.4215 -40.4215 -40.2158 -40.2158 -15.5469 -15.5469 -15.2872 -15.2872 -5.9504 -5.9504 -4.8661 -4.8661 -1.8482 -1.8482 -1.4183 -1.4183 -0.8172 -0.8172 -0.1846 -0.1846 0.1083 0.1083 0.5126 0.5126 3.4611 3.4611 6.7501 6.7501 6.8785 6.8785 7.1443 7.1443 9.7784 9.7784 11.2388 11.2388 k = 0.5692 0.1135 0.1084 ( 8904 PWs) bands (ev): -40.5851 -40.5851 -40.5401 -40.5401 -40.4216 -40.4216 -40.2157 -40.2157 -15.5468 -15.5468 -15.2887 -15.2887 -5.9383 -5.9383 -4.8321 -4.8321 -1.8608 -1.8608 -1.4639 -1.4639 -0.8260 -0.8260 -0.1897 -0.1897 0.0946 0.0946 0.5130 0.5130 3.4446 3.4446 6.7660 6.7660 6.8854 6.8854 7.1677 7.1677 9.8115 9.8115 11.2273 11.2273 k = 0.5623 0.1273 0.0975 ( 8908 PWs) bands (ev): -40.5856 -40.5856 -40.5396 -40.5396 -40.4217 -40.4217 -40.2156 -40.2156 -15.5466 -15.5466 -15.2901 -15.2901 -5.9269 -5.9269 -4.7999 -4.7999 -1.8732 -1.8732 -1.5070 -1.5070 -0.8335 -0.8335 -0.1943 -0.1943 0.0822 0.0822 0.5132 0.5132 3.4296 3.4296 6.7808 6.7808 6.8919 6.8919 7.1893 7.1893 9.8418 9.8418 11.2157 11.2157 k = 0.5554 0.1411 0.0867 ( 8916 PWs) bands (ev): -40.5860 -40.5860 -40.5392 -40.5392 -40.4218 -40.4218 -40.2155 -40.2155 -15.5465 -15.5465 -15.2914 -15.2914 -5.9163 -5.9163 -4.7698 -4.7698 -1.8853 -1.8853 -1.5472 -1.5472 -0.8398 -0.8398 -0.1985 -0.1985 0.0711 0.0711 0.5134 0.5134 3.4160 3.4160 6.7943 6.7943 6.8979 6.8979 7.2088 7.2088 9.8690 9.8690 11.2045 11.2045 k = 0.5485 0.1548 0.0759 ( 8924 PWs) bands (ev): -40.5863 -40.5863 -40.5389 -40.5389 -40.4219 -40.4219 -40.2154 -40.2154 -15.5464 -15.5464 -15.2926 -15.2926 -5.9066 -5.9066 -4.7422 -4.7422 -1.8966 -1.8966 -1.5839 -1.5839 -0.8452 -0.8452 -0.2022 -0.2022 0.0613 0.0613 0.5135 0.5135 3.4039 3.4039 6.8066 6.8066 6.9033 6.9033 7.2262 7.2262 9.8931 9.8931 11.1940 11.1940 k = 0.5415 0.1686 0.0650 ( 8926 PWs) bands (ev): -40.5866 -40.5866 -40.5386 -40.5386 -40.4220 -40.4220 -40.2153 -40.2153 -15.5464 -15.5464 -15.2936 -15.2936 -5.8979 -5.8979 -4.7173 -4.7173 -1.9070 -1.9070 -1.6169 -1.6169 -0.8496 -0.8496 -0.2055 -0.2055 0.0528 0.0528 0.5136 0.5136 3.3933 3.3933 6.8173 6.8173 6.9082 6.9082 7.2414 7.2414 9.9140 9.9140 11.1846 11.1846 k = 0.5346 0.1824 0.0542 ( 8934 PWs) bands (ev): -40.5869 -40.5869 -40.5383 -40.5383 -40.4221 -40.4221 -40.2153 -40.2153 -15.5463 -15.5463 -15.2944 -15.2944 -5.8904 -5.8904 -4.6955 -4.6955 -1.9163 -1.9163 -1.6456 -1.6456 -0.8531 -0.8531 -0.2083 -0.2083 0.0456 0.0456 0.5137 0.5137 3.3843 3.3843 6.8266 6.8266 6.9123 6.9123 7.2544 7.2544 9.9317 9.9317 11.1763 11.1763 k = 0.5277 0.1962 0.0433 ( 8932 PWs) bands (ev): -40.5871 -40.5871 -40.5381 -40.5381 -40.4221 -40.4221 -40.2152 -40.2152 -15.5463 -15.5463 -15.2951 -15.2951 -5.8841 -5.8841 -4.6772 -4.6772 -1.9242 -1.9242 -1.6697 -1.6697 -0.8559 -0.8559 -0.2106 -0.2106 0.0397 0.0397 0.5138 0.5138 3.3769 3.3769 6.8343 6.8343 6.9158 6.9158 7.2652 7.2652 9.9462 9.9462 11.1694 11.1694 k = 0.5208 0.2099 0.0325 ( 8920 PWs) bands (ev): -40.5873 -40.5873 -40.5379 -40.5379 -40.4222 -40.4222 -40.2152 -40.2152 -15.5462 -15.5462 -15.2957 -15.2957 -5.8791 -5.8791 -4.6627 -4.6627 -1.9305 -1.9305 -1.6888 -1.6888 -0.8579 -0.8579 -0.2124 -0.2124 0.0351 0.0351 0.5138 0.5138 3.3711 3.3711 6.8403 6.8403 6.9185 6.9185 7.2736 7.2736 9.9574 9.9574 11.1639 11.1639 k = 0.5138 0.2237 0.0217 ( 8920 PWs) bands (ev): -40.5874 -40.5874 -40.5378 -40.5378 -40.4222 -40.4222 -40.2151 -40.2151 -15.5462 -15.5462 -15.2961 -15.2961 -5.8755 -5.8755 -4.6521 -4.6521 -1.9351 -1.9351 -1.7027 -1.7027 -0.8594 -0.8594 -0.2137 -0.2137 0.0319 0.0319 0.5138 0.5138 3.3670 3.3670 6.8446 6.8446 6.9205 6.9205 7.2796 7.2796 9.9655 9.9655 11.1599 11.1599 k = 0.5069 0.2375 0.0108 ( 8904 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5462 -15.5462 -15.2963 -15.2963 -5.8734 -5.8734 -4.6457 -4.6457 -1.9379 -1.9379 -1.7111 -1.7111 -0.8602 -0.8602 -0.2144 -0.2144 0.0299 0.0299 0.5138 0.5138 3.3645 3.3645 6.8473 6.8473 6.9217 6.9217 7.2832 7.2832 9.9703 9.9703 11.1575 11.1575 k = 0.5000 0.2513 0.0000 ( 8904 PWs) bands (ev): -40.5875 -40.5875 -40.5377 -40.5377 -40.4222 -40.4222 -40.2151 -40.2151 -15.5462 -15.5462 -15.2964 -15.2964 -5.8726 -5.8726 -4.6435 -4.6435 -1.9389 -1.9389 -1.7139 -1.7139 -0.8605 -0.8605 -0.2147 -0.2147 0.0292 0.0292 0.5138 0.5138 3.3636 3.3636 6.8481 6.8481 6.9221 6.9221 7.2844 7.2844 9.9719 9.9719 11.1567 11.1567 Writing output data file LiN.save init_run : 0.15s CPU 0.38s WALL ( 1 calls) electrons : 380.80s CPU 383.70s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.11s WALL ( 1 calls) potinit : 0.03s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 380.80s CPU 383.69s 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 : 0.01s CPU 0.02s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.10s WALL ( 436 calls) cegterg : 318.95s CPU 320.87s WALL ( 529 calls) Called by sum_band: Called by *egterg: h_psi : 318.05s CPU 319.81s WALL ( 8079 calls) s_psi : 3.90s CPU 3.96s WALL ( 8079 calls) g_psi : 0.38s CPU 0.40s WALL ( 7114 calls) cdiaghg : 32.68s CPU 33.04s WALL ( 7550 calls) cegterg:over : 6.99s CPU 6.96s WALL ( 7114 calls) cegterg:upda : 7.41s CPU 7.44s WALL ( 7114 calls) cegterg:last : 4.55s CPU 4.59s WALL ( 1401 calls) cdiaghg:chol : 1.93s CPU 1.95s WALL ( 7550 calls) cdiaghg:inve : 0.79s CPU 0.77s WALL ( 7550 calls) cdiaghg:para : 1.98s CPU 2.05s WALL ( 15100 calls) Called by h_psi: h_psi:vloc : 307.60s CPU 309.32s WALL ( 8079 calls) h_psi:vnl : 10.04s CPU 10.05s WALL ( 8079 calls) add_vuspsi : 4.10s CPU 4.20s WALL ( 8079 calls) General routines calbec : 5.88s CPU 5.83s WALL ( 8079 calls) fft : 0.01s CPU 0.02s WALL ( 15 calls) fftw : 292.59s CPU 294.22s WALL ( 713360 calls) davcio : 0.36s CPU 0.42s WALL ( 872 calls) Parallel routines fft_scatter : 67.50s CPU 67.06s WALL ( 713375 calls) PWSCF : 6m47.33s CPU 7m17.25s WALL This run was terminated on: 20:52:40 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. 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