Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 4:27: 6 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./H2C2O.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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 42 24 7 1942 837 127 Max 43 25 8 1949 861 133 Sum 3085 1763 509 140135 61047 9369 bravais-lattice index = 14 lattice parameter (alat) = 9.4781 a.u. unit-cell volume = 1402.6274 (a.u.)^3 number of atoms/cell = 20 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.478110 celldm(2)= 1.380931 celldm(3)= 1.412314 celldm(4)= -0.390024 celldm(5)= -0.125801 celldm(6)= -0.298841 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.412679 1.317827 0.000000 ) a(3) = ( -0.177670 -0.632851 1.250025 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.313151 0.300672 ) b(2) = ( 0.000000 0.758825 0.384171 ) b(3) = ( 0.000000 0.000000 0.799984 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) H 1.00 1.00790 H( 1.00) C 4.00 12.01070 C( 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= 242 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 -0.3794125 -0.1920854), wk = 0.0041322 k( 2) = ( 0.0000000 -0.3653602 -0.1849711), wk = 0.0041322 k( 3) = ( 0.0000000 -0.3513078 -0.1778568), wk = 0.0041322 k( 4) = ( 0.0000000 -0.3372555 -0.1707425), wk = 0.0041322 k( 5) = ( 0.0000000 -0.3232032 -0.1636283), wk = 0.0041322 k( 6) = ( 0.0000000 -0.3091509 -0.1565140), wk = 0.0041322 k( 7) = ( 0.0000000 -0.2950986 -0.1493997), wk = 0.0041322 k( 8) = ( 0.0000000 -0.2810463 -0.1422855), wk = 0.0041322 k( 9) = ( 0.0000000 -0.2669940 -0.1351712), wk = 0.0041322 k( 10) = ( 0.0000000 -0.2529416 -0.1280569), wk = 0.0041322 k( 11) = ( 0.0000000 -0.2388893 -0.1209426), wk = 0.0041322 k( 12) = ( 0.0000000 -0.2248370 -0.1138284), wk = 0.0041322 k( 13) = ( 0.0000000 -0.2107847 -0.1067141), wk = 0.0041322 k( 14) = ( 0.0000000 -0.1967324 -0.0995998), wk = 0.0041322 k( 15) = ( 0.0000000 -0.1826801 -0.0924855), wk = 0.0041322 k( 16) = ( 0.0000000 -0.1686278 -0.0853713), wk = 0.0041322 k( 17) = ( 0.0000000 -0.1545755 -0.0782570), wk = 0.0041322 k( 18) = ( 0.0000000 -0.1405231 -0.0711427), wk = 0.0041322 k( 19) = ( 0.0000000 -0.1264708 -0.0640285), wk = 0.0041322 k( 20) = ( 0.0000000 -0.1124185 -0.0569142), wk = 0.0041322 k( 21) = ( 0.0000000 -0.0983662 -0.0497999), wk = 0.0041322 k( 22) = ( 0.0000000 -0.0843139 -0.0426856), wk = 0.0041322 k( 23) = ( 0.0000000 -0.0702616 -0.0355714), wk = 0.0041322 k( 24) = ( 0.0000000 -0.0562093 -0.0284571), wk = 0.0041322 k( 25) = ( 0.0000000 -0.0421569 -0.0213428), wk = 0.0041322 k( 26) = ( 0.0000000 -0.0281046 -0.0142285), wk = 0.0041322 k( 27) = ( 0.0000000 -0.0140523 -0.0071143), wk = 0.0041322 k( 28) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 29) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 30) = ( 0.0142857 0.0044736 0.0042953), wk = 0.0041322 k( 31) = ( 0.0285714 0.0089472 0.0085906), wk = 0.0041322 k( 32) = ( 0.0428571 0.0134208 0.0128860), wk = 0.0041322 k( 33) = ( 0.0571429 0.0178943 0.0171813), wk = 0.0041322 k( 34) = ( 0.0714286 0.0223679 0.0214766), wk = 0.0041322 k( 35) = ( 0.0857143 0.0268415 0.0257719), wk = 0.0041322 k( 36) = ( 0.1000000 0.0313151 0.0300672), wk = 0.0041322 k( 37) = ( 0.1142857 0.0357887 0.0343626), wk = 0.0041322 k( 38) = ( 0.1285714 0.0402623 0.0386579), wk = 0.0041322 k( 39) = ( 0.1428571 0.0447359 0.0429532), wk = 0.0041322 k( 40) = ( 0.1571429 0.0492094 0.0472485), wk = 0.0041322 k( 41) = ( 0.1714286 0.0536830 0.0515438), wk = 0.0041322 k( 42) = ( 0.1857143 0.0581566 0.0558392), wk = 0.0041322 k( 43) = ( 0.2000000 0.0626302 0.0601345), wk = 0.0041322 k( 44) = ( 0.2142857 0.0671038 0.0644298), wk = 0.0041322 k( 45) = ( 0.2285714 0.0715774 0.0687251), wk = 0.0041322 k( 46) = ( 0.2428571 0.0760510 0.0730204), wk = 0.0041322 k( 47) = ( 0.2571429 0.0805245 0.0773157), wk = 0.0041322 k( 48) = ( 0.2714286 0.0849981 0.0816111), wk = 0.0041322 k( 49) = ( 0.2857143 0.0894717 0.0859064), wk = 0.0041322 k( 50) = ( 0.3000000 0.0939453 0.0902017), wk = 0.0041322 k( 51) = ( 0.3142857 0.0984189 0.0944970), wk = 0.0041322 k( 52) = ( 0.3285714 0.1028925 0.0987923), wk = 0.0041322 k( 53) = ( 0.3428571 0.1073661 0.1030877), wk = 0.0041322 k( 54) = ( 0.3571429 0.1118396 0.1073830), wk = 0.0041322 k( 55) = ( 0.3714286 0.1163132 0.1116783), wk = 0.0041322 k( 56) = ( 0.3857143 0.1207868 0.1159736), wk = 0.0041322 k( 57) = ( 0.4000000 0.1252604 0.1202689), wk = 0.0041322 k( 58) = ( 0.4142857 0.1297340 0.1245643), wk = 0.0041322 k( 59) = ( 0.4285714 0.1342076 0.1288596), wk = 0.0041322 k( 60) = ( 0.4428571 0.1386812 0.1331549), wk = 0.0041322 k( 61) = ( 0.4571429 0.1431547 0.1374502), wk = 0.0041322 k( 62) = ( 0.4714286 0.1476283 0.1417455), wk = 0.0041322 k( 63) = ( 0.4857143 0.1521019 0.1460409), wk = 0.0041322 k( 64) = ( 0.5000000 0.1565755 0.1503362), wk = 0.0041322 k( 65) = ( 0.5000000 -0.2228370 -0.0417492), wk = 0.0041322 k( 66) = ( 0.4857143 -0.2164702 -0.0405563), wk = 0.0041322 k( 67) = ( 0.4714286 -0.2101034 -0.0393635), wk = 0.0041322 k( 68) = ( 0.4571429 -0.2037367 -0.0381707), wk = 0.0041322 k( 69) = ( 0.4428571 -0.1973699 -0.0369778), wk = 0.0041322 k( 70) = ( 0.4285714 -0.1910031 -0.0357850), wk = 0.0041322 k( 71) = ( 0.4142857 -0.1846363 -0.0345922), wk = 0.0041322 k( 72) = ( 0.4000000 -0.1782696 -0.0333993), wk = 0.0041322 k( 73) = ( 0.3857143 -0.1719028 -0.0322065), wk = 0.0041322 k( 74) = ( 0.3714286 -0.1655360 -0.0310137), wk = 0.0041322 k( 75) = ( 0.3571429 -0.1591693 -0.0298208), wk = 0.0041322 k( 76) = ( 0.3428571 -0.1528025 -0.0286280), wk = 0.0041322 k( 77) = ( 0.3285714 -0.1464357 -0.0274352), wk = 0.0041322 k( 78) = ( 0.3142857 -0.1400690 -0.0262423), wk = 0.0041322 k( 79) = ( 0.3000000 -0.1337022 -0.0250495), wk = 0.0041322 k( 80) = ( 0.2857143 -0.1273354 -0.0238567), wk = 0.0041322 k( 81) = ( 0.2714286 -0.1209686 -0.0226638), wk = 0.0041322 k( 82) = ( 0.2571429 -0.1146019 -0.0214710), wk = 0.0041322 k( 83) = ( 0.2428571 -0.1082351 -0.0202782), wk = 0.0041322 k( 84) = ( 0.2285714 -0.1018683 -0.0190853), wk = 0.0041322 k( 85) = ( 0.2142857 -0.0955016 -0.0178925), wk = 0.0041322 k( 86) = ( 0.2000000 -0.0891348 -0.0166997), wk = 0.0041322 k( 87) = ( 0.1857143 -0.0827680 -0.0155068), wk = 0.0041322 k( 88) = ( 0.1714286 -0.0764012 -0.0143140), wk = 0.0041322 k( 89) = ( 0.1571429 -0.0700345 -0.0131212), wk = 0.0041322 k( 90) = ( 0.1428571 -0.0636677 -0.0119283), wk = 0.0041322 k( 91) = ( 0.1285714 -0.0573009 -0.0107355), wk = 0.0041322 k( 92) = ( 0.1142857 -0.0509342 -0.0095427), wk = 0.0041322 k( 93) = ( 0.1000000 -0.0445674 -0.0083498), wk = 0.0041322 k( 94) = ( 0.0857143 -0.0382006 -0.0071570), wk = 0.0041322 k( 95) = ( 0.0714286 -0.0318339 -0.0059642), wk = 0.0041322 k( 96) = ( 0.0571429 -0.0254671 -0.0047713), wk = 0.0041322 k( 97) = ( 0.0428571 -0.0191003 -0.0035785), wk = 0.0041322 k( 98) = ( 0.0285714 -0.0127335 -0.0023857), wk = 0.0041322 k( 99) = ( 0.0142857 -0.0063668 -0.0011928), wk = 0.0041322 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 102) = ( -0.0135135 -0.0042318 0.0067475), wk = 0.0041322 k( 103) = ( -0.0270270 -0.0084635 0.0134949), wk = 0.0041322 k( 104) = ( -0.0405405 -0.0126953 0.0202424), wk = 0.0041322 k( 105) = ( -0.0540540 -0.0169271 0.0269898), wk = 0.0041322 k( 106) = ( -0.0675676 -0.0211589 0.0337373), wk = 0.0041322 k( 107) = ( -0.0810811 -0.0253906 0.0404847), wk = 0.0041322 k( 108) = ( -0.0945946 -0.0296224 0.0472322), wk = 0.0041322 k( 109) = ( -0.1081081 -0.0338542 0.0539796), wk = 0.0041322 k( 110) = ( -0.1216216 -0.0380859 0.0607271), wk = 0.0041322 k( 111) = ( -0.1351351 -0.0423177 0.0674745), wk = 0.0041322 k( 112) = ( -0.1486486 -0.0465495 0.0742220), wk = 0.0041322 k( 113) = ( -0.1621622 -0.0507812 0.0809694), wk = 0.0041322 k( 114) = ( -0.1756757 -0.0550130 0.0877169), wk = 0.0041322 k( 115) = ( -0.1891892 -0.0592448 0.0944644), wk = 0.0041322 k( 116) = ( -0.2027027 -0.0634766 0.1012118), wk = 0.0041322 k( 117) = ( -0.2162162 -0.0677083 0.1079593), wk = 0.0041322 k( 118) = ( -0.2297297 -0.0719401 0.1147067), wk = 0.0041322 k( 119) = ( -0.2432432 -0.0761719 0.1214542), wk = 0.0041322 k( 120) = ( -0.2567568 -0.0804036 0.1282016), wk = 0.0041322 k( 121) = ( -0.2702703 -0.0846354 0.1349491), wk = 0.0041322 k( 122) = ( -0.2837838 -0.0888672 0.1416965), wk = 0.0041322 k( 123) = ( -0.2972973 -0.0930990 0.1484440), wk = 0.0041322 k( 124) = ( -0.3108108 -0.0973307 0.1551914), wk = 0.0041322 k( 125) = ( -0.3243243 -0.1015625 0.1619389), wk = 0.0041322 k( 126) = ( -0.3378378 -0.1057943 0.1686863), wk = 0.0041322 k( 127) = ( -0.3513514 -0.1100260 0.1754338), wk = 0.0041322 k( 128) = ( -0.3648649 -0.1142578 0.1821813), wk = 0.0041322 k( 129) = ( -0.3783784 -0.1184896 0.1889287), wk = 0.0041322 k( 130) = ( -0.3918919 -0.1227213 0.1956762), wk = 0.0041322 k( 131) = ( -0.4054054 -0.1269531 0.2024236), wk = 0.0041322 k( 132) = ( -0.4189189 -0.1311849 0.2091711), wk = 0.0041322 k( 133) = ( -0.4324324 -0.1354167 0.2159185), wk = 0.0041322 k( 134) = ( -0.4459459 -0.1396484 0.2226660), wk = 0.0041322 k( 135) = ( -0.4594595 -0.1438802 0.2294134), wk = 0.0041322 k( 136) = ( -0.4729730 -0.1481120 0.2361609), wk = 0.0041322 k( 137) = ( -0.4864865 -0.1523437 0.2429083), wk = 0.0041322 k( 138) = ( -0.5000000 -0.1565755 0.2496558), wk = 0.0041322 k( 139) = ( -0.5000000 -0.5359880 0.0575704), wk = 0.0041322 k( 140) = ( -0.4893617 -0.5245840 0.0563455), wk = 0.0041322 k( 141) = ( -0.4787234 -0.5131800 0.0551206), wk = 0.0041322 k( 142) = ( -0.4680851 -0.5017760 0.0538957), wk = 0.0041322 k( 143) = ( -0.4574468 -0.4903720 0.0526708), wk = 0.0041322 k( 144) = ( -0.4468085 -0.4789680 0.0514459), wk = 0.0041322 k( 145) = ( -0.4361702 -0.4675640 0.0502210), wk = 0.0041322 k( 146) = ( -0.4255319 -0.4561600 0.0489961), wk = 0.0041322 k( 147) = ( -0.4148936 -0.4447560 0.0477712), wk = 0.0041322 k( 148) = ( -0.4042553 -0.4333520 0.0465463), wk = 0.0041322 k( 149) = ( -0.3936170 -0.4219480 0.0453214), wk = 0.0041322 k( 150) = ( -0.3829787 -0.4105440 0.0440965), wk = 0.0041322 k( 151) = ( -0.3723404 -0.3991400 0.0428716), wk = 0.0041322 k( 152) = ( -0.3617021 -0.3877360 0.0416467), wk = 0.0041322 k( 153) = ( -0.3510638 -0.3763320 0.0404218), wk = 0.0041322 k( 154) = ( -0.3404255 -0.3649280 0.0391969), wk = 0.0041322 k( 155) = ( -0.3297872 -0.3535240 0.0379720), wk = 0.0041322 k( 156) = ( -0.3191489 -0.3421200 0.0367471), wk = 0.0041322 k( 157) = ( -0.3085106 -0.3307160 0.0355222), wk = 0.0041322 k( 158) = ( -0.2978723 -0.3193120 0.0342973), wk = 0.0041322 k( 159) = ( -0.2872340 -0.3079080 0.0330724), wk = 0.0041322 k( 160) = ( -0.2765957 -0.2965040 0.0318475), wk = 0.0041322 k( 161) = ( -0.2659574 -0.2851000 0.0306226), wk = 0.0041322 k( 162) = ( -0.2553191 -0.2736960 0.0293977), wk = 0.0041322 k( 163) = ( -0.2446809 -0.2622920 0.0281728), wk = 0.0041322 k( 164) = ( -0.2340425 -0.2508880 0.0269479), wk = 0.0041322 k( 165) = ( -0.2234043 -0.2394840 0.0257230), wk = 0.0041322 k( 166) = ( -0.2127660 -0.2280800 0.0244981), wk = 0.0041322 k( 167) = ( -0.2021277 -0.2166760 0.0232732), wk = 0.0041322 k( 168) = ( -0.1914894 -0.2052720 0.0220483), wk = 0.0041322 k( 169) = ( -0.1808511 -0.1938680 0.0208233), wk = 0.0041322 k( 170) = ( -0.1702128 -0.1824640 0.0195984), wk = 0.0041322 k( 171) = ( -0.1595745 -0.1710600 0.0183735), wk = 0.0041322 k( 172) = ( -0.1489362 -0.1596560 0.0171486), wk = 0.0041322 k( 173) = ( -0.1382979 -0.1482520 0.0159237), wk = 0.0041322 k( 174) = ( -0.1276596 -0.1368480 0.0146988), wk = 0.0041322 k( 175) = ( -0.1170213 -0.1254440 0.0134739), wk = 0.0041322 k( 176) = ( -0.1063830 -0.1140400 0.0122490), wk = 0.0041322 k( 177) = ( -0.0957447 -0.1026360 0.0110241), wk = 0.0041322 k( 178) = ( -0.0851064 -0.0912320 0.0097992), wk = 0.0041322 k( 179) = ( -0.0744681 -0.0798280 0.0085743), wk = 0.0041322 k( 180) = ( -0.0638298 -0.0684240 0.0073494), wk = 0.0041322 k( 181) = ( -0.0531915 -0.0570200 0.0061245), wk = 0.0041322 k( 182) = ( -0.0425532 -0.0456160 0.0048996), wk = 0.0041322 k( 183) = ( -0.0319149 -0.0342120 0.0036747), wk = 0.0041322 k( 184) = ( -0.0212766 -0.0228080 0.0024498), wk = 0.0041322 k( 185) = ( -0.0106383 -0.0114040 0.0012249), wk = 0.0041322 k( 186) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 187) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 188) = ( 0.0000000 0.0000000 0.0153843), wk = 0.0041322 k( 189) = ( 0.0000000 0.0000000 0.0307686), wk = 0.0041322 k( 190) = ( 0.0000000 0.0000000 0.0461529), wk = 0.0041322 k( 191) = ( 0.0000000 0.0000000 0.0615372), wk = 0.0041322 k( 192) = ( 0.0000000 0.0000000 0.0769215), wk = 0.0041322 k( 193) = ( 0.0000000 0.0000000 0.0923058), wk = 0.0041322 k( 194) = ( 0.0000000 0.0000000 0.1076901), wk = 0.0041322 k( 195) = ( 0.0000000 0.0000000 0.1230744), wk = 0.0041322 k( 196) = ( 0.0000000 0.0000000 0.1384588), wk = 0.0041322 k( 197) = ( 0.0000000 0.0000000 0.1538431), wk = 0.0041322 k( 198) = ( 0.0000000 0.0000000 0.1692274), wk = 0.0041322 k( 199) = ( 0.0000000 0.0000000 0.1846117), wk = 0.0041322 k( 200) = ( 0.0000000 0.0000000 0.1999960), wk = 0.0041322 k( 201) = ( 0.0000000 0.0000000 0.2153803), wk = 0.0041322 k( 202) = ( 0.0000000 0.0000000 0.2307646), wk = 0.0041322 k( 203) = ( 0.0000000 0.0000000 0.2461489), wk = 0.0041322 k( 204) = ( 0.0000000 0.0000000 0.2615332), wk = 0.0041322 k( 205) = ( 0.0000000 0.0000000 0.2769175), wk = 0.0041322 k( 206) = ( 0.0000000 0.0000000 0.2923018), wk = 0.0041322 k( 207) = ( 0.0000000 0.0000000 0.3076861), wk = 0.0041322 k( 208) = ( 0.0000000 0.0000000 0.3230704), wk = 0.0041322 k( 209) = ( 0.0000000 0.0000000 0.3384547), wk = 0.0041322 k( 210) = ( 0.0000000 0.0000000 0.3538390), wk = 0.0041322 k( 211) = ( 0.0000000 0.0000000 0.3692234), wk = 0.0041322 k( 212) = ( 0.0000000 0.0000000 0.3846077), wk = 0.0041322 k( 213) = ( 0.0000000 0.0000000 0.3999920), wk = 0.0041322 k( 214) = ( 0.0000000 -0.3794125 0.2079066), wk = 0.0041322 k( 215) = ( 0.0000000 -0.3658620 0.2004814), wk = 0.0041322 k( 216) = ( 0.0000000 -0.3523116 0.1930561), wk = 0.0041322 k( 217) = ( 0.0000000 -0.3387611 0.1856309), wk = 0.0041322 k( 218) = ( 0.0000000 -0.3252107 0.1782057), wk = 0.0041322 k( 219) = ( 0.0000000 -0.3116603 0.1707804), wk = 0.0041322 k( 220) = ( 0.0000000 -0.2981098 0.1633552), wk = 0.0041322 k( 221) = ( 0.0000000 -0.2845594 0.1559300), wk = 0.0041322 k( 222) = ( 0.0000000 -0.2710089 0.1485047), wk = 0.0041322 k( 223) = ( 0.0000000 -0.2574585 0.1410795), wk = 0.0041322 k( 224) = ( 0.0000000 -0.2439080 0.1336542), wk = 0.0041322 k( 225) = ( 0.0000000 -0.2303576 0.1262290), wk = 0.0041322 k( 226) = ( 0.0000000 -0.2168071 0.1188038), wk = 0.0041322 k( 227) = ( 0.0000000 -0.2032567 0.1113785), wk = 0.0041322 k( 228) = ( 0.0000000 -0.1897062 0.1039533), wk = 0.0041322 k( 229) = ( 0.0000000 -0.1761558 0.0965281), wk = 0.0041322 k( 230) = ( 0.0000000 -0.1626053 0.0891028), wk = 0.0041322 k( 231) = ( 0.0000000 -0.1490549 0.0816776), wk = 0.0041322 k( 232) = ( 0.0000000 -0.1355045 0.0742524), wk = 0.0041322 k( 233) = ( 0.0000000 -0.1219540 0.0668271), wk = 0.0041322 k( 234) = ( 0.0000000 -0.1084036 0.0594019), wk = 0.0041322 k( 235) = ( 0.0000000 -0.0948531 0.0519767), wk = 0.0041322 k( 236) = ( 0.0000000 -0.0813027 0.0445514), wk = 0.0041322 k( 237) = ( 0.0000000 -0.0677522 0.0371262), wk = 0.0041322 k( 238) = ( 0.0000000 -0.0542018 0.0297009), wk = 0.0041322 k( 239) = ( 0.0000000 -0.0406513 0.0222757), wk = 0.0041322 k( 240) = ( 0.0000000 -0.0271009 0.0148505), wk = 0.0041322 k( 241) = ( 0.0000000 -0.0135504 0.0074252), wk = 0.0041322 k( 242) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 cryst. coord. k( 1) = ( 0.0000000 -0.5000000 0.0000000), wk = 0.0041322 k( 2) = ( 0.0000000 -0.4814815 0.0000000), wk = 0.0041322 k( 3) = ( 0.0000000 -0.4629630 0.0000000), wk = 0.0041322 k( 4) = ( 0.0000000 -0.4444444 0.0000000), wk = 0.0041322 k( 5) = ( 0.0000000 -0.4259259 0.0000000), wk = 0.0041322 k( 6) = ( 0.0000000 -0.4074074 -0.0000000), wk = 0.0041322 k( 7) = ( 0.0000000 -0.3888889 0.0000000), wk = 0.0041322 k( 8) = ( 0.0000000 -0.3703704 0.0000000), wk = 0.0041322 k( 9) = ( 0.0000000 -0.3518519 0.0000000), wk = 0.0041322 k( 10) = ( 0.0000000 -0.3333333 0.0000000), wk = 0.0041322 k( 11) = ( 0.0000000 -0.3148148 0.0000000), wk = 0.0041322 k( 12) = ( 0.0000000 -0.2962963 0.0000000), wk = 0.0041322 k( 13) = ( 0.0000000 -0.2777778 0.0000000), wk = 0.0041322 k( 14) = ( 0.0000000 -0.2592593 -0.0000000), wk = 0.0041322 k( 15) = ( 0.0000000 -0.2407407 0.0000000), wk = 0.0041322 k( 16) = ( 0.0000000 -0.2222222 0.0000000), wk = 0.0041322 k( 17) = ( 0.0000000 -0.2037037 0.0000000), wk = 0.0041322 k( 18) = ( 0.0000000 -0.1851852 -0.0000000), wk = 0.0041322 k( 19) = ( 0.0000000 -0.1666667 0.0000000), wk = 0.0041322 k( 20) = ( 0.0000000 -0.1481482 0.0000000), wk = 0.0041322 k( 21) = ( 0.0000000 -0.1296296 -0.0000000), wk = 0.0041322 k( 22) = ( 0.0000000 -0.1111111 0.0000000), wk = 0.0041322 k( 23) = ( 0.0000000 -0.0925926 0.0000000), wk = 0.0041322 k( 24) = ( 0.0000000 -0.0740741 0.0000000), wk = 0.0041322 k( 25) = ( 0.0000000 -0.0555556 -0.0000000), wk = 0.0041322 k( 26) = ( 0.0000000 -0.0370370 0.0000000), wk = 0.0041322 k( 27) = ( 0.0000000 -0.0185185 0.0000000), wk = 0.0041322 k( 28) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 29) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 30) = ( 0.0142857 -0.0000000 0.0000000), wk = 0.0041322 k( 31) = ( 0.0285714 0.0000000 -0.0000000), wk = 0.0041322 k( 32) = ( 0.0428571 0.0000000 0.0000000), wk = 0.0041322 k( 33) = ( 0.0571429 0.0000000 -0.0000000), wk = 0.0041322 k( 34) = ( 0.0714286 0.0000000 -0.0000000), wk = 0.0041322 k( 35) = ( 0.0857143 0.0000000 -0.0000000), wk = 0.0041322 k( 36) = ( 0.1000000 0.0000000 -0.0000000), wk = 0.0041322 k( 37) = ( 0.1142857 0.0000000 -0.0000000), wk = 0.0041322 k( 38) = ( 0.1285714 0.0000000 -0.0000000), wk = 0.0041322 k( 39) = ( 0.1428571 0.0000000 -0.0000000), wk = 0.0041322 k( 40) = ( 0.1571429 0.0000000 0.0000000), wk = 0.0041322 k( 41) = ( 0.1714286 0.0000000 -0.0000000), wk = 0.0041322 k( 42) = ( 0.1857143 0.0000000 0.0000000), wk = 0.0041322 k( 43) = ( 0.2000000 0.0000000 -0.0000000), wk = 0.0041322 k( 44) = ( 0.2142857 -0.0000000 0.0000000), wk = 0.0041322 k( 45) = ( 0.2285714 0.0000000 0.0000000), wk = 0.0041322 k( 46) = ( 0.2428571 0.0000000 -0.0000000), wk = 0.0041322 k( 47) = ( 0.2571429 0.0000000 -0.0000000), wk = 0.0041322 k( 48) = ( 0.2714286 0.0000000 0.0000000), wk = 0.0041322 k( 49) = ( 0.2857143 0.0000000 -0.0000000), wk = 0.0041322 k( 50) = ( 0.3000000 0.0000000 -0.0000000), wk = 0.0041322 k( 51) = ( 0.3142857 0.0000000 -0.0000000), wk = 0.0041322 k( 52) = ( 0.3285714 0.0000000 -0.0000000), wk = 0.0041322 k( 53) = ( 0.3428571 0.0000000 -0.0000000), wk = 0.0041322 k( 54) = ( 0.3571429 0.0000000 0.0000000), wk = 0.0041322 k( 55) = ( 0.3714286 0.0000000 -0.0000000), wk = 0.0041322 k( 56) = ( 0.3857143 0.0000000 -0.0000000), wk = 0.0041322 k( 57) = ( 0.4000000 0.0000000 -0.0000000), wk = 0.0041322 k( 58) = ( 0.4142857 0.0000000 0.0000000), wk = 0.0041322 k( 59) = ( 0.4285714 0.0000000 -0.0000000), wk = 0.0041322 k( 60) = ( 0.4428571 0.0000000 -0.0000000), wk = 0.0041322 k( 61) = ( 0.4571429 0.0000000 0.0000000), wk = 0.0041322 k( 62) = ( 0.4714286 -0.0000000 -0.0000000), wk = 0.0041322 k( 63) = ( 0.4857143 0.0000000 -0.0000000), wk = 0.0041322 k( 64) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0041322 k( 65) = ( 0.5000000 -0.5000000 -0.0000000), wk = 0.0041322 k( 66) = ( 0.4857143 -0.4857143 -0.0000000), wk = 0.0041322 k( 67) = ( 0.4714286 -0.4714286 0.0000000), wk = 0.0041322 k( 68) = ( 0.4571429 -0.4571429 -0.0000000), wk = 0.0041322 k( 69) = ( 0.4428571 -0.4428571 0.0000000), wk = 0.0041322 k( 70) = ( 0.4285714 -0.4285714 0.0000000), wk = 0.0041322 k( 71) = ( 0.4142857 -0.4142857 -0.0000000), wk = 0.0041322 k( 72) = ( 0.4000000 -0.4000000 0.0000000), wk = 0.0041322 k( 73) = ( 0.3857143 -0.3857143 0.0000000), wk = 0.0041322 k( 74) = ( 0.3714286 -0.3714286 0.0000000), wk = 0.0041322 k( 75) = ( 0.3571429 -0.3571429 -0.0000000), wk = 0.0041322 k( 76) = ( 0.3428571 -0.3428571 0.0000000), wk = 0.0041322 k( 77) = ( 0.3285714 -0.3285714 0.0000000), wk = 0.0041322 k( 78) = ( 0.3142857 -0.3142857 -0.0000000), wk = 0.0041322 k( 79) = ( 0.3000000 -0.3000000 0.0000000), wk = 0.0041322 k( 80) = ( 0.2857143 -0.2857143 -0.0000000), wk = 0.0041322 k( 81) = ( 0.2714286 -0.2714286 0.0000000), wk = 0.0041322 k( 82) = ( 0.2571429 -0.2571429 0.0000000), wk = 0.0041322 k( 83) = ( 0.2428571 -0.2428571 -0.0000000), wk = 0.0041322 k( 84) = ( 0.2285714 -0.2285714 -0.0000000), wk = 0.0041322 k( 85) = ( 0.2142857 -0.2142857 0.0000000), wk = 0.0041322 k( 86) = ( 0.2000000 -0.2000000 0.0000000), wk = 0.0041322 k( 87) = ( 0.1857143 -0.1857143 0.0000000), wk = 0.0041322 k( 88) = ( 0.1714286 -0.1714286 0.0000000), wk = 0.0041322 k( 89) = ( 0.1571429 -0.1571429 0.0000000), wk = 0.0041322 k( 90) = ( 0.1428571 -0.1428571 0.0000000), wk = 0.0041322 k( 91) = ( 0.1285714 -0.1285714 0.0000000), wk = 0.0041322 k( 92) = ( 0.1142857 -0.1142857 0.0000000), wk = 0.0041322 k( 93) = ( 0.1000000 -0.1000000 0.0000000), wk = 0.0041322 k( 94) = ( 0.0857143 -0.0857143 0.0000000), wk = 0.0041322 k( 95) = ( 0.0714286 -0.0714286 0.0000000), wk = 0.0041322 k( 96) = ( 0.0571429 -0.0571429 0.0000000), wk = 0.0041322 k( 97) = ( 0.0428571 -0.0428571 0.0000000), wk = 0.0041322 k( 98) = ( 0.0285714 -0.0285714 0.0000000), wk = 0.0041322 k( 99) = ( 0.0142857 -0.0142857 -0.0000000), wk = 0.0041322 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 102) = ( -0.0135135 -0.0000000 0.0135135), wk = 0.0041322 k( 103) = ( -0.0270270 -0.0000000 0.0270270), wk = 0.0041322 k( 104) = ( -0.0405405 -0.0000000 0.0405405), wk = 0.0041322 k( 105) = ( -0.0540540 -0.0000000 0.0540541), wk = 0.0041322 k( 106) = ( -0.0675676 -0.0000000 0.0675676), wk = 0.0041322 k( 107) = ( -0.0810811 -0.0000000 0.0810811), wk = 0.0041322 k( 108) = ( -0.0945946 -0.0000000 0.0945946), wk = 0.0041322 k( 109) = ( -0.1081081 -0.0000000 0.1081081), wk = 0.0041322 k( 110) = ( -0.1216216 0.0000000 0.1216216), wk = 0.0041322 k( 111) = ( -0.1351351 -0.0000000 0.1351351), wk = 0.0041322 k( 112) = ( -0.1486486 -0.0000000 0.1486486), wk = 0.0041322 k( 113) = ( -0.1621622 -0.0000000 0.1621622), wk = 0.0041322 k( 114) = ( -0.1756757 -0.0000000 0.1756757), wk = 0.0041322 k( 115) = ( -0.1891892 -0.0000000 0.1891892), wk = 0.0041322 k( 116) = ( -0.2027027 -0.0000000 0.2027027), wk = 0.0041322 k( 117) = ( -0.2162162 -0.0000000 0.2162162), wk = 0.0041322 k( 118) = ( -0.2297297 -0.0000000 0.2297297), wk = 0.0041322 k( 119) = ( -0.2432432 0.0000000 0.2432432), wk = 0.0041322 k( 120) = ( -0.2567568 -0.0000000 0.2567568), wk = 0.0041322 k( 121) = ( -0.2702703 -0.0000000 0.2702703), wk = 0.0041322 k( 122) = ( -0.2837838 -0.0000000 0.2837838), wk = 0.0041322 k( 123) = ( -0.2972973 -0.0000000 0.2972973), wk = 0.0041322 k( 124) = ( -0.3108108 -0.0000000 0.3108108), wk = 0.0041322 k( 125) = ( -0.3243243 -0.0000000 0.3243243), wk = 0.0041322 k( 126) = ( -0.3378378 -0.0000000 0.3378378), wk = 0.0041322 k( 127) = ( -0.3513514 -0.0000000 0.3513514), wk = 0.0041322 k( 128) = ( -0.3648649 -0.0000000 0.3648649), wk = 0.0041322 k( 129) = ( -0.3783784 -0.0000000 0.3783784), wk = 0.0041322 k( 130) = ( -0.3918919 -0.0000000 0.3918919), wk = 0.0041322 k( 131) = ( -0.4054054 -0.0000000 0.4054054), wk = 0.0041322 k( 132) = ( -0.4189189 -0.0000000 0.4189189), wk = 0.0041322 k( 133) = ( -0.4324324 -0.0000000 0.4324324), wk = 0.0041322 k( 134) = ( -0.4459459 0.0000000 0.4459460), wk = 0.0041322 k( 135) = ( -0.4594595 -0.0000000 0.4594595), wk = 0.0041322 k( 136) = ( -0.4729730 -0.0000000 0.4729730), wk = 0.0041322 k( 137) = ( -0.4864865 0.0000000 0.4864865), wk = 0.0041322 k( 138) = ( -0.5000000 -0.0000000 0.5000000), wk = 0.0041322 k( 139) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0041322 k( 140) = ( -0.4893617 -0.4893617 0.4893617), wk = 0.0041322 k( 141) = ( -0.4787234 -0.4787234 0.4787234), wk = 0.0041322 k( 142) = ( -0.4680851 -0.4680851 0.4680851), wk = 0.0041322 k( 143) = ( -0.4574468 -0.4574468 0.4574468), wk = 0.0041322 k( 144) = ( -0.4468085 -0.4468085 0.4468085), wk = 0.0041322 k( 145) = ( -0.4361702 -0.4361702 0.4361702), wk = 0.0041322 k( 146) = ( -0.4255319 -0.4255319 0.4255319), wk = 0.0041322 k( 147) = ( -0.4148936 -0.4148936 0.4148936), wk = 0.0041322 k( 148) = ( -0.4042553 -0.4042553 0.4042553), wk = 0.0041322 k( 149) = ( -0.3936170 -0.3936170 0.3936170), wk = 0.0041322 k( 150) = ( -0.3829787 -0.3829787 0.3829787), wk = 0.0041322 k( 151) = ( -0.3723404 -0.3723404 0.3723404), wk = 0.0041322 k( 152) = ( -0.3617021 -0.3617021 0.3617021), wk = 0.0041322 k( 153) = ( -0.3510638 -0.3510638 0.3510638), wk = 0.0041322 k( 154) = ( -0.3404255 -0.3404255 0.3404255), wk = 0.0041322 k( 155) = ( -0.3297872 -0.3297872 0.3297872), wk = 0.0041322 k( 156) = ( -0.3191489 -0.3191489 0.3191489), wk = 0.0041322 k( 157) = ( -0.3085106 -0.3085106 0.3085106), wk = 0.0041322 k( 158) = ( -0.2978723 -0.2978723 0.2978723), wk = 0.0041322 k( 159) = ( -0.2872340 -0.2872340 0.2872340), wk = 0.0041322 k( 160) = ( -0.2765957 -0.2765957 0.2765957), wk = 0.0041322 k( 161) = ( -0.2659574 -0.2659574 0.2659574), wk = 0.0041322 k( 162) = ( -0.2553191 -0.2553191 0.2553192), wk = 0.0041322 k( 163) = ( -0.2446809 -0.2446809 0.2446809), wk = 0.0041322 k( 164) = ( -0.2340425 -0.2340425 0.2340426), wk = 0.0041322 k( 165) = ( -0.2234043 -0.2234043 0.2234043), wk = 0.0041322 k( 166) = ( -0.2127660 -0.2127660 0.2127660), wk = 0.0041322 k( 167) = ( -0.2021277 -0.2021277 0.2021277), wk = 0.0041322 k( 168) = ( -0.1914894 -0.1914894 0.1914894), wk = 0.0041322 k( 169) = ( -0.1808511 -0.1808511 0.1808511), wk = 0.0041322 k( 170) = ( -0.1702128 -0.1702128 0.1702128), wk = 0.0041322 k( 171) = ( -0.1595745 -0.1595745 0.1595745), wk = 0.0041322 k( 172) = ( -0.1489362 -0.1489362 0.1489362), wk = 0.0041322 k( 173) = ( -0.1382979 -0.1382979 0.1382979), wk = 0.0041322 k( 174) = ( -0.1276596 -0.1276596 0.1276596), wk = 0.0041322 k( 175) = ( -0.1170213 -0.1170213 0.1170213), wk = 0.0041322 k( 176) = ( -0.1063830 -0.1063830 0.1063830), wk = 0.0041322 k( 177) = ( -0.0957447 -0.0957447 0.0957447), wk = 0.0041322 k( 178) = ( -0.0851064 -0.0851064 0.0851064), wk = 0.0041322 k( 179) = ( -0.0744681 -0.0744681 0.0744681), wk = 0.0041322 k( 180) = ( -0.0638298 -0.0638298 0.0638298), wk = 0.0041322 k( 181) = ( -0.0531915 -0.0531915 0.0531915), wk = 0.0041322 k( 182) = ( -0.0425532 -0.0425532 0.0425532), wk = 0.0041322 k( 183) = ( -0.0319149 -0.0319149 0.0319149), wk = 0.0041322 k( 184) = ( -0.0212766 -0.0212766 0.0212766), wk = 0.0041322 k( 185) = ( -0.0106383 -0.0106383 0.0106383), wk = 0.0041322 k( 186) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 187) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 188) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0041322 k( 189) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0041322 k( 190) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0041322 k( 191) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0041322 k( 192) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0041322 k( 193) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0041322 k( 194) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0041322 k( 195) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0041322 k( 196) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0041322 k( 197) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0041322 k( 198) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0041322 k( 199) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0041322 k( 200) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0041322 k( 201) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0041322 k( 202) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0041322 k( 203) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0041322 k( 204) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0041322 k( 205) = ( 0.0000000 0.0000000 0.3461539), wk = 0.0041322 k( 206) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0041322 k( 207) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0041322 k( 208) = ( 0.0000000 0.0000000 0.4038462), wk = 0.0041322 k( 209) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0041322 k( 210) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0041322 k( 211) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0041322 k( 212) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0041322 k( 213) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0041322 k( 214) = ( 0.0000000 -0.5000000 0.5000000), wk = 0.0041322 k( 215) = ( 0.0000000 -0.4821429 0.4821429), wk = 0.0041322 k( 216) = ( 0.0000000 -0.4642857 0.4642857), wk = 0.0041322 k( 217) = ( 0.0000000 -0.4464286 0.4464286), wk = 0.0041322 k( 218) = ( 0.0000000 -0.4285714 0.4285714), wk = 0.0041322 k( 219) = ( 0.0000000 -0.4107143 0.4107143), wk = 0.0041322 k( 220) = ( 0.0000000 -0.3928571 0.3928571), wk = 0.0041322 k( 221) = ( 0.0000000 -0.3750000 0.3750000), wk = 0.0041322 k( 222) = ( 0.0000000 -0.3571429 0.3571429), wk = 0.0041322 k( 223) = ( 0.0000000 -0.3392857 0.3392857), wk = 0.0041322 k( 224) = ( 0.0000000 -0.3214286 0.3214286), wk = 0.0041322 k( 225) = ( 0.0000000 -0.3035714 0.3035714), wk = 0.0041322 k( 226) = ( 0.0000000 -0.2857143 0.2857143), wk = 0.0041322 k( 227) = ( 0.0000000 -0.2678571 0.2678571), wk = 0.0041322 k( 228) = ( 0.0000000 -0.2500000 0.2500000), wk = 0.0041322 k( 229) = ( 0.0000000 -0.2321429 0.2321429), wk = 0.0041322 k( 230) = ( 0.0000000 -0.2142857 0.2142857), wk = 0.0041322 k( 231) = ( 0.0000000 -0.1964286 0.1964286), wk = 0.0041322 k( 232) = ( 0.0000000 -0.1785714 0.1785714), wk = 0.0041322 k( 233) = ( 0.0000000 -0.1607143 0.1607143), wk = 0.0041322 k( 234) = ( 0.0000000 -0.1428571 0.1428571), wk = 0.0041322 k( 235) = ( 0.0000000 -0.1250000 0.1250000), wk = 0.0041322 k( 236) = ( 0.0000000 -0.1071429 0.1071429), wk = 0.0041322 k( 237) = ( 0.0000000 -0.0892857 0.0892857), wk = 0.0041322 k( 238) = ( 0.0000000 -0.0714286 0.0714286), wk = 0.0041322 k( 239) = ( 0.0000000 -0.0535714 0.0535714), wk = 0.0041322 k( 240) = ( 0.0000000 -0.0357143 0.0357143), wk = 0.0041322 k( 241) = ( 0.0000000 -0.0178571 0.0178571), wk = 0.0041322 k( 242) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 Dense grid: 140135 G-vectors FFT dimensions: ( 60, 75, 80) Smooth grid: 61047 G-vectors FFT dimensions: ( 45, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.26 Mb ( 226, 76) NL pseudopotentials 0.32 Mb ( 113, 184) Each V/rho on FFT grid 0.14 Mb ( 9000) Each G-vector array 0.01 Mb ( 1943) G-vector shells 0.01 Mb ( 1943) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.05 Mb ( 226, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.43 Mb ( 184, 2, 76) Check: negative/imaginary core charge= -0.000008 0.000000 The potential is recalculated from file : ./H2C2O.save/charge-density.dat Starting wfc are 112 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 3.8 secs Computing kpt #: 3 total cpu time spent up to now is 5.1 secs Computing kpt #: 4 total cpu time spent up to now is 6.3 secs Computing kpt #: 5 total cpu time spent up to now is 7.6 secs Computing kpt #: 6 total cpu time spent up to now is 8.8 secs Computing kpt #: 7 total cpu time spent up to now is 10.1 secs Computing kpt #: 8 total cpu time spent up to now is 11.4 secs Computing kpt #: 9 total cpu time spent up to now is 12.7 secs Computing kpt #: 10 total cpu time spent up to now is 14.1 secs Computing kpt #: 11 total cpu time spent up to now is 15.6 secs Computing kpt #: 12 total cpu time spent up to now is 17.1 secs Computing kpt #: 13 total cpu time spent up to now is 18.5 secs Computing kpt #: 14 total cpu time spent up to now is 19.9 secs Computing kpt #: 15 total cpu time spent up to now is 21.3 secs Computing kpt #: 16 total cpu time spent up to now is 22.6 secs Computing kpt #: 17 total cpu time spent up to now is 23.9 secs Computing kpt #: 18 total cpu time spent up to now is 25.2 secs Computing kpt #: 19 total cpu time spent up to now is 26.6 secs Computing kpt #: 20 total cpu time spent up to now is 27.9 secs Computing kpt #: 21 total cpu time spent up to now is 29.3 secs Computing kpt #: 22 total cpu time spent up to now is 30.6 secs Computing kpt #: 23 total cpu time spent up to now is 31.9 secs Computing kpt #: 24 total cpu time spent up to now is 33.4 secs Computing kpt #: 25 total cpu time spent up to now is 34.7 secs Computing kpt #: 26 total cpu time spent up to now is 36.0 secs Computing kpt #: 27 total cpu time spent up to now is 37.3 secs Computing kpt #: 28 total cpu time spent up to now is 38.6 secs Computing kpt #: 29 total cpu time spent up to now is 39.9 secs Computing kpt #: 30 total cpu time spent up to now is 41.2 secs Computing kpt #: 31 total cpu time spent up to now is 42.5 secs Computing kpt #: 32 total cpu time spent up to now is 43.8 secs Computing kpt #: 33 total cpu time spent up to now is 45.1 secs Computing kpt #: 34 total cpu time spent up to now is 46.5 secs Computing kpt #: 35 total cpu time spent up to now is 47.8 secs Computing kpt #: 36 total cpu time spent up to now is 49.2 secs Computing kpt #: 37 total cpu time spent up to now is 50.5 secs Computing kpt #: 38 total cpu time spent up to now is 51.8 secs Computing kpt #: 39 total cpu time spent up to now is 53.1 secs Computing kpt #: 40 total cpu time spent up to now is 54.3 secs Computing kpt #: 41 total cpu time spent up to now is 55.5 secs Computing kpt #: 42 total cpu time spent up to now is 56.8 secs Computing kpt #: 43 total cpu time spent up to now is 58.1 secs Computing kpt #: 44 total cpu time spent up to now is 59.3 secs Computing kpt #: 45 total cpu time spent up to now is 60.6 secs Computing kpt #: 46 total cpu time spent up to now is 61.9 secs Computing kpt #: 47 total cpu time spent up to now is 63.1 secs Computing kpt #: 48 total cpu time spent up to now is 64.4 secs Computing kpt #: 49 total cpu time spent up to now is 65.6 secs Computing kpt #: 50 total cpu time spent up to now is 66.9 secs Computing kpt #: 51 total cpu time spent up to now is 68.1 secs Computing kpt #: 52 total cpu time spent up to now is 69.4 secs Computing kpt #: 53 total cpu time spent up to now is 70.7 secs Computing kpt #: 54 total cpu time spent up to now is 71.9 secs Computing kpt #: 55 total cpu time spent up to now is 73.2 secs Computing kpt #: 56 total cpu time spent up to now is 74.5 secs Computing kpt #: 57 total cpu time spent up to now is 75.8 secs Computing kpt #: 58 total cpu time spent up to now is 77.2 secs Computing kpt #: 59 total cpu time spent up to now is 78.5 secs Computing kpt #: 60 total cpu time spent up to now is 79.8 secs Computing kpt #: 61 total cpu time spent up to now is 81.1 secs Computing kpt #: 62 total cpu time spent up to now is 82.3 secs Computing kpt #: 63 total cpu time spent up to now is 83.6 secs Computing kpt #: 64 total cpu time spent up to now is 84.9 secs Computing kpt #: 65 total cpu time spent up to now is 86.3 secs Computing kpt #: 66 total cpu time spent up to now is 87.6 secs Computing kpt #: 67 total cpu time spent up to now is 89.0 secs Computing kpt #: 68 total cpu time spent up to now is 90.3 secs Computing kpt #: 69 total cpu time spent up to now is 91.7 secs Computing kpt #: 70 total cpu time spent up to now is 93.0 secs Computing kpt #: 71 total cpu time spent up to now is 94.5 secs Computing kpt #: 72 total cpu time spent up to now is 96.0 secs Computing kpt #: 73 total cpu time spent up to now is 97.5 secs Computing kpt #: 74 total cpu time spent up to now is 98.9 secs Computing kpt #: 75 total cpu time spent up to now is 100.3 secs Computing kpt #: 76 total cpu time spent up to now is 101.6 secs Computing kpt #: 77 total cpu time spent up to now is 103.0 secs Computing kpt #: 78 total cpu time spent up to now is 104.3 secs Computing kpt #: 79 total cpu time spent up to now is 105.6 secs Computing kpt #: 80 total cpu time spent up to now is 106.8 secs Computing kpt #: 81 total cpu time spent up to now is 108.1 secs Computing kpt #: 82 total cpu time spent up to now is 109.4 secs Computing kpt #: 83 total cpu time spent up to now is 110.8 secs Computing kpt #: 84 total cpu time spent up to now is 112.1 secs Computing kpt #: 85 total cpu time spent up to now is 113.4 secs Computing kpt #: 86 total cpu time spent up to now is 114.9 secs Computing kpt #: 87 total cpu time spent up to now is 116.2 secs Computing kpt #: 88 total cpu time spent up to now is 117.6 secs Computing kpt #: 89 total cpu time spent up to now is 119.0 secs Computing kpt #: 90 total cpu time spent up to now is 120.3 secs Computing kpt #: 91 total cpu time spent up to now is 121.7 secs Computing kpt #: 92 total cpu time spent up to now is 123.1 secs Computing kpt #: 93 total cpu time spent up to now is 124.4 secs Computing kpt #: 94 total cpu time spent up to now is 125.8 secs Computing kpt #: 95 total cpu time spent up to now is 127.5 secs Computing kpt #: 96 total cpu time spent up to now is 128.9 secs Computing kpt #: 97 total cpu time spent up to now is 130.2 secs Computing kpt #: 98 total cpu time spent up to now is 131.5 secs Computing kpt #: 99 total cpu time spent up to now is 132.8 secs Computing kpt #: 100 total cpu time spent up to now is 134.1 secs Computing kpt #: 101 total cpu time spent up to now is 135.3 secs Computing kpt #: 102 total cpu time spent up to now is 136.7 secs Computing kpt #: 103 total cpu time spent up to now is 138.0 secs Computing kpt #: 104 total cpu time spent up to now is 139.3 secs Computing kpt #: 105 total cpu time spent up to now is 140.6 secs Computing kpt #: 106 total cpu time spent up to now is 142.0 secs Computing kpt #: 107 total cpu time spent up to now is 143.3 secs Computing kpt #: 108 total cpu time spent up to now is 144.6 secs Computing kpt #: 109 total cpu time spent up to now is 145.9 secs Computing kpt #: 110 total cpu time spent up to now is 147.1 secs Computing kpt #: 111 total cpu time spent up to now is 148.4 secs Computing kpt #: 112 total cpu time spent up to now is 149.6 secs Computing kpt #: 113 total cpu time spent up to now is 150.9 secs Computing kpt #: 114 total cpu time spent up to now is 152.1 secs Computing kpt #: 115 total cpu time spent up to now is 153.4 secs Computing kpt #: 116 total cpu time spent up to now is 154.6 secs Computing kpt #: 117 total cpu time spent up to now is 155.9 secs Computing kpt #: 118 total cpu time spent up to now is 157.1 secs Computing kpt #: 119 total cpu time spent up to now is 158.5 secs Computing kpt #: 120 total cpu time spent up to now is 159.7 secs Computing kpt #: 121 total cpu time spent up to now is 161.1 secs Computing kpt #: 122 total cpu time spent up to now is 162.4 secs Computing kpt #: 123 total cpu time spent up to now is 163.6 secs Computing kpt #: 124 total cpu time spent up to now is 164.9 secs Computing kpt #: 125 total cpu time spent up to now is 166.1 secs Computing kpt #: 126 total cpu time spent up to now is 167.4 secs Computing kpt #: 127 total cpu time spent up to now is 168.6 secs Computing kpt #: 128 total cpu time spent up to now is 169.9 secs Computing kpt #: 129 total cpu time spent up to now is 171.1 secs Computing kpt #: 130 total cpu time spent up to now is 172.4 secs Computing kpt #: 131 total cpu time spent up to now is 173.9 secs Computing kpt #: 132 total cpu time spent up to now is 175.2 secs Computing kpt #: 133 total cpu time spent up to now is 176.4 secs Computing kpt #: 134 total cpu time spent up to now is 177.7 secs Computing kpt #: 135 total cpu time spent up to now is 179.0 secs Computing kpt #: 136 total cpu time spent up to now is 180.3 secs Computing kpt #: 137 total cpu time spent up to now is 181.7 secs Computing kpt #: 138 total cpu time spent up to now is 183.0 secs Computing kpt #: 139 total cpu time spent up to now is 184.4 secs Computing kpt #: 140 total cpu time spent up to now is 185.8 secs Computing kpt #: 141 total cpu time spent up to now is 187.2 secs Computing kpt #: 142 total cpu time spent up to now is 188.6 secs Computing kpt #: 143 total cpu time spent up to now is 190.1 secs Computing kpt #: 144 total cpu time spent up to now is 191.6 secs Computing kpt #: 145 total cpu time spent up to now is 193.0 secs Computing kpt #: 146 total cpu time spent up to now is 194.4 secs Computing kpt #: 147 total cpu time spent up to now is 195.8 secs Computing kpt #: 148 total cpu time spent up to now is 197.2 secs Computing kpt #: 149 total cpu time spent up to now is 198.6 secs Computing kpt #: 150 total cpu time spent up to now is 199.9 secs Computing kpt #: 151 total cpu time spent up to now is 201.3 secs Computing kpt #: 152 total cpu time spent up to now is 202.7 secs Computing kpt #: 153 total cpu time spent up to now is 204.1 secs Computing kpt #: 154 total cpu time spent up to now is 205.8 secs Computing kpt #: 155 total cpu time spent up to now is 207.2 secs Computing kpt #: 156 total cpu time spent up to now is 208.5 secs Computing kpt #: 157 total cpu time spent up to now is 209.9 secs Computing kpt #: 158 total cpu time spent up to now is 211.3 secs Computing kpt #: 159 total cpu time spent up to now is 212.6 secs Computing kpt #: 160 total cpu time spent up to now is 213.8 secs Computing kpt #: 161 total cpu time spent up to now is 215.1 secs Computing kpt #: 162 total cpu time spent up to now is 216.3 secs Computing kpt #: 163 total cpu time spent up to now is 217.6 secs Computing kpt #: 164 total cpu time spent up to now is 218.8 secs Computing kpt #: 165 total cpu time spent up to now is 220.0 secs Computing kpt #: 166 total cpu time spent up to now is 221.3 secs Computing kpt #: 167 total cpu time spent up to now is 222.6 secs Computing kpt #: 168 total cpu time spent up to now is 223.8 secs Computing kpt #: 169 total cpu time spent up to now is 225.1 secs Computing kpt #: 170 total cpu time spent up to now is 226.3 secs Computing kpt #: 171 total cpu time spent up to now is 227.6 secs Computing kpt #: 172 total cpu time spent up to now is 228.8 secs Computing kpt #: 173 total cpu time spent up to now is 230.1 secs Computing kpt #: 174 total cpu time spent up to now is 231.4 secs Computing kpt #: 175 total cpu time spent up to now is 232.7 secs Computing kpt #: 176 total cpu time spent up to now is 234.0 secs Computing kpt #: 177 total cpu time spent up to now is 235.3 secs Computing kpt #: 178 total cpu time spent up to now is 236.7 secs Computing kpt #: 179 total cpu time spent up to now is 238.0 secs Computing kpt #: 180 total cpu time spent up to now is 239.3 secs Computing kpt #: 181 total cpu time spent up to now is 240.6 secs Computing kpt #: 182 total cpu time spent up to now is 242.0 secs Computing kpt #: 183 total cpu time spent up to now is 243.3 secs Computing kpt #: 184 total cpu time spent up to now is 244.6 secs Computing kpt #: 185 total cpu time spent up to now is 245.9 secs Computing kpt #: 186 total cpu time spent up to now is 247.3 secs Computing kpt #: 187 total cpu time spent up to now is 248.6 secs Computing kpt #: 188 total cpu time spent up to now is 249.9 secs Computing kpt #: 189 total cpu time spent up to now is 251.3 secs Computing kpt #: 190 total cpu time spent up to now is 252.7 secs Computing kpt #: 191 total cpu time spent up to now is 254.1 secs Computing kpt #: 192 total cpu time spent up to now is 255.5 secs Computing kpt #: 193 total cpu time spent up to now is 256.8 secs Computing kpt #: 194 total cpu time spent up to now is 258.1 secs Computing kpt #: 195 total cpu time spent up to now is 259.3 secs Computing kpt #: 196 total cpu time spent up to now is 260.6 secs Computing kpt #: 197 total cpu time spent up to now is 261.8 secs Computing kpt #: 198 total cpu time spent up to now is 263.1 secs Computing kpt #: 199 total cpu time spent up to now is 264.4 secs Computing kpt #: 200 total cpu time spent up to now is 265.8 secs Computing kpt #: 201 total cpu time spent up to now is 267.1 secs Computing kpt #: 202 total cpu time spent up to now is 268.5 secs Computing kpt #: 203 total cpu time spent up to now is 269.8 secs Computing kpt #: 204 total cpu time spent up to now is 271.1 secs Computing kpt #: 205 total cpu time spent up to now is 272.5 secs Computing kpt #: 206 total cpu time spent up to now is 273.8 secs Computing kpt #: 207 total cpu time spent up to now is 275.2 secs Computing kpt #: 208 total cpu time spent up to now is 276.5 secs Computing kpt #: 209 total cpu time spent up to now is 277.8 secs Computing kpt #: 210 total cpu time spent up to now is 279.1 secs Computing kpt #: 211 total cpu time spent up to now is 280.4 secs Computing kpt #: 212 total cpu time spent up to now is 281.7 secs Computing kpt #: 213 total cpu time spent up to now is 283.0 secs Computing kpt #: 214 total cpu time spent up to now is 284.3 secs Computing kpt #: 215 total cpu time spent up to now is 285.5 secs Computing kpt #: 216 total cpu time spent up to now is 286.8 secs Computing kpt #: 217 total cpu time spent up to now is 288.1 secs Computing kpt #: 218 total cpu time spent up to now is 289.3 secs Computing kpt #: 219 total cpu time spent up to now is 290.6 secs Computing kpt #: 220 total cpu time spent up to now is 291.9 secs Computing kpt #: 221 total cpu time spent up to now is 293.1 secs Computing kpt #: 222 total cpu time spent up to now is 294.4 secs Computing kpt #: 223 total cpu time spent up to now is 295.6 secs Computing kpt #: 224 total cpu time spent up to now is 296.9 secs Computing kpt #: 225 total cpu time spent up to now is 298.2 secs Computing kpt #: 226 total cpu time spent up to now is 299.4 secs Computing kpt #: 227 total cpu time spent up to now is 300.7 secs Computing kpt #: 228 total cpu time spent up to now is 302.0 secs Computing kpt #: 229 total cpu time spent up to now is 303.5 secs Computing kpt #: 230 total cpu time spent up to now is 304.8 secs Computing kpt #: 231 total cpu time spent up to now is 306.1 secs Computing kpt #: 232 total cpu time spent up to now is 307.3 secs Computing kpt #: 233 total cpu time spent up to now is 308.6 secs Computing kpt #: 234 total cpu time spent up to now is 309.9 secs Computing kpt #: 235 total cpu time spent up to now is 311.1 secs Computing kpt #: 236 total cpu time spent up to now is 312.4 secs Computing kpt #: 237 total cpu time spent up to now is 313.8 secs Computing kpt #: 238 total cpu time spent up to now is 315.1 secs Computing kpt #: 239 total cpu time spent up to now is 316.5 secs Computing kpt #: 240 total cpu time spent up to now is 317.8 secs Computing kpt #: 241 total cpu time spent up to now is 319.0 secs Computing kpt #: 242 total cpu time spent up to now is 320.4 secs ethr = 1.56E-08, avg # of iterations = 25.3 total cpu time spent up to now is 320.4 secs End of band structure calculation k = 0.0000-0.3794-0.1921 ( 7662 PWs) bands (ev): -22.6438 -22.6438 -22.3322 -22.3322 -19.9664 -19.9664 -19.6893 -19.6893 -14.0718 -14.0718 -14.0187 -14.0187 -12.6720 -12.6720 -12.4014 -12.4014 -10.9869 -10.9869 -10.5309 -10.5309 -8.3989 -8.3989 -7.6398 -7.6398 -6.5313 -6.5313 -6.1315 -6.1315 -5.7393 -5.7393 -5.6752 -5.6752 -5.6138 -5.6138 -5.4174 -5.4174 -5.1738 -5.1738 -5.0863 -5.0863 -5.0267 -5.0267 -4.9430 -4.9430 -4.5811 -4.5811 -3.3745 -3.3745 -2.3863 -2.3863 -2.0925 -2.0925 -1.6482 -1.6482 -1.3213 -1.3213 -1.2457 -1.2457 -1.1351 -1.1351 -0.8115 -0.8115 -0.6161 -0.6161 3.5364 3.5364 4.2195 4.2195 5.7023 5.7023 6.5824 6.5824 6.8966 6.8966 6.9460 6.9460 k = 0.0000-0.3654-0.1850 ( 7661 PWs) bands (ev): -22.6438 -22.6438 -22.3321 -22.3321 -19.9664 -19.9664 -19.6893 -19.6893 -14.0720 -14.0720 -14.0184 -14.0184 -12.6716 -12.6716 -12.4022 -12.4022 -10.9863 -10.9863 -10.5311 -10.5311 -8.3989 -8.3989 -7.6399 -7.6399 -6.5312 -6.5312 -6.1316 -6.1316 -5.7392 -5.7392 -5.6749 -5.6749 -5.6136 -5.6136 -5.4181 -5.4181 -5.1741 -5.1741 -5.0864 -5.0864 -5.0264 -5.0264 -4.9430 -4.9430 -4.5809 -4.5809 -3.3744 -3.3744 -2.3867 -2.3867 -2.0916 -2.0916 -1.6483 -1.6483 -1.3219 -1.3219 -1.2463 -1.2463 -1.1343 -1.1343 -0.8111 -0.8111 -0.6162 -0.6162 3.5370 3.5370 4.2187 4.2187 5.7033 5.7033 6.5784 6.5784 6.8497 6.8497 6.9974 6.9974 k = 0.0000-0.3513-0.1779 ( 7656 PWs) bands (ev): -22.6438 -22.6438 -22.3321 -22.3321 -19.9664 -19.9664 -19.6894 -19.6894 -14.0726 -14.0726 -14.0176 -14.0176 -12.6705 -12.6705 -12.4046 -12.4046 -10.9844 -10.9844 -10.5317 -10.5317 -8.3992 -8.3992 -7.6402 -7.6402 -6.5311 -6.5311 -6.1317 -6.1317 -5.7388 -5.7388 -5.6742 -5.6742 -5.6129 -5.6129 -5.4201 -5.4201 -5.1750 -5.1750 -5.0867 -5.0867 -5.0256 -5.0256 -4.9433 -4.9433 -4.5803 -4.5803 -3.3741 -3.3741 -2.3877 -2.3877 -2.0889 -2.0889 -1.6486 -1.6486 -1.3238 -1.3238 -1.2483 -1.2483 -1.1321 -1.1321 -0.8099 -0.8099 -0.6162 -0.6162 3.5387 3.5387 4.2161 4.2161 5.7063 5.7063 6.5655 6.5655 6.7910 6.7910 7.0704 7.0704 k = 0.0000-0.3373-0.1707 ( 7648 PWs) bands (ev): -22.6439 -22.6439 -22.3320 -22.3320 -19.9663 -19.9663 -19.6894 -19.6894 -14.0735 -14.0735 -14.0163 -14.0163 -12.6686 -12.6686 -12.4085 -12.4085 -10.9813 -10.9813 -10.5325 -10.5325 -8.3996 -8.3996 -7.6406 -7.6406 -6.5309 -6.5309 -6.1320 -6.1320 -5.7383 -5.7383 -5.6730 -5.6730 -5.6117 -5.6117 -5.4234 -5.4234 -5.1765 -5.1765 -5.0872 -5.0872 -5.0243 -5.0243 -4.9437 -4.9437 -4.5794 -4.5794 -3.3736 -3.3736 -2.3893 -2.3893 -2.0845 -2.0845 -1.6490 -1.6490 -1.3269 -1.3269 -1.2514 -1.2514 -1.1286 -1.1286 -0.8080 -0.8080 -0.6164 -0.6164 3.5416 3.5416 4.2120 4.2120 5.7113 5.7113 6.5419 6.5419 6.7404 6.7404 7.1470 7.1470 k = 0.0000-0.3232-0.1636 ( 7648 PWs) bands (ev): -22.6440 -22.6440 -22.3319 -22.3319 -19.9662 -19.9662 -19.6895 -19.6895 -14.0748 -14.0748 -14.0145 -14.0145 -12.6660 -12.6660 -12.4139 -12.4139 -10.9771 -10.9771 -10.5337 -10.5337 -8.4001 -8.4001 -7.6413 -7.6413 -6.5305 -6.5305 -6.1325 -6.1325 -5.7375 -5.7375 -5.6712 -5.6712 -5.6102 -5.6102 -5.4278 -5.4278 -5.1784 -5.1784 -5.0881 -5.0881 -5.0225 -5.0225 -4.9443 -4.9443 -4.5781 -4.5781 -3.3729 -3.3729 -2.3915 -2.3915 -2.0785 -2.0785 -1.6495 -1.6495 -1.3314 -1.3314 -1.2553 -1.2553 -1.1240 -1.1240 -0.8054 -0.8054 -0.6165 -0.6165 3.5455 3.5455 4.2064 4.2064 5.7182 5.7182 6.5064 6.5064 6.7006 6.7006 7.2256 7.2256 k = 0.0000-0.3092-0.1565 ( 7648 PWs) bands (ev): -22.6441 -22.6441 -22.3318 -22.3318 -19.9662 -19.9662 -19.6896 -19.6896 -14.0764 -14.0764 -14.0122 -14.0122 -12.6627 -12.6627 -12.4207 -12.4207 -10.9720 -10.9720 -10.5350 -10.5350 -8.4007 -8.4007 -7.6423 -7.6423 -6.5300 -6.5300 -6.1330 -6.1330 -5.7367 -5.7367 -5.6689 -5.6689 -5.6082 -5.6082 -5.4332 -5.4332 -5.1807 -5.1807 -5.0893 -5.0893 -5.0203 -5.0203 -4.9450 -4.9450 -4.5767 -4.5767 -3.3720 -3.3720 -2.3941 -2.3941 -2.0712 -2.0712 -1.6502 -1.6502 -1.3370 -1.3370 -1.2596 -1.2596 -1.1187 -1.1187 -0.8021 -0.8021 -0.6167 -0.6167 3.5504 3.5504 4.1993 4.1993 5.7270 5.7270 6.4606 6.4606 6.6706 6.6706 7.3055 7.3055 k = 0.0000-0.2951-0.1494 ( 7648 PWs) bands (ev): -22.6442 -22.6442 -22.3316 -22.3316 -19.9661 -19.9661 -19.6897 -19.6897 -14.0783 -14.0783 -14.0095 -14.0095 -12.6589 -12.6589 -12.4286 -12.4286 -10.9661 -10.9661 -10.5366 -10.5366 -8.4014 -8.4014 -7.6437 -7.6437 -6.5293 -6.5293 -6.1338 -6.1338 -5.7359 -5.7359 -5.6661 -5.6661 -5.6059 -5.6059 -5.4394 -5.4394 -5.1833 -5.1833 -5.0909 -5.0909 -5.0177 -5.0177 -4.9458 -4.9458 -4.5753 -4.5753 -3.3709 -3.3709 -2.3969 -2.3969 -2.0627 -2.0627 -1.6510 -1.6510 -1.3439 -1.3439 -1.2642 -1.2642 -1.1127 -1.1127 -0.7984 -0.7984 -0.6168 -0.6168 3.5560 3.5560 4.1911 4.1911 5.7376 5.7376 6.4084 6.4084 6.6468 6.6468 7.3860 7.3860 k = 0.0000-0.2810-0.1423 ( 7640 PWs) bands (ev): -22.6444 -22.6444 -22.3315 -22.3315 -19.9660 -19.9660 -19.6898 -19.6898 -14.0803 -14.0803 -14.0064 -14.0064 -12.6547 -12.6547 -12.4374 -12.4374 -10.9596 -10.9596 -10.5381 -10.5381 -8.4020 -8.4020 -7.6454 -7.6454 -6.5283 -6.5283 -6.1347 -6.1347 -5.7352 -5.7352 -5.6626 -5.6626 -5.6033 -5.6033 -5.4461 -5.4461 -5.1859 -5.1859 -5.0928 -5.0928 -5.0148 -5.0148 -4.9467 -4.9467 -4.5739 -4.5739 -3.3695 -3.3695 -2.4000 -2.4000 -2.0533 -2.0533 -1.6518 -1.6518 -1.3519 -1.3519 -1.2688 -1.2688 -1.1062 -1.1062 -0.7942 -0.7942 -0.6169 -0.6169 3.5623 3.5623 4.1819 4.1819 5.7499 5.7499 6.3534 6.3534 6.6262 6.6262 7.4666 7.4666 k = 0.0000-0.2670-0.1352 ( 7643 PWs) bands (ev): -22.6445 -22.6445 -22.3313 -22.3313 -19.9658 -19.9658 -19.6900 -19.6900 -14.0826 -14.0826 -14.0029 -14.0029 -12.6502 -12.6502 -12.4469 -12.4469 -10.9528 -10.9528 -10.5395 -10.5395 -8.4026 -8.4026 -7.6476 -7.6476 -6.5271 -6.5271 -6.1359 -6.1359 -5.7348 -5.7348 -5.6586 -5.6586 -5.6006 -5.6006 -5.4531 -5.4531 -5.1887 -5.1887 -5.0951 -5.0951 -5.0117 -5.0117 -4.9475 -4.9475 -4.5726 -4.5726 -3.3680 -3.3680 -2.4031 -2.4031 -2.0431 -2.0431 -1.6527 -1.6527 -1.3608 -1.3608 -1.2732 -1.2732 -1.0995 -1.0995 -0.7898 -0.7898 -0.6170 -0.6170 3.5689 3.5689 4.1720 4.1720 5.7637 5.7637 6.2979 6.2979 6.6068 6.6068 7.5464 7.5464 k = 0.0000-0.2529-0.1281 ( 7637 PWs) bands (ev): -22.6447 -22.6447 -22.3311 -22.3311 -19.9657 -19.9657 -19.6901 -19.6901 -14.0850 -14.0850 -13.9992 -13.9992 -12.6456 -12.6456 -12.4569 -12.4569 -10.9458 -10.9458 -10.5408 -10.5408 -8.4030 -8.4030 -7.6503 -7.6503 -6.5255 -6.5255 -6.1372 -6.1372 -5.7346 -5.7346 -5.6540 -5.6540 -5.5979 -5.5979 -5.4600 -5.4600 -5.1914 -5.1914 -5.0978 -5.0978 -5.0087 -5.0087 -4.9483 -4.9483 -4.5716 -4.5716 -3.3663 -3.3663 -2.4062 -2.4062 -2.0323 -2.0323 -1.6536 -1.6536 -1.3706 -1.3706 -1.2774 -1.2774 -1.0926 -1.0926 -0.7851 -0.7851 -0.6170 -0.6170 3.5757 3.5757 4.1615 4.1615 5.7791 5.7791 6.2431 6.2431 6.5875 6.5875 7.6239 7.6239 k = 0.0000-0.2389-0.1209 ( 7637 PWs) bands (ev): -22.6449 -22.6449 -22.3309 -22.3309 -19.9655 -19.9655 -19.6903 -19.6903 -14.0876 -14.0876 -13.9952 -13.9952 -12.6410 -12.6410 -12.4670 -12.4670 -10.9390 -10.9390 -10.5418 -10.5418 -8.4033 -8.4033 -7.6535 -7.6535 -6.5236 -6.5236 -6.1387 -6.1387 -5.7348 -5.7348 -5.6489 -5.6489 -5.5954 -5.5954 -5.4666 -5.4666 -5.1939 -5.1939 -5.1006 -5.1006 -5.0058 -5.0058 -4.9489 -4.9489 -4.5710 -4.5710 -3.3644 -3.3644 -2.4092 -2.4092 -2.0213 -2.0213 -1.6546 -1.6546 -1.3811 -1.3811 -1.2813 -1.2813 -1.0856 -1.0856 -0.7803 -0.7803 -0.6169 -0.6169 3.5825 3.5825 4.1509 4.1509 5.7957 5.7957 6.1899 6.1899 6.5678 6.5678 7.6949 7.6949 k = 0.0000-0.2248-0.1138 ( 7639 PWs) bands (ev): -22.6452 -22.6452 -22.3306 -22.3306 -19.9654 -19.9654 -19.6905 -19.6905 -14.0903 -14.0903 -13.9909 -13.9909 -12.6369 -12.6369 -12.4768 -12.4768 -10.9325 -10.9325 -10.5423 -10.5423 -8.4034 -8.4034 -7.6572 -7.6572 -6.5214 -6.5214 -6.1404 -6.1404 -5.7354 -5.7354 -5.6435 -5.6435 -5.5932 -5.5932 -5.4724 -5.4724 -5.1963 -5.1963 -5.1037 -5.1037 -5.0031 -5.0031 -4.9493 -4.9493 -4.5709 -4.5709 -3.3624 -3.3624 -2.4120 -2.4120 -2.0101 -2.0101 -1.6555 -1.6555 -1.3922 -1.3922 -1.2847 -1.2847 -1.0787 -1.0787 -0.7755 -0.7755 -0.6166 -0.6166 3.5890 3.5890 4.1404 4.1404 5.8135 5.8135 6.1388 6.1388 6.5476 6.5476 7.7479 7.7479 k = 0.0000-0.2108-0.1067 ( 7640 PWs) bands (ev): -22.6454 -22.6454 -22.3304 -22.3304 -19.9652 -19.9652 -19.6906 -19.6906 -14.0930 -14.0930 -13.9865 -13.9865 -12.6334 -12.6334 -12.4860 -12.4860 -10.9265 -10.9265 -10.5424 -10.5424 -8.4033 -8.4033 -7.6616 -7.6616 -6.5188 -6.5188 -6.1423 -6.1423 -5.7363 -5.7363 -5.6378 -5.6378 -5.5917 -5.5917 -5.4771 -5.4771 -5.1985 -5.1985 -5.1069 -5.1069 -5.0008 -5.0008 -4.9495 -4.9495 -4.5712 -4.5712 -3.3602 -3.3602 -2.4147 -2.4147 -1.9988 -1.9988 -1.6564 -1.6564 -1.4035 -1.4035 -1.2877 -1.2877 -1.0718 -1.0718 -0.7707 -0.7707 -0.6163 -0.6163 3.5950 3.5950 4.1304 4.1304 5.8323 5.8323 6.0901 6.0901 6.5268 6.5268 7.7792 7.7792 k = 0.0000-0.1967-0.0996 ( 7640 PWs) bands (ev): -22.6456 -22.6456 -22.3301 -22.3301 -19.9651 -19.9651 -19.6908 -19.6908 -14.0957 -14.0957 -13.9820 -13.9820 -12.6310 -12.6310 -12.4941 -12.4941 -10.9211 -10.9211 -10.5418 -10.5418 -8.4029 -8.4029 -7.6664 -7.6664 -6.5158 -6.5158 -6.1443 -6.1443 -5.7376 -5.7376 -5.6322 -5.6322 -5.5908 -5.5908 -5.4804 -5.4804 -5.2005 -5.2005 -5.1101 -5.1101 -4.9990 -4.9990 -4.9493 -4.9493 -4.5721 -4.5721 -3.3578 -3.3578 -2.4171 -2.4171 -1.9878 -1.9878 -1.6573 -1.6573 -1.4151 -1.4151 -1.2902 -1.2902 -1.0651 -1.0651 -0.7661 -0.7661 -0.6157 -0.6157 3.6001 3.6001 4.1210 4.1210 5.8518 5.8518 6.0442 6.0442 6.5055 6.5055 7.8022 7.8022 k = 0.0000-0.1827-0.0925 ( 7643 PWs) bands (ev): -22.6458 -22.6458 -22.3299 -22.3299 -19.9649 -19.9649 -19.6910 -19.6910 -14.0984 -14.0984 -13.9774 -13.9774 -12.6300 -12.6300 -12.5006 -12.5006 -10.9166 -10.9166 -10.5407 -10.5407 -8.4022 -8.4022 -7.6718 -7.6718 -6.5126 -6.5126 -6.1465 -6.1465 -5.7392 -5.7392 -5.6269 -5.6269 -5.5906 -5.5906 -5.4820 -5.4820 -5.2022 -5.2022 -5.1134 -5.1134 -4.9976 -4.9976 -4.9487 -4.9487 -4.5736 -4.5736 -3.3554 -3.3554 -2.4193 -2.4193 -1.9770 -1.9770 -1.6583 -1.6583 -1.4268 -1.4268 -1.2921 -1.2921 -1.0587 -1.0587 -0.7617 -0.7617 -0.6150 -0.6150 3.6043 3.6043 4.1126 4.1126 5.8717 5.8717 6.0012 6.0012 6.4838 6.4838 7.8234 7.8234 k = 0.0000-0.1686-0.0854 ( 7638 PWs) bands (ev): -22.6461 -22.6461 -22.3296 -22.3296 -19.9647 -19.9647 -19.6912 -19.6912 -14.1010 -14.1010 -13.9728 -13.9728 -12.6307 -12.6307 -12.5053 -12.5053 -10.9129 -10.9129 -10.5389 -10.5389 -8.4013 -8.4013 -7.6775 -7.6775 -6.5091 -6.5091 -6.1488 -6.1488 -5.7411 -5.7411 -5.6223 -5.6223 -5.5910 -5.5910 -5.4818 -5.4818 -5.2035 -5.2035 -5.1166 -5.1166 -4.9968 -4.9968 -4.9477 -4.9477 -4.5755 -4.5755 -3.3529 -3.3529 -2.4212 -2.4212 -1.9666 -1.9666 -1.6592 -1.6592 -1.4384 -1.4384 -1.2935 -1.2935 -1.0526 -1.0526 -0.7576 -0.7576 -0.6142 -0.6142 3.6074 3.6074 4.1054 4.1054 5.8915 5.8915 5.9619 5.9619 6.4619 6.4619 7.8441 7.8441 k = 0.0000-0.1546-0.0783 ( 7631 PWs) bands (ev): -22.6463 -22.6463 -22.3294 -22.3294 -19.9646 -19.9646 -19.6914 -19.6914 -14.1036 -14.1036 -13.9682 -13.9682 -12.6331 -12.6331 -12.5080 -12.5080 -10.9100 -10.9100 -10.5365 -10.5365 -8.4001 -8.4001 -7.6836 -7.6836 -6.5054 -6.5054 -6.1511 -6.1511 -5.7432 -5.7432 -5.6188 -5.6188 -5.5915 -5.5915 -5.4799 -5.4799 -5.2046 -5.2046 -5.1197 -5.1197 -4.9965 -4.9965 -4.9465 -4.9465 -4.5780 -4.5780 -3.3504 -3.3504 -2.4229 -2.4229 -1.9567 -1.9567 -1.6601 -1.6601 -1.4498 -1.4498 -1.2944 -1.2944 -1.0468 -1.0468 -0.7538 -0.7538 -0.6131 -0.6131 3.6094 3.6094 4.0994 4.0994 5.9058 5.9058 5.9313 5.9313 6.4400 6.4400 7.8645 7.8645 k = 0.0000-0.1405-0.0711 ( 7634 PWs) bands (ev): -22.6465 -22.6465 -22.3292 -22.3292 -19.9644 -19.9644 -19.6915 -19.6915 -14.1061 -14.1061 -13.9638 -13.9638 -12.6372 -12.6372 -12.5088 -12.5088 -10.9080 -10.9080 -10.5337 -10.5337 -8.3987 -8.3987 -7.6899 -7.6899 -6.5016 -6.5016 -6.1535 -6.1535 -5.7454 -5.7454 -5.6169 -5.6169 -5.5914 -5.5914 -5.4766 -5.4766 -5.2054 -5.2054 -5.1227 -5.1227 -4.9965 -4.9965 -4.9450 -4.9450 -4.5809 -4.5809 -3.3479 -3.3479 -2.4244 -2.4244 -1.9473 -1.9473 -1.6610 -1.6610 -1.4608 -1.4608 -1.2949 -1.2949 -1.0414 -1.0414 -0.7504 -0.7504 -0.6120 -0.6120 3.6101 3.6101 4.0947 4.0947 5.8853 5.8853 5.9386 5.9386 6.4183 6.4183 7.8842 7.8842 k = 0.0000-0.1265-0.0640 ( 7636 PWs) bands (ev): -22.6467 -22.6467 -22.3289 -22.3289 -19.9642 -19.9642 -19.6917 -19.6917 -14.1084 -14.1084 -13.9595 -13.9595 -12.6424 -12.6424 -12.5080 -12.5080 -10.9068 -10.9068 -10.5305 -10.5305 -8.3971 -8.3971 -7.6962 -7.6962 -6.4977 -6.4977 -6.1558 -6.1558 -5.7476 -5.7476 -5.6169 -5.6169 -5.5903 -5.5903 -5.4723 -5.4723 -5.2060 -5.2060 -5.1255 -5.1255 -4.9968 -4.9968 -4.9434 -4.9434 -4.5841 -4.5841 -3.3455 -3.3455 -2.4257 -2.4257 -1.9386 -1.9386 -1.6619 -1.6619 -1.4714 -1.4714 -1.2948 -1.2948 -1.0364 -1.0364 -0.7473 -0.7473 -0.6107 -0.6107 3.6098 3.6098 4.0914 4.0914 5.8557 5.8557 5.9580 5.9580 6.3970 6.3970 7.9027 7.9027 k = 0.0000-0.1124-0.0569 ( 7639 PWs) bands (ev): -22.6469 -22.6469 -22.3287 -22.3287 -19.9641 -19.9641 -19.6919 -19.6919 -14.1105 -14.1105 -13.9555 -13.9555 -12.6484 -12.6484 -12.5061 -12.5061 -10.9062 -10.9062 -10.5271 -10.5271 -8.3954 -8.3954 -7.7025 -7.7025 -6.4939 -6.4939 -6.1580 -6.1580 -5.7499 -5.7499 -5.6184 -5.6184 -5.5885 -5.5885 -5.4673 -5.4673 -5.2063 -5.2063 -5.1281 -5.1281 -4.9973 -4.9973 -4.9417 -4.9417 -4.5875 -4.5875 -3.3431 -3.3431 -2.4268 -2.4268 -1.9306 -1.9306 -1.6628 -1.6628 -1.4814 -1.4814 -1.2944 -1.2944 -1.0319 -1.0319 -0.7446 -0.7446 -0.6094 -0.6094 3.6085 3.6085 4.0892 4.0892 5.8284 5.8284 5.9778 5.9778 6.3764 6.3764 7.9193 7.9193 k = 0.0000-0.0984-0.0498 ( 7640 PWs) bands (ev): -22.6471 -22.6471 -22.3286 -22.3286 -19.9640 -19.9640 -19.6920 -19.6920 -14.1125 -14.1125 -13.9518 -13.9518 -12.6546 -12.6546 -12.5036 -12.5036 -10.9062 -10.9062 -10.5236 -10.5236 -8.3937 -8.3937 -7.7086 -7.7086 -6.4902 -6.4902 -6.1602 -6.1602 -5.7521 -5.7521 -5.6207 -5.6207 -5.5863 -5.5863 -5.4620 -5.4620 -5.2065 -5.2065 -5.1305 -5.1305 -4.9980 -4.9980 -4.9401 -4.9401 -4.5910 -4.5910 -3.3410 -3.3410 -2.4277 -2.4277 -1.9233 -1.9233 -1.6637 -1.6637 -1.4907 -1.4907 -1.2937 -1.2937 -1.0279 -1.0279 -0.7422 -0.7422 -0.6081 -0.6081 3.6065 3.6065 4.0881 4.0881 5.8041 5.8041 5.9972 5.9972 6.3565 6.3565 7.9329 7.9329 k = 0.0000-0.0843-0.0427 ( 7636 PWs) bands (ev): -22.6472 -22.6472 -22.3284 -22.3284 -19.9639 -19.9639 -19.6921 -19.6921 -14.1142 -14.1142 -13.9484 -13.9484 -12.6607 -12.6607 -12.5007 -12.5007 -10.9065 -10.9065 -10.5202 -10.5202 -8.3919 -8.3919 -7.7143 -7.7143 -6.4868 -6.4868 -6.1622 -6.1622 -5.7542 -5.7542 -5.6233 -5.6233 -5.5841 -5.5841 -5.4566 -5.4566 -5.2065 -5.2065 -5.1326 -5.1326 -4.9987 -4.9987 -4.9386 -4.9386 -4.5944 -4.5944 -3.3390 -3.3390 -2.4284 -2.4284 -1.9169 -1.9169 -1.6644 -1.6644 -1.4990 -1.4990 -1.2928 -1.2928 -1.0244 -1.0244 -0.7402 -0.7402 -0.6068 -0.6068 3.6041 3.6041 4.0877 4.0877 5.7830 5.7830 6.0157 6.0157 6.3378 6.3378 7.9426 7.9426 k = 0.0000-0.0703-0.0356 ( 7627 PWs) bands (ev): -22.6473 -22.6473 -22.3282 -22.3282 -19.9638 -19.9638 -19.6922 -19.6922 -14.1157 -14.1157 -13.9455 -13.9455 -12.6663 -12.6663 -12.4978 -12.4978 -10.9071 -10.9071 -10.5170 -10.5170 -8.3903 -8.3903 -7.7194 -7.7194 -6.4837 -6.4837 -6.1639 -6.1639 -5.7560 -5.7560 -5.6259 -5.6259 -5.5821 -5.5821 -5.4515 -5.4515 -5.2063 -5.2063 -5.1344 -5.1344 -4.9993 -4.9993 -4.9372 -4.9372 -4.5976 -4.5976 -3.3372 -3.3372 -2.4290 -2.4290 -1.9113 -1.9113 -1.6651 -1.6651 -1.5064 -1.5064 -1.2918 -1.2918 -1.0214 -1.0214 -0.7386 -0.7386 -0.6056 -0.6056 3.6014 3.6014 4.0879 4.0879 5.7652 5.7652 6.0329 6.0329 6.3206 6.3206 7.9479 7.9479 k = 0.0000-0.0562-0.0285 ( 7628 PWs) bands (ev): -22.6475 -22.6475 -22.3281 -22.3281 -19.9637 -19.9637 -19.6923 -19.6923 -14.1170 -14.1170 -13.9430 -13.9430 -12.6712 -12.6712 -12.4952 -12.4952 -10.9078 -10.9078 -10.5142 -10.5142 -8.3888 -8.3888 -7.7239 -7.7239 -6.4810 -6.4810 -6.1655 -6.1655 -5.7576 -5.7576 -5.6282 -5.6282 -5.5804 -5.5804 -5.4470 -5.4470 -5.2062 -5.2062 -5.1359 -5.1359 -4.9999 -4.9999 -4.9360 -4.9360 -4.6005 -4.6005 -3.3358 -3.3358 -2.4295 -2.4295 -1.9066 -1.9066 -1.6657 -1.6657 -1.5127 -1.5127 -1.2909 -1.2909 -1.0190 -1.0190 -0.7373 -0.7373 -0.6046 -0.6046 3.5989 3.5989 4.0884 4.0884 5.7505 5.7505 6.0484 6.0484 6.3051 6.3051 7.9496 7.9496 k = 0.0000-0.0422-0.0213 ( 7623 PWs) bands (ev): -22.6475 -22.6475 -22.3280 -22.3280 -19.9636 -19.9636 -19.6924 -19.6924 -14.1180 -14.1180 -13.9410 -13.9410 -12.6752 -12.6752 -12.4930 -12.4930 -10.9084 -10.9084 -10.5119 -10.5119 -8.3875 -8.3875 -7.7275 -7.7275 -6.4789 -6.4789 -6.1667 -6.1667 -5.7589 -5.7589 -5.6302 -5.6302 -5.5791 -5.5791 -5.4433 -5.4433 -5.2060 -5.2060 -5.1371 -5.1371 -5.0003 -5.0003 -4.9350 -4.9350 -4.6029 -4.6029 -3.3346 -3.3346 -2.4298 -2.4298 -1.9030 -1.9030 -1.6662 -1.6662 -1.5177 -1.5177 -1.2900 -1.2900 -1.0170 -1.0170 -0.7363 -0.7363 -0.6037 -0.6037 3.5966 3.5966 4.0890 4.0890 5.7392 5.7392 6.0616 6.0616 6.2919 6.2919 7.9492 7.9492 k = 0.0000-0.0281-0.0142 ( 7614 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9636 -19.9636 -19.6925 -19.6925 -14.1187 -14.1187 -13.9396 -13.9396 -12.6782 -12.6782 -12.4913 -12.4913 -10.9089 -10.9089 -10.5101 -10.5101 -8.3866 -8.3866 -7.7302 -7.7302 -6.4773 -6.4773 -6.1676 -6.1676 -5.7599 -5.7599 -5.6316 -5.6316 -5.5782 -5.5782 -5.4405 -5.4405 -5.2059 -5.2059 -5.1380 -5.1380 -5.0007 -5.0007 -4.9343 -4.9343 -4.6047 -4.6047 -3.3337 -3.3337 -2.4300 -2.4300 -1.9003 -1.9003 -1.6665 -1.6665 -1.5214 -1.5214 -1.2893 -1.2893 -1.0157 -1.0157 -0.7356 -0.7356 -0.6031 -0.6031 3.5949 3.5949 4.0896 4.0896 5.7311 5.7311 6.0719 6.0719 6.2816 6.2816 7.9480 7.9480 k = 0.0000-0.0141-0.0071 ( 7618 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1191 -14.1191 -13.9387 -13.9387 -12.6800 -12.6800 -12.4903 -12.4903 -10.9093 -10.9093 -10.5091 -10.5091 -8.3860 -8.3860 -7.7318 -7.7318 -6.4763 -6.4763 -6.1681 -6.1681 -5.7605 -5.7605 -5.6324 -5.6324 -5.5776 -5.5776 -5.4388 -5.4388 -5.2058 -5.2058 -5.1385 -5.1385 -5.0009 -5.0009 -4.9339 -4.9339 -4.6058 -4.6058 -3.3332 -3.3332 -2.4302 -2.4302 -1.8987 -1.8987 -1.6668 -1.6668 -1.5236 -1.5236 -1.2889 -1.2889 -1.0148 -1.0148 -0.7352 -0.7352 -0.6027 -0.6027 3.5938 3.5938 4.0900 4.0900 5.7262 5.7262 6.0785 6.0785 6.2751 6.2751 7.9470 7.9470 k = 0.0000 0.0000 0.0000 ( 7611 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1193 -14.1193 -13.9384 -13.9384 -12.6806 -12.6806 -12.4899 -12.4899 -10.9094 -10.9094 -10.5087 -10.5087 -8.3858 -8.3858 -7.7324 -7.7324 -6.4759 -6.4759 -6.1683 -6.1683 -5.7607 -5.7607 -5.6327 -5.6327 -5.5774 -5.5774 -5.4382 -5.4382 -5.2057 -5.2057 -5.1387 -5.1387 -5.0010 -5.0010 -4.9338 -4.9338 -4.6062 -4.6062 -3.3330 -3.3330 -2.4302 -2.4302 -1.8981 -1.8981 -1.6668 -1.6668 -1.5244 -1.5244 -1.2888 -1.2888 -1.0146 -1.0146 -0.7350 -0.7350 -0.6025 -0.6025 3.5934 3.5934 4.0902 4.0902 5.7246 5.7246 6.0808 6.0808 6.2728 6.2728 7.9467 7.9467 k = 0.0000 0.0000 0.0000 ( 7611 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1193 -14.1193 -13.9384 -13.9384 -12.6806 -12.6806 -12.4899 -12.4899 -10.9094 -10.9094 -10.5087 -10.5087 -8.3858 -8.3858 -7.7324 -7.7324 -6.4759 -6.4759 -6.1683 -6.1683 -5.7607 -5.7607 -5.6327 -5.6327 -5.5774 -5.5774 -5.4382 -5.4382 -5.2057 -5.2057 -5.1387 -5.1387 -5.0010 -5.0010 -4.9338 -4.9338 -4.6062 -4.6062 -3.3330 -3.3330 -2.4302 -2.4302 -1.8981 -1.8981 -1.6668 -1.6668 -1.5244 -1.5244 -1.2888 -1.2888 -1.0146 -1.0146 -0.7350 -0.7350 -0.6025 -0.6025 3.5934 3.5934 4.0902 4.0902 5.7246 5.7246 6.0808 6.0808 6.2728 6.2728 7.9467 7.9467 k = 0.0143 0.0045 0.0043 ( 7614 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9636 -19.9636 -19.6924 -19.6924 -14.1190 -14.1190 -13.9386 -13.9386 -12.6805 -12.6805 -12.4901 -12.4901 -10.9091 -10.9091 -10.5090 -10.5090 -8.3861 -8.3861 -7.7315 -7.7315 -6.4768 -6.4768 -6.1682 -6.1682 -5.7620 -5.7620 -5.6341 -5.6341 -5.5747 -5.5747 -5.4391 -5.4391 -5.2060 -5.2060 -5.1389 -5.1389 -5.0007 -5.0007 -4.9336 -4.9336 -4.6054 -4.6054 -3.3333 -3.3333 -2.4298 -2.4298 -1.8986 -1.8986 -1.6687 -1.6687 -1.5224 -1.5224 -1.2877 -1.2877 -1.0145 -1.0145 -0.7358 -0.7358 -0.6017 -0.6017 3.5939 3.5939 4.0895 4.0895 5.7259 5.7259 6.0759 6.0759 6.2776 6.2776 7.9466 7.9466 k = 0.0286 0.0089 0.0086 ( 7623 PWs) bands (ev): -22.6474 -22.6474 -22.3281 -22.3281 -19.9639 -19.9639 -19.6922 -19.6922 -14.1182 -14.1182 -13.9394 -13.9394 -12.6804 -12.6804 -12.4907 -12.4907 -10.9082 -10.9082 -10.5099 -10.5099 -8.3870 -8.3870 -7.7288 -7.7288 -6.4793 -6.4793 -6.1677 -6.1677 -5.7659 -5.7659 -5.6371 -5.6371 -5.5676 -5.5676 -5.4416 -5.4416 -5.2069 -5.2069 -5.1395 -5.1395 -4.9999 -4.9999 -4.9330 -4.9330 -4.6030 -4.6030 -3.3341 -3.3341 -2.4285 -2.4285 -1.9001 -1.9001 -1.6741 -1.6741 -1.5169 -1.5169 -1.2845 -1.2845 -1.0144 -1.0144 -0.7381 -0.7381 -0.5995 -0.5995 3.5953 3.5953 4.0875 4.0875 5.7301 5.7301 6.0626 6.0626 6.2907 6.2907 7.9462 7.9462 k = 0.0429 0.0134 0.0129 ( 7622 PWs) bands (ev): -22.6471 -22.6471 -22.3283 -22.3283 -19.9644 -19.9644 -19.6917 -19.6917 -14.1169 -14.1169 -13.9405 -13.9405 -12.6802 -12.6802 -12.4916 -12.4916 -10.9067 -10.9067 -10.5113 -10.5113 -8.3884 -8.3884 -7.7246 -7.7246 -6.4833 -6.4833 -6.1670 -6.1670 -5.7725 -5.7725 -5.6400 -5.6400 -5.5580 -5.5580 -5.4455 -5.4455 -5.2084 -5.2084 -5.1404 -5.1404 -4.9985 -4.9985 -4.9321 -4.9321 -4.5991 -4.5991 -3.3355 -3.3355 -2.4263 -2.4263 -1.9025 -1.9025 -1.6821 -1.6821 -1.5086 -1.5086 -1.2793 -1.2793 -1.0141 -1.0141 -0.7416 -0.7416 -0.5960 -0.5960 3.5977 3.5977 4.0841 4.0841 5.7370 5.7370 6.0435 6.0435 6.3095 6.3095 7.9456 7.9456 k = 0.0571 0.0179 0.0172 ( 7625 PWs) bands (ev): -22.6467 -22.6467 -22.3286 -22.3286 -19.9650 -19.9650 -19.6912 -19.6912 -14.1152 -14.1152 -13.9421 -13.9421 -12.6802 -12.6802 -12.4926 -12.4926 -10.9049 -10.9049 -10.5131 -10.5131 -8.3903 -8.3903 -7.7189 -7.7189 -6.4886 -6.4886 -6.1661 -6.1661 -5.7815 -5.7815 -5.6417 -5.6417 -5.5474 -5.5474 -5.4507 -5.4507 -5.2103 -5.2103 -5.1415 -5.1415 -4.9967 -4.9967 -4.9308 -4.9308 -4.5941 -4.5941 -3.3373 -3.3373 -2.4233 -2.4233 -1.9058 -1.9058 -1.6919 -1.6919 -1.4983 -1.4983 -1.2724 -1.2724 -1.0138 -1.0138 -0.7462 -0.7462 -0.5915 -0.5915 3.6010 3.6010 4.0796 4.0796 5.7466 5.7466 6.0212 6.0212 6.3316 6.3316 7.9443 7.9443 k = 0.0714 0.0224 0.0215 ( 7623 PWs) bands (ev): -22.6461 -22.6461 -22.3290 -22.3290 -19.9658 -19.9658 -19.6904 -19.6904 -14.1129 -14.1129 -13.9440 -13.9440 -12.6806 -12.6806 -12.4935 -12.4935 -10.9029 -10.9029 -10.5151 -10.5151 -8.3924 -8.3924 -7.7120 -7.7120 -6.4951 -6.4951 -6.1650 -6.1650 -5.7928 -5.7928 -5.6418 -5.6418 -5.5369 -5.5369 -5.4567 -5.4567 -5.2126 -5.2126 -5.1427 -5.1427 -4.9944 -4.9944 -4.9292 -4.9292 -4.5880 -4.5880 -3.3396 -3.3396 -2.4195 -2.4195 -1.9100 -1.9100 -1.7024 -1.7024 -1.4866 -1.4866 -1.2638 -1.2638 -1.0133 -1.0133 -0.7516 -0.7516 -0.5863 -0.5863 3.6051 3.6051 4.0739 4.0739 5.7588 5.7588 5.9974 5.9974 6.3555 6.3555 7.9423 7.9423 k = 0.0857 0.0268 0.0258 ( 7624 PWs) bands (ev): -22.6454 -22.6454 -22.3295 -22.3295 -19.9668 -19.9668 -19.6896 -19.6896 -14.1103 -14.1103 -13.9462 -13.9462 -12.6815 -12.6815 -12.4940 -12.4940 -10.9009 -10.9009 -10.5172 -10.5172 -8.3947 -8.3947 -7.7043 -7.7043 -6.5024 -6.5024 -6.1638 -6.1638 -5.8058 -5.8058 -5.6405 -5.6405 -5.5271 -5.5271 -5.4630 -5.4630 -5.2152 -5.2152 -5.1440 -5.1440 -4.9917 -4.9917 -4.9274 -4.9274 -4.5812 -4.5812 -3.3424 -3.3424 -2.4149 -2.4149 -1.9150 -1.9150 -1.7133 -1.7133 -1.4742 -1.4742 -1.2538 -1.2538 -1.0127 -1.0127 -0.7574 -0.7574 -0.5807 -0.5807 3.6099 3.6099 4.0671 4.0671 5.7735 5.7735 5.9732 5.9732 6.3801 6.3801 7.9392 7.9392 k = 0.1000 0.0313 0.0301 ( 7633 PWs) bands (ev): -22.6447 -22.6447 -22.3301 -22.3301 -19.9680 -19.9680 -19.6886 -19.6886 -14.1074 -14.1074 -13.9487 -13.9487 -12.6832 -12.6832 -12.4939 -12.4939 -10.8992 -10.8992 -10.5191 -10.5191 -8.3969 -8.3969 -7.6960 -7.6960 -6.5103 -6.5103 -6.1626 -6.1626 -5.8202 -5.8202 -5.6381 -5.6381 -5.5187 -5.5187 -5.4688 -5.4688 -5.2181 -5.2181 -5.1450 -5.1450 -4.9887 -4.9887 -4.9254 -4.9254 -4.5739 -4.5739 -3.3456 -3.3456 -2.4095 -2.4095 -1.9207 -1.9207 -1.7240 -1.7240 -1.4612 -1.4612 -1.2428 -1.2428 -1.0119 -1.0119 -0.7636 -0.7636 -0.5750 -0.5750 3.6153 3.6153 4.0594 4.0594 5.7903 5.7903 5.9497 5.9497 6.4048 6.4048 7.9346 7.9346 k = 0.1143 0.0358 0.0344 ( 7632 PWs) bands (ev): -22.6438 -22.6438 -22.3308 -22.3308 -19.9692 -19.9692 -19.6874 -19.6874 -14.1042 -14.1042 -13.9512 -13.9512 -12.6858 -12.6858 -12.4929 -12.4929 -10.8980 -10.8980 -10.5207 -10.5207 -8.3990 -8.3990 -7.6875 -7.6875 -6.5185 -6.5185 -6.1614 -6.1614 -5.8355 -5.8355 -5.6352 -5.6352 -5.5126 -5.5126 -5.4733 -5.4733 -5.2211 -5.2211 -5.1457 -5.1457 -4.9854 -4.9854 -4.9232 -4.9232 -4.5666 -4.5666 -3.3492 -3.3492 -2.4033 -2.4033 -1.9269 -1.9269 -1.7342 -1.7342 -1.4481 -1.4481 -1.2309 -1.2309 -1.0108 -1.0108 -0.7698 -0.7698 -0.5693 -0.5693 3.6212 3.6212 4.0510 4.0510 5.8086 5.8086 5.9280 5.9280 6.4292 6.4292 7.9283 7.9283 k = 0.1286 0.0403 0.0387 ( 7636 PWs) bands (ev): -22.6428 -22.6428 -22.3315 -22.3315 -19.9706 -19.9706 -19.6862 -19.6862 -14.1009 -14.1009 -13.9538 -13.9538 -12.6895 -12.6895 -12.4910 -12.4910 -10.8975 -10.8975 -10.5218 -10.5218 -8.4008 -8.4008 -7.6791 -7.6791 -6.5266 -6.5266 -6.1602 -6.1602 -5.8515 -5.8515 -5.6324 -5.6324 -5.5091 -5.5091 -5.4757 -5.4757 -5.2241 -5.2241 -5.1457 -5.1457 -4.9819 -4.9819 -4.9208 -4.9208 -4.5595 -4.5595 -3.3531 -3.3531 -2.3964 -2.3964 -1.9336 -1.9336 -1.7437 -1.7437 -1.4349 -1.4349 -1.2182 -1.2182 -1.0095 -1.0095 -0.7760 -0.7760 -0.5639 -0.5639 3.6275 3.6275 4.0419 4.0419 5.8263 5.8263 5.9107 5.9107 6.4530 6.4530 7.9203 7.9203 k = 0.1429 0.0447 0.0430 ( 7639 PWs) bands (ev): -22.6417 -22.6417 -22.3323 -22.3323 -19.9722 -19.9722 -19.6849 -19.6849 -14.0975 -14.0975 -13.9564 -13.9564 -12.6941 -12.6941 -12.4881 -12.4881 -10.8980 -10.8980 -10.5222 -10.5222 -8.4021 -8.4021 -7.6712 -7.6712 -6.5343 -6.5343 -6.1591 -6.1591 -5.8677 -5.8677 -5.6306 -5.6306 -5.5079 -5.5079 -5.4758 -5.4758 -5.2272 -5.2272 -5.1450 -5.1450 -4.9783 -4.9783 -4.9184 -4.9184 -4.5528 -4.5528 -3.3572 -3.3572 -2.3888 -2.3888 -1.9405 -1.9405 -1.7524 -1.7524 -1.4219 -1.4219 -1.2051 -1.2051 -1.0079 -1.0079 -0.7820 -0.7820 -0.5590 -0.5590 3.6340 3.6340 4.0323 4.0323 5.8376 5.8376 5.9039 5.9039 6.4758 6.4758 7.9107 7.9107 k = 0.1571 0.0492 0.0472 ( 7639 PWs) bands (ev): -22.6405 -22.6405 -22.3332 -22.3332 -19.9738 -19.9738 -19.6835 -19.6835 -14.0941 -14.0941 -13.9587 -13.9587 -12.6997 -12.6997 -12.4843 -12.4843 -10.8994 -10.8994 -10.5218 -10.5218 -8.4030 -8.4030 -7.6640 -7.6640 -6.5414 -6.5414 -6.1579 -6.1579 -5.8842 -5.8842 -5.6302 -5.6302 -5.5074 -5.5074 -5.4750 -5.4750 -5.2304 -5.2304 -5.1433 -5.1433 -4.9746 -4.9746 -4.9160 -4.9160 -4.5468 -4.5468 -3.3616 -3.3616 -2.3806 -2.3806 -1.9474 -1.9474 -1.7602 -1.7602 -1.4093 -1.4093 -1.1916 -1.1916 -1.0060 -1.0060 -0.7877 -0.7877 -0.5546 -0.5546 3.6406 3.6406 4.0225 4.0225 5.8353 5.8353 5.9152 5.9152 6.4974 6.4974 7.8995 7.8995 k = 0.1714 0.0537 0.0515 ( 7636 PWs) bands (ev): -22.6393 -22.6393 -22.3341 -22.3341 -19.9755 -19.9755 -19.6820 -19.6820 -14.0908 -14.0908 -13.9607 -13.9607 -12.7060 -12.7060 -12.4799 -12.4799 -10.9018 -10.9018 -10.5206 -10.5206 -8.4033 -8.4033 -7.6579 -7.6579 -6.5477 -6.5477 -6.1568 -6.1568 -5.9006 -5.9006 -5.6316 -5.6316 -5.5062 -5.5062 -5.4740 -5.4740 -5.2337 -5.2337 -5.1404 -5.1404 -4.9710 -4.9710 -4.9135 -4.9135 -4.5417 -4.5417 -3.3661 -3.3661 -2.3717 -2.3717 -1.9543 -1.9543 -1.7669 -1.7669 -1.3973 -1.3973 -1.1778 -1.1778 -1.0038 -1.0038 -0.7931 -0.7931 -0.5510 -0.5510 3.6471 3.6471 4.0125 4.0125 5.8245 5.8245 5.9394 5.9394 6.5177 6.5177 7.8871 7.8871 k = 0.1857 0.0582 0.0558 ( 7635 PWs) bands (ev): -22.6379 -22.6379 -22.3351 -22.3351 -19.9772 -19.9772 -19.6804 -19.6804 -14.0879 -14.0879 -13.9623 -13.9623 -12.7127 -12.7127 -12.4750 -12.4750 -10.9052 -10.9052 -10.5187 -10.5187 -8.4030 -8.4030 -7.6529 -7.6529 -6.5528 -6.5528 -6.1557 -6.1557 -5.9168 -5.9168 -5.6349 -5.6349 -5.5043 -5.5043 -5.4733 -5.4733 -5.2370 -5.2370 -5.1363 -5.1363 -4.9674 -4.9674 -4.9110 -4.9110 -4.5377 -4.5377 -3.3707 -3.3707 -2.3623 -2.3623 -1.9610 -1.9610 -1.7727 -1.7727 -1.3861 -1.3861 -1.1639 -1.1639 -1.0011 -1.0011 -0.7980 -0.7980 -0.5483 -0.5483 3.6535 3.6535 4.0025 4.0025 5.8122 5.8122 5.9699 5.9699 6.5362 6.5362 7.8737 7.8737 k = 0.2000 0.0626 0.0601 ( 7633 PWs) bands (ev): -22.6365 -22.6365 -22.3362 -22.3362 -19.9790 -19.9790 -19.6789 -19.6789 -14.0853 -14.0853 -13.9635 -13.9635 -12.7197 -12.7197 -12.4699 -12.4699 -10.9094 -10.9094 -10.5161 -10.5161 -8.4021 -8.4021 -7.6492 -7.6492 -6.5568 -6.5568 -6.1545 -6.1545 -5.9328 -5.9328 -5.6397 -5.6397 -5.5023 -5.5023 -5.4721 -5.4721 -5.2406 -5.2406 -5.1311 -5.1311 -4.9640 -4.9640 -4.9086 -4.9086 -4.5347 -4.5347 -3.3754 -3.3754 -2.3524 -2.3524 -1.9673 -1.9673 -1.7774 -1.7774 -1.3759 -1.3759 -1.1499 -1.1499 -0.9980 -0.9980 -0.8025 -0.8025 -0.5466 -0.5466 3.6597 3.6597 3.9927 3.9927 5.8010 5.8010 6.0043 6.0043 6.5529 6.5529 7.8597 7.8597 k = 0.2143 0.0671 0.0644 ( 7634 PWs) bands (ev): -22.6351 -22.6351 -22.3372 -22.3372 -19.9809 -19.9809 -19.6772 -19.6772 -14.0832 -14.0832 -13.9640 -13.9640 -12.7266 -12.7266 -12.4649 -12.4649 -10.9142 -10.9142 -10.5130 -10.5130 -8.4006 -8.4006 -7.6469 -7.6469 -6.5593 -6.5593 -6.1533 -6.1533 -5.9484 -5.9484 -5.6457 -5.6457 -5.5018 -5.5018 -5.4695 -5.4695 -5.2443 -5.2443 -5.1246 -5.1246 -4.9608 -4.9608 -4.9062 -4.9062 -4.5330 -4.5330 -3.3801 -3.3801 -2.3419 -2.3419 -1.9732 -1.9732 -1.7811 -1.7811 -1.3669 -1.3669 -1.1358 -1.1358 -0.9945 -0.9945 -0.8065 -0.8065 -0.5459 -0.5459 3.6656 3.6656 3.9830 3.9830 5.7921 5.7921 6.0414 6.0414 6.5675 6.5675 7.8452 7.8452 k = 0.2286 0.0716 0.0687 ( 7631 PWs) bands (ev): -22.6336 -22.6336 -22.3384 -22.3384 -19.9827 -19.9827 -19.6756 -19.6756 -14.0815 -14.0815 -13.9640 -13.9640 -12.7331 -12.7331 -12.4603 -12.4603 -10.9193 -10.9193 -10.5096 -10.5096 -8.3986 -8.3986 -7.6460 -7.6460 -6.5605 -6.5605 -6.1519 -6.1519 -5.9635 -5.9635 -5.6524 -5.6524 -5.5039 -5.5039 -5.4645 -5.4645 -5.2481 -5.2481 -5.1171 -5.1171 -4.9578 -4.9578 -4.9039 -4.9039 -4.5324 -4.5324 -3.3847 -3.3847 -2.3310 -2.3310 -1.9786 -1.9786 -1.7835 -1.7835 -1.3592 -1.3592 -1.1219 -1.1219 -0.9905 -0.9905 -0.8098 -0.8098 -0.5464 -0.5464 3.6711 3.6711 3.9736 3.9736 5.7858 5.7858 6.0811 6.0811 6.5798 6.5798 7.8305 7.8305 k = 0.2429 0.0761 0.0730 ( 7634 PWs) bands (ev): -22.6321 -22.6321 -22.3395 -22.3395 -19.9846 -19.9846 -19.6740 -19.6740 -14.0805 -14.0805 -13.9635 -13.9635 -12.7390 -12.7390 -12.4565 -12.4565 -10.9245 -10.9245 -10.5062 -10.5062 -8.3961 -8.3961 -7.6464 -7.6464 -6.5603 -6.5603 -6.1504 -6.1504 -5.9782 -5.9782 -5.6594 -5.6594 -5.5084 -5.5084 -5.4578 -5.4578 -5.2522 -5.2522 -5.1088 -5.1088 -4.9551 -4.9551 -4.9017 -4.9017 -4.5330 -4.5330 -3.3893 -3.3893 -2.3197 -2.3197 -1.9837 -1.9837 -1.7846 -1.7846 -1.3531 -1.3531 -1.1080 -1.1080 -0.9860 -0.9860 -0.8126 -0.8126 -0.5480 -0.5480 3.6762 3.6762 3.9645 3.9645 5.7824 5.7824 6.1230 6.1230 6.5895 6.5895 7.8157 7.8157 k = 0.2571 0.0805 0.0773 ( 7632 PWs) bands (ev): -22.6306 -22.6306 -22.3407 -22.3407 -19.9865 -19.9865 -19.6724 -19.6724 -14.0799 -14.0799 -13.9623 -13.9623 -12.7441 -12.7441 -12.4535 -12.4535 -10.9294 -10.9294 -10.5028 -10.5028 -8.3933 -8.3933 -7.6480 -7.6480 -6.5587 -6.5587 -6.1487 -6.1487 -5.9923 -5.9923 -5.6662 -5.6662 -5.5147 -5.5147 -5.4502 -5.4502 -5.2564 -5.2564 -5.0997 -5.0997 -4.9526 -4.9526 -4.8997 -4.8997 -4.5346 -4.5346 -3.3939 -3.3939 -2.3080 -2.3080 -1.9884 -1.9884 -1.7844 -1.7844 -1.3486 -1.3486 -1.0944 -1.0944 -0.9811 -0.9811 -0.8147 -0.8147 -0.5508 -0.5508 3.6810 3.6810 3.9558 3.9558 5.7821 5.7821 6.1669 6.1669 6.5965 6.5965 7.8009 7.8009 k = 0.2714 0.0850 0.0816 ( 7633 PWs) bands (ev): -22.6291 -22.6291 -22.3418 -22.3418 -19.9883 -19.9883 -19.6708 -19.6708 -14.0798 -14.0798 -13.9608 -13.9608 -12.7482 -12.7482 -12.4518 -12.4518 -10.9339 -10.9339 -10.4997 -10.4997 -8.3902 -8.3902 -7.6507 -7.6507 -6.5560 -6.5560 -6.1468 -6.1468 -6.0057 -6.0057 -5.6728 -5.6728 -5.5222 -5.5222 -5.4423 -5.4423 -5.2606 -5.2606 -5.0901 -5.0901 -4.9505 -4.9505 -4.8977 -4.8977 -4.5371 -4.5371 -3.3982 -3.3982 -2.2960 -2.2960 -1.9928 -1.9928 -1.7828 -1.7828 -1.3457 -1.3457 -1.0812 -1.0812 -0.9756 -0.9756 -0.8161 -0.8161 -0.5548 -0.5548 3.6855 3.6855 3.9473 3.9473 5.7851 5.7851 6.2126 6.2126 6.6007 6.6007 7.7862 7.7862 k = 0.2857 0.0895 0.0859 ( 7629 PWs) bands (ev): -22.6275 -22.6275 -22.3430 -22.3430 -19.9901 -19.9901 -19.6692 -19.6692 -14.0801 -14.0801 -13.9588 -13.9588 -12.7511 -12.7511 -12.4514 -12.4514 -10.9377 -10.9377 -10.4971 -10.4971 -8.3869 -8.3869 -7.6543 -7.6543 -6.5521 -6.5521 -6.1447 -6.1447 -6.0185 -6.0185 -5.6788 -5.6788 -5.5307 -5.5307 -5.4348 -5.4348 -5.2649 -5.2649 -5.0801 -5.0801 -4.9486 -4.9486 -4.8960 -4.8960 -4.5405 -4.5405 -3.4025 -3.4025 -2.2837 -2.2837 -1.9971 -1.9971 -1.7795 -1.7795 -1.3447 -1.3447 -1.0685 -1.0685 -0.9698 -0.9698 -0.8168 -0.8168 -0.5599 -0.5599 3.6898 3.6898 3.9391 3.9391 5.7912 5.7912 6.2600 6.2600 6.6018 6.6018 7.7715 7.7715 k = 0.3000 0.0939 0.0902 ( 7626 PWs) bands (ev): -22.6260 -22.6260 -22.3441 -22.3441 -19.9918 -19.9918 -19.6677 -19.6677 -14.0807 -14.0807 -13.9567 -13.9567 -12.7527 -12.7527 -12.4525 -12.4525 -10.9406 -10.9406 -10.4951 -10.4951 -8.3835 -8.3835 -7.6584 -7.6584 -6.5474 -6.5474 -6.1423 -6.1423 -6.0306 -6.0306 -5.6841 -5.6841 -5.5396 -5.5396 -5.4281 -5.4281 -5.2692 -5.2692 -5.0697 -5.0697 -4.9471 -4.9471 -4.8944 -4.8944 -4.5444 -4.5444 -3.4067 -3.4067 -2.2712 -2.2712 -2.0013 -2.0013 -1.7747 -1.7747 -1.3455 -1.3455 -1.0564 -1.0564 -0.9636 -0.9636 -0.8167 -0.8167 -0.5662 -0.5662 3.6941 3.6941 3.9310 3.9310 5.8007 5.8007 6.3089 6.3089 6.5999 6.5999 7.7567 7.7567 k = 0.3143 0.0984 0.0945 ( 7624 PWs) bands (ev): -22.6245 -22.6245 -22.3453 -22.3453 -19.9935 -19.9935 -19.6663 -19.6663 -14.0815 -14.0815 -13.9544 -13.9544 -12.7528 -12.7528 -12.4553 -12.4553 -10.9425 -10.9425 -10.4937 -10.4937 -8.3801 -8.3801 -7.6630 -7.6630 -6.5419 -6.5419 -6.1398 -6.1398 -6.0418 -6.0418 -5.6886 -5.6886 -5.5490 -5.5490 -5.4224 -5.4224 -5.2734 -5.2734 -5.0592 -5.0592 -4.9459 -4.9459 -4.8930 -4.8930 -4.5488 -4.5488 -3.4106 -3.4106 -2.2585 -2.2585 -2.0057 -2.0057 -1.7681 -1.7681 -1.3482 -1.3482 -1.0451 -1.0451 -0.9571 -0.9571 -0.8157 -0.8157 -0.5734 -0.5734 3.6983 3.6983 3.9229 3.9229 5.8132 5.8132 6.3590 6.3590 6.5949 6.5949 7.7415 7.7415 k = 0.3286 0.1029 0.0988 ( 7623 PWs) bands (ev): -22.6231 -22.6231 -22.3464 -22.3464 -19.9951 -19.9951 -19.6649 -19.6649 -14.0825 -14.0825 -13.9522 -13.9522 -12.7514 -12.7514 -12.4597 -12.4597 -10.9433 -10.9433 -10.4931 -10.4931 -8.3769 -8.3769 -7.6678 -7.6678 -6.5359 -6.5359 -6.1370 -6.1370 -6.0523 -6.0523 -5.6922 -5.6922 -5.5585 -5.5585 -5.4181 -5.4181 -5.2774 -5.2774 -5.0487 -5.0487 -4.9450 -4.9450 -4.8918 -4.8918 -4.5534 -4.5534 -3.4144 -3.4144 -2.2456 -2.2456 -2.0102 -2.0102 -1.7598 -1.7598 -1.3527 -1.3527 -1.0345 -1.0345 -0.9505 -0.9505 -0.8139 -0.8139 -0.5817 -0.5817 3.7028 3.7028 3.9148 3.9148 5.8289 5.8289 6.4098 6.4098 6.5872 6.5872 7.7257 7.7257 k = 0.3429 0.1074 0.1031 ( 7622 PWs) bands (ev): -22.6217 -22.6217 -22.3474 -22.3474 -19.9966 -19.9966 -19.6636 -19.6636 -14.0835 -14.0835 -13.9500 -13.9500 -12.7484 -12.7484 -12.4659 -12.4659 -10.9430 -10.9430 -10.4932 -10.4932 -8.3738 -8.3738 -7.6726 -7.6726 -6.5296 -6.5296 -6.1342 -6.1342 -6.0620 -6.0620 -5.6949 -5.6949 -5.5680 -5.5680 -5.4152 -5.4152 -5.2811 -5.2811 -5.0381 -5.0381 -4.9444 -4.9444 -4.8908 -4.8908 -4.5581 -4.5581 -3.4181 -3.4181 -2.2326 -2.2326 -2.0150 -2.0150 -1.7499 -1.7499 -1.3590 -1.3590 -1.0249 -1.0249 -0.9438 -0.9438 -0.8111 -0.8111 -0.5907 -0.5907 3.7075 3.7075 3.9066 3.9066 5.8475 5.8475 6.4605 6.4605 6.5774 6.5774 7.7086 7.7086 k = 0.3571 0.1118 0.1074 ( 7618 PWs) bands (ev): -22.6204 -22.6204 -22.3484 -22.3484 -19.9980 -19.9980 -19.6624 -19.6624 -14.0846 -14.0846 -13.9479 -13.9479 -12.7437 -12.7437 -12.4737 -12.4737 -10.9417 -10.9417 -10.4941 -10.4941 -8.3711 -8.3711 -7.6772 -7.6772 -6.5231 -6.5231 -6.1312 -6.1312 -6.0708 -6.0708 -5.6966 -5.6966 -5.5774 -5.5774 -5.4139 -5.4139 -5.2844 -5.2844 -5.0278 -5.0278 -4.9441 -4.9441 -4.8901 -4.8901 -4.5627 -4.5627 -3.4215 -3.4215 -2.2197 -2.2197 -2.0202 -2.0202 -1.7382 -1.7382 -1.3671 -1.3671 -1.0161 -1.0161 -0.9372 -0.9372 -0.8073 -0.8073 -0.6005 -0.6005 3.7126 3.7126 3.8981 3.8981 5.8688 5.8688 6.5065 6.5065 6.5699 6.5699 7.6896 7.6896 k = 0.3714 0.1163 0.1117 ( 7619 PWs) bands (ev): -22.6192 -22.6192 -22.3494 -22.3494 -19.9993 -19.9993 -19.6613 -19.6613 -14.0857 -14.0857 -13.9460 -13.9460 -12.7375 -12.7375 -12.4831 -12.4831 -10.9394 -10.9394 -10.4956 -10.4956 -8.3686 -8.3686 -7.6816 -7.6816 -6.5167 -6.5167 -6.1283 -6.1283 -6.0786 -6.0786 -5.6973 -5.6973 -5.5866 -5.5866 -5.4141 -5.4141 -5.2872 -5.2872 -5.0177 -5.0177 -4.9440 -4.9440 -4.8896 -4.8896 -4.5671 -4.5671 -3.4247 -3.4247 -2.2067 -2.2067 -2.0258 -2.0258 -1.7250 -1.7250 -1.3769 -1.3769 -1.0083 -1.0083 -0.9308 -0.9308 -0.8027 -0.8027 -0.6110 -0.6110 3.7183 3.7183 3.8893 3.8893 5.8927 5.8927 6.5244 6.5244 6.5879 6.5879 7.6683 7.6683 k = 0.3857 0.1208 0.1160 ( 7628 PWs) bands (ev): -22.6180 -22.6180 -22.3502 -22.3502 -20.0005 -20.0005 -19.6603 -19.6603 -14.0867 -14.0867 -13.9444 -13.9444 -12.7298 -12.7298 -12.4941 -12.4941 -10.9363 -10.9363 -10.4977 -10.4977 -8.3665 -8.3665 -7.6855 -7.6855 -6.5105 -6.5105 -6.1256 -6.1256 -6.0854 -6.0854 -5.6969 -5.6969 -5.5955 -5.5955 -5.4159 -5.4159 -5.2896 -5.2896 -5.0079 -5.0079 -4.9441 -4.9441 -4.8894 -4.8894 -4.5711 -4.5711 -3.4277 -3.4277 -2.1939 -2.1939 -2.0318 -2.0318 -1.7104 -1.7104 -1.3883 -1.3883 -1.0015 -1.0015 -0.9249 -0.9249 -0.7970 -0.7970 -0.6219 -0.6219 3.7245 3.7245 3.8801 3.8801 5.9187 5.9187 6.5114 6.5114 6.6342 6.6342 7.6439 7.6439 k = 0.4000 0.1253 0.1203 ( 7637 PWs) bands (ev): -22.6170 -22.6170 -22.3510 -22.3510 -20.0015 -20.0015 -19.6594 -19.6594 -14.0875 -14.0875 -13.9429 -13.9429 -12.7205 -12.7205 -12.5064 -12.5064 -10.9327 -10.9327 -10.5003 -10.5003 -8.3648 -8.3648 -7.6890 -7.6890 -6.5047 -6.5047 -6.1232 -6.1232 -6.0912 -6.0912 -5.6956 -5.6956 -5.6040 -5.6040 -5.4189 -5.4189 -5.2914 -5.2914 -4.9986 -4.9986 -4.9444 -4.9444 -4.8894 -4.8894 -4.5748 -4.5748 -3.4304 -3.4304 -2.1812 -2.1812 -2.0383 -2.0383 -1.6946 -1.6946 -1.4012 -1.4012 -0.9955 -0.9955 -0.9195 -0.9195 -0.7905 -0.7905 -0.6331 -0.6331 3.7313 3.7313 3.8706 3.8706 5.9465 5.9465 6.4905 6.4905 6.6856 6.6856 7.6163 7.6163 k = 0.4143 0.1297 0.1246 ( 7637 PWs) bands (ev): -22.6161 -22.6161 -22.3518 -22.3518 -20.0025 -20.0025 -19.6586 -19.6586 -14.0883 -14.0883 -13.9417 -13.9417 -12.7100 -12.7100 -12.5198 -12.5198 -10.9287 -10.9287 -10.5031 -10.5031 -8.3634 -8.3634 -7.6920 -7.6920 -6.4994 -6.4994 -6.1213 -6.1213 -6.0957 -6.0957 -5.6933 -5.6933 -5.6122 -5.6122 -5.4229 -5.4229 -5.2928 -5.2928 -4.9899 -4.9899 -4.9449 -4.9449 -4.8896 -4.8896 -4.5781 -4.5781 -3.4329 -3.4329 -2.1688 -2.1688 -2.0452 -2.0452 -1.6779 -1.6779 -1.4153 -1.4153 -0.9903 -0.9903 -0.9147 -0.9147 -0.7832 -0.7832 -0.6446 -0.6446 3.7388 3.7388 3.8607 3.8607 5.9756 5.9756 6.4664 6.4664 6.7372 6.7372 7.5857 7.5857 k = 0.4286 0.1342 0.1289 ( 7642 PWs) bands (ev): -22.6153 -22.6153 -22.3524 -22.3524 -20.0033 -20.0033 -19.6579 -19.6579 -14.0890 -14.0890 -13.9408 -13.9408 -12.6982 -12.6982 -12.5341 -12.5341 -10.9247 -10.9247 -10.5059 -10.5059 -8.3623 -8.3623 -7.6945 -7.6945 -6.4948 -6.4948 -6.1202 -6.1202 -6.0989 -6.0989 -5.6903 -5.6903 -5.6199 -5.6199 -5.4273 -5.4273 -5.2938 -5.2938 -4.9819 -4.9819 -4.9456 -4.9456 -4.8900 -4.8900 -4.5808 -4.5808 -3.4350 -3.4350 -2.1567 -2.1567 -2.0526 -2.0526 -1.6605 -1.6605 -1.4303 -1.4303 -0.9861 -0.9861 -0.9106 -0.9106 -0.7751 -0.7751 -0.6562 -0.6562 3.7470 3.7470 3.8505 3.8505 6.0053 6.0053 6.4406 6.4406 6.7871 6.7871 7.5530 7.5530 k = 0.4429 0.1387 0.1332 ( 7647 PWs) bands (ev): -22.6147 -22.6147 -22.3529 -22.3529 -20.0039 -20.0039 -19.6573 -19.6573 -14.0895 -14.0895 -13.9400 -13.9400 -12.6854 -12.6854 -12.5491 -12.5491 -10.9208 -10.9208 -10.5087 -10.5087 -8.3614 -8.3614 -7.6964 -7.6964 -6.4908 -6.4908 -6.1199 -6.1199 -6.1007 -6.1007 -5.6866 -5.6866 -5.6271 -5.6271 -5.4318 -5.4318 -5.2944 -5.2944 -4.9748 -4.9748 -4.9466 -4.9466 -4.8906 -4.8906 -4.5831 -4.5831 -3.4367 -3.4367 -2.1450 -2.1450 -2.0604 -2.0604 -1.6431 -1.6431 -1.4458 -1.4458 -0.9826 -0.9826 -0.9072 -0.9072 -0.7665 -0.7665 -0.6676 -0.6676 3.7557 3.7557 3.8400 3.8400 6.0348 6.0348 6.4142 6.4142 6.8338 6.8338 7.5196 7.5196 k = 0.4571 0.1432 0.1375 ( 7647 PWs) bands (ev): -22.6141 -22.6141 -22.3533 -22.3533 -20.0044 -20.0044 -19.6569 -19.6569 -14.0900 -14.0900 -13.9394 -13.9394 -12.6721 -12.6721 -12.5642 -12.5642 -10.9175 -10.9175 -10.5110 -10.5110 -8.3608 -8.3608 -7.6979 -7.6979 -6.4877 -6.4877 -6.1202 -6.1202 -6.1014 -6.1014 -5.6825 -5.6825 -5.6337 -5.6337 -5.4359 -5.4359 -5.2949 -5.2949 -4.9685 -4.9685 -4.9478 -4.9478 -4.8911 -4.8911 -4.5848 -4.5848 -3.4381 -3.4381 -2.1338 -2.1338 -2.0684 -2.0684 -1.6262 -1.6262 -1.4611 -1.4611 -0.9799 -0.9799 -0.9045 -0.9045 -0.7576 -0.7576 -0.6787 -0.6787 3.7650 3.7650 3.8293 3.8293 6.0625 6.0625 6.3889 6.3889 6.8753 6.8753 7.4879 7.4879 k = 0.4714 0.1476 0.1417 ( 7648 PWs) bands (ev): -22.6138 -22.6138 -22.3536 -22.3536 -20.0048 -20.0048 -19.6566 -19.6566 -14.0902 -14.0902 -13.9391 -13.9391 -12.6587 -12.6587 -12.5789 -12.5789 -10.9150 -10.9150 -10.5129 -10.5129 -8.3605 -8.3605 -7.6990 -7.6990 -6.4854 -6.4854 -6.1209 -6.1209 -6.1016 -6.1016 -5.6784 -5.6784 -5.6393 -5.6393 -5.4392 -5.4392 -5.2951 -5.2951 -4.9632 -4.9632 -4.9493 -4.9493 -4.8916 -4.8916 -4.5860 -4.5860 -3.4392 -3.4392 -2.1235 -2.1235 -2.0765 -2.0765 -1.6112 -1.6112 -1.4750 -1.4750 -0.9780 -0.9780 -0.9027 -0.9027 -0.7490 -0.7490 -0.6888 -0.6888 3.7747 3.7747 3.8187 3.8187 6.0864 6.0864 6.3666 6.3666 6.9088 6.9088 7.4610 7.4610 k = 0.4857 0.1521 0.1460 ( 7648 PWs) bands (ev): -22.6135 -22.6135 -22.3538 -22.3538 -20.0050 -20.0050 -19.6564 -19.6564 -14.0904 -14.0904 -13.9388 -13.9388 -12.6471 -12.6471 -12.5913 -12.5913 -10.9133 -10.9133 -10.5141 -10.5141 -8.3602 -8.3602 -7.6996 -7.6996 -6.4840 -6.4840 -6.1214 -6.1214 -6.1015 -6.1015 -5.6752 -5.6752 -5.6435 -5.6435 -5.4413 -5.4413 -5.2952 -5.2952 -4.9591 -4.9591 -4.9511 -4.9511 -4.8920 -4.8920 -4.5868 -4.5868 -3.4398 -3.4398 -2.1147 -2.1147 -2.0839 -2.0839 -1.6001 -1.6001 -1.4854 -1.4854 -0.9769 -0.9769 -0.9015 -0.9015 -0.7418 -0.7418 -0.6969 -0.6969 3.7844 3.7844 3.8084 3.8084 6.1032 6.1032 6.3508 6.3508 6.9311 6.9311 7.4426 7.4426 k = 0.5000 0.1566 0.1503 ( 7648 PWs) bands (ev): -22.6135 -22.6135 -22.3538 -22.3538 -20.0051 -20.0051 -19.6563 -19.6563 -14.0905 -14.0905 -13.9388 -13.9388 -12.6417 -12.6417 -12.5969 -12.5969 -10.9128 -10.9128 -10.5145 -10.5145 -8.3602 -8.3602 -7.6998 -7.6998 -6.4835 -6.4835 -6.1216 -6.1216 -6.1014 -6.1014 -5.6738 -5.6738 -5.6451 -5.6451 -5.4420 -5.4420 -5.2953 -5.2953 -4.9570 -4.9570 -4.9523 -4.9523 -4.8921 -4.8921 -4.5870 -4.5870 -3.4400 -3.4400 -2.1106 -2.1106 -2.0875 -2.0875 -1.5959 -1.5959 -1.4894 -1.4894 -0.9765 -0.9765 -0.9012 -0.9012 -0.7388 -0.7388 -0.7003 -0.7003 3.7908 3.7908 3.8017 3.8017 6.1094 6.1094 6.3449 6.3449 6.9389 6.9389 7.4360 7.4360 k = 0.5000-0.2228-0.0417 ( 7640 PWs) bands (ev): -22.6170 -22.6170 -22.3498 -22.3498 -20.0023 -20.0023 -19.6595 -19.6595 -14.0583 -14.0583 -13.9415 -13.9415 -12.8236 -12.8236 -12.4934 -12.4934 -10.8673 -10.8673 -10.4785 -10.4785 -8.3877 -8.3877 -7.6678 -7.6678 -6.5873 -6.5873 -6.2342 -6.2342 -5.9680 -5.9680 -5.5672 -5.5672 -5.5319 -5.5319 -5.5004 -5.5004 -5.1877 -5.1877 -5.0647 -5.0647 -5.0142 -5.0142 -4.9935 -4.9935 -4.5303 -4.5303 -3.3909 -3.3909 -2.1808 -2.1808 -2.0313 -2.0313 -1.9535 -1.9535 -1.3039 -1.3039 -1.0319 -1.0319 -0.8647 -0.8647 -0.8226 -0.8226 -0.4561 -0.4561 3.6838 3.6838 3.8995 3.8995 5.8295 5.8295 6.6128 6.6128 7.5989 7.5989 7.6024 7.6024 k = 0.4857-0.2165-0.0406 ( 7636 PWs) bands (ev): -22.6171 -22.6171 -22.3498 -22.3498 -20.0023 -20.0023 -19.6596 -19.6596 -14.0584 -14.0584 -13.9414 -13.9414 -12.8234 -12.8234 -12.4934 -12.4934 -10.8673 -10.8673 -10.4785 -10.4785 -8.3877 -8.3877 -7.6679 -7.6679 -6.5871 -6.5871 -6.2340 -6.2340 -5.9680 -5.9680 -5.5676 -5.5676 -5.5316 -5.5316 -5.4999 -5.4999 -5.1878 -5.1878 -5.0648 -5.0648 -5.0158 -5.0158 -4.9920 -4.9920 -4.5304 -4.5304 -3.3908 -3.3908 -2.1819 -2.1819 -2.0304 -2.0304 -1.9531 -1.9531 -1.3041 -1.3041 -1.0324 -1.0324 -0.8650 -0.8650 -0.8225 -0.8225 -0.4564 -0.4564 3.6834 3.6834 3.9002 3.9002 5.8297 5.8297 6.6122 6.6122 7.5470 7.5470 7.6488 7.6488 k = 0.4714-0.2101-0.0394 ( 7632 PWs) bands (ev): -22.6173 -22.6173 -22.3496 -22.3496 -20.0020 -20.0020 -19.6598 -19.6598 -14.0589 -14.0589 -13.9413 -13.9413 -12.8226 -12.8226 -12.4932 -12.4932 -10.8676 -10.8676 -10.4787 -10.4787 -8.3877 -8.3877 -7.6683 -7.6683 -6.5864 -6.5864 -6.2332 -6.2332 -5.9682 -5.9682 -5.5688 -5.5688 -5.5308 -5.5308 -5.4984 -5.4984 -5.1880 -5.1880 -5.0650 -5.0650 -5.0196 -5.0196 -4.9883 -4.9883 -4.5307 -4.5307 -3.3904 -3.3904 -2.1851 -2.1851 -2.0278 -2.0278 -1.9520 -1.9520 -1.3049 -1.3049 -1.0340 -1.0340 -0.8659 -0.8659 -0.8222 -0.8222 -0.4571 -0.4571 3.6822 3.6822 3.9020 3.9020 5.8303 5.8303 6.6105 6.6105 7.4887 7.4887 7.6914 7.6914 k = 0.4571-0.2037-0.0382 ( 7632 PWs) bands (ev): -22.6176 -22.6176 -22.3494 -22.3494 -20.0017 -20.0017 -19.6600 -19.6600 -14.0596 -14.0596 -13.9412 -13.9412 -12.8214 -12.8214 -12.4930 -12.4930 -10.8679 -10.8679 -10.4790 -10.4790 -8.3877 -8.3877 -7.6690 -7.6690 -6.5854 -6.5854 -6.2318 -6.2318 -5.9684 -5.9684 -5.5707 -5.5707 -5.5295 -5.5295 -5.4960 -5.4960 -5.1884 -5.1884 -5.0654 -5.0654 -5.0243 -5.0243 -4.9839 -4.9839 -4.5312 -4.5312 -3.3898 -3.3898 -2.1902 -2.1902 -2.0238 -2.0238 -1.9502 -1.9502 -1.3062 -1.3062 -1.0366 -1.0366 -0.8674 -0.8674 -0.8217 -0.8217 -0.4584 -0.4584 3.6802 3.6802 3.9050 3.9050 5.8313 5.8313 6.6077 6.6077 7.4261 7.4261 7.7284 7.7284 k = 0.4429-0.1974-0.0370 ( 7631 PWs) bands (ev): -22.6181 -22.6181 -22.3490 -22.3490 -20.0012 -20.0012 -19.6605 -19.6605 -14.0607 -14.0607 -13.9409 -13.9409 -12.8198 -12.8198 -12.4927 -12.4927 -10.8685 -10.8685 -10.4794 -10.4794 -8.3877 -8.3877 -7.6699 -7.6699 -6.5839 -6.5839 -6.2300 -6.2300 -5.9686 -5.9686 -5.5732 -5.5732 -5.5278 -5.5278 -5.4929 -5.4929 -5.1888 -5.1888 -5.0660 -5.0660 -5.0292 -5.0292 -4.9793 -4.9793 -4.5319 -4.5319 -3.3890 -3.3890 -2.1968 -2.1968 -2.0187 -2.0187 -1.9476 -1.9476 -1.3080 -1.3080 -1.0402 -1.0402 -0.8695 -0.8695 -0.8210 -0.8210 -0.4602 -0.4602 3.6776 3.6776 3.9090 3.9090 5.8327 5.8327 6.6038 6.6038 7.3600 7.3600 7.7603 7.7603 k = 0.4286-0.1910-0.0358 ( 7635 PWs) bands (ev): -22.6186 -22.6186 -22.3486 -22.3486 -20.0006 -20.0006 -19.6610 -19.6610 -14.0620 -14.0620 -13.9407 -13.9407 -12.8176 -12.8176 -12.4922 -12.4922 -10.8691 -10.8691 -10.4799 -10.4799 -8.3877 -8.3877 -7.6711 -7.6711 -6.5820 -6.5820 -6.2276 -6.2276 -5.9689 -5.9689 -5.5761 -5.5761 -5.5257 -5.5257 -5.4891 -5.4891 -5.1894 -5.1894 -5.0669 -5.0669 -5.0338 -5.0338 -4.9748 -4.9748 -4.5328 -4.5328 -3.3879 -3.3879 -2.2046 -2.2046 -2.0129 -2.0129 -1.9441 -1.9441 -1.3103 -1.3103 -1.0448 -1.0448 -0.8722 -0.8722 -0.8201 -0.8201 -0.4625 -0.4625 3.6744 3.6744 3.9140 3.9140 5.8345 5.8345 6.5988 6.5988 7.2913 7.2913 7.7876 7.7876 k = 0.4143-0.1846-0.0346 ( 7633 PWs) bands (ev): -22.6194 -22.6194 -22.3481 -22.3481 -19.9998 -19.9998 -19.6616 -19.6616 -14.0635 -14.0635 -13.9404 -13.9404 -12.8150 -12.8150 -12.4918 -12.4918 -10.8699 -10.8699 -10.4806 -10.4806 -8.3877 -8.3877 -7.6725 -7.6725 -6.5797 -6.5797 -6.2248 -6.2248 -5.9691 -5.9691 -5.5794 -5.5794 -5.5233 -5.5233 -5.4848 -5.4848 -5.1900 -5.1900 -5.0681 -5.0681 -5.0380 -5.0380 -4.9707 -4.9707 -4.5340 -4.5340 -3.3867 -3.3867 -2.2134 -2.2134 -2.0067 -2.0067 -1.9398 -1.9398 -1.3132 -1.3132 -1.0504 -1.0504 -0.8754 -0.8754 -0.8190 -0.8190 -0.4653 -0.4653 3.6708 3.6708 3.9199 3.9199 5.8368 5.8368 6.5927 6.5927 7.2205 7.2205 7.8110 7.8110 k = 0.4000-0.1783-0.0334 ( 7635 PWs) bands (ev): -22.6202 -22.6202 -22.3475 -22.3475 -19.9989 -19.9989 -19.6623 -19.6623 -14.0653 -14.0653 -13.9401 -13.9401 -12.8120 -12.8120 -12.4912 -12.4912 -10.8709 -10.8709 -10.4813 -10.4813 -8.3878 -8.3878 -7.6741 -7.6741 -6.5771 -6.5771 -6.2216 -6.2216 -5.9692 -5.9692 -5.5830 -5.5830 -5.5206 -5.5206 -5.4801 -5.4801 -5.1907 -5.1907 -5.0697 -5.0697 -5.0416 -5.0416 -4.9669 -4.9669 -4.5353 -4.5353 -3.3852 -3.3852 -2.2229 -2.2229 -2.0004 -2.0004 -1.9344 -1.9344 -1.3166 -1.3166 -1.0569 -1.0569 -0.8792 -0.8792 -0.8177 -0.8177 -0.4685 -0.4685 3.6667 3.6667 3.9265 3.9265 5.8394 5.8394 6.5854 6.5854 7.1484 7.1484 7.8311 7.8311 k = 0.3857-0.1719-0.0322 ( 7634 PWs) bands (ev): -22.6211 -22.6211 -22.3468 -22.3468 -19.9979 -19.9979 -19.6632 -19.6632 -14.0673 -14.0673 -13.9397 -13.9397 -12.8085 -12.8085 -12.4906 -12.4906 -10.8720 -10.8720 -10.4821 -10.4821 -8.3878 -8.3878 -7.6759 -7.6759 -6.5741 -6.5741 -6.2179 -6.2179 -5.9692 -5.9692 -5.5868 -5.5868 -5.5177 -5.5177 -5.4752 -5.4752 -5.1914 -5.1914 -5.0718 -5.0718 -5.0445 -5.0445 -4.9636 -4.9636 -4.5369 -4.5369 -3.3835 -3.3835 -2.2329 -2.2329 -1.9942 -1.9942 -1.9281 -1.9281 -1.3205 -1.3205 -1.0642 -1.0642 -0.8834 -0.8834 -0.8161 -0.8161 -0.4721 -0.4721 3.6624 3.6624 3.9337 3.9337 5.8424 5.8424 6.5769 6.5769 7.0756 7.0756 7.8487 7.8487 k = 0.3714-0.1655-0.0310 ( 7638 PWs) bands (ev): -22.6221 -22.6221 -22.3461 -22.3461 -19.9968 -19.9968 -19.6641 -19.6641 -14.0695 -14.0695 -13.9394 -13.9394 -12.8047 -12.8047 -12.4900 -12.4900 -10.8732 -10.8732 -10.4831 -10.4831 -8.3878 -8.3878 -7.6779 -7.6779 -6.5707 -6.5707 -6.2140 -6.2140 -5.9689 -5.9689 -5.5908 -5.5908 -5.5147 -5.5147 -5.4702 -5.4702 -5.1920 -5.1920 -5.0741 -5.0741 -5.0465 -5.0465 -4.9608 -4.9608 -4.5387 -4.5387 -3.3817 -3.3817 -2.2433 -2.2433 -1.9883 -1.9883 -1.9208 -1.9208 -1.3250 -1.3250 -1.0723 -1.0723 -0.8881 -0.8881 -0.8143 -0.8143 -0.4761 -0.4761 3.6580 3.6580 3.9413 3.9413 5.8458 5.8458 6.5672 6.5672 7.0026 7.0026 7.8643 7.8643 k = 0.3571-0.1592-0.0298 ( 7645 PWs) bands (ev): -22.6232 -22.6232 -22.3453 -22.3453 -19.9956 -19.9956 -19.6652 -19.6652 -14.0718 -14.0718 -13.9390 -13.9390 -12.8004 -12.8004 -12.4893 -12.4893 -10.8745 -10.8745 -10.4841 -10.4841 -8.3878 -8.3878 -7.6802 -7.6802 -6.5670 -6.5670 -6.2097 -6.2097 -5.9683 -5.9683 -5.5949 -5.5949 -5.5116 -5.5116 -5.4652 -5.4652 -5.1926 -5.1926 -5.0767 -5.0767 -5.0479 -5.0479 -4.9586 -4.9586 -4.5408 -4.5408 -3.3797 -3.3797 -2.2539 -2.2539 -1.9827 -1.9827 -1.9125 -1.9125 -1.3300 -1.3300 -1.0812 -1.0812 -0.8932 -0.8932 -0.8123 -0.8123 -0.4804 -0.4804 3.6534 3.6534 3.9494 3.9494 5.8495 5.8495 6.5562 6.5562 6.9301 6.9301 7.8784 7.8784 k = 0.3429-0.1528-0.0286 ( 7639 PWs) bands (ev): -22.6243 -22.6243 -22.3444 -22.3444 -19.9943 -19.9943 -19.6663 -19.6663 -14.0742 -14.0742 -13.9387 -13.9387 -12.7958 -12.7958 -12.4887 -12.4887 -10.8759 -10.8759 -10.4852 -10.4852 -8.3877 -8.3877 -7.6825 -7.6825 -6.5631 -6.5631 -6.2052 -6.2052 -5.9673 -5.9673 -5.5991 -5.5991 -5.5085 -5.5085 -5.4603 -5.4603 -5.1931 -5.1931 -5.0794 -5.0794 -5.0485 -5.0485 -4.9569 -4.9569 -4.5430 -4.5430 -3.3775 -3.3775 -2.2646 -2.2646 -1.9773 -1.9773 -1.9035 -1.9035 -1.3355 -1.3355 -1.0907 -1.0907 -0.8986 -0.8986 -0.8101 -0.8101 -0.4851 -0.4851 3.6488 3.6488 3.9577 3.9577 5.8537 5.8537 6.5436 6.5436 6.8587 6.8587 7.8912 7.8912 k = 0.3286-0.1464-0.0274 ( 7648 PWs) bands (ev): -22.6256 -22.6256 -22.3435 -22.3435 -19.9929 -19.9929 -19.6675 -19.6675 -14.0768 -14.0768 -13.9384 -13.9384 -12.7909 -12.7909 -12.4880 -12.4880 -10.8775 -10.8775 -10.4863 -10.4863 -8.3877 -8.3877 -7.6850 -7.6850 -6.5589 -6.5589 -6.2006 -6.2006 -5.9658 -5.9658 -5.6033 -5.6033 -5.5054 -5.5054 -5.4557 -5.4557 -5.1936 -5.1936 -5.0820 -5.0820 -5.0486 -5.0486 -4.9557 -4.9557 -4.5455 -4.5455 -3.3753 -3.3753 -2.2754 -2.2754 -1.9722 -1.9722 -1.8937 -1.8937 -1.3416 -1.3416 -1.1008 -1.1008 -0.9043 -0.9043 -0.8077 -0.8077 -0.4901 -0.4901 3.6442 3.6442 3.9662 3.9662 5.8582 5.8582 6.5291 6.5291 6.7892 6.7892 7.9031 7.9031 k = 0.3143-0.1401-0.0262 ( 7643 PWs) bands (ev): -22.6269 -22.6269 -22.3426 -22.3426 -19.9914 -19.9914 -19.6687 -19.6687 -14.0794 -14.0794 -13.9381 -13.9381 -12.7856 -12.7856 -12.4873 -12.4873 -10.8791 -10.8791 -10.4875 -10.4875 -8.3877 -8.3877 -7.6877 -7.6877 -6.5544 -6.5544 -6.1960 -6.1960 -5.9636 -5.9636 -5.6076 -5.6076 -5.5023 -5.5023 -5.4514 -5.4514 -5.1940 -5.1940 -5.0846 -5.0846 -5.0481 -5.0481 -4.9550 -4.9550 -4.5483 -4.5483 -3.3729 -3.3729 -2.2862 -2.2862 -1.9674 -1.9674 -1.8833 -1.8833 -1.3481 -1.3481 -1.1113 -1.1113 -0.9103 -0.9103 -0.8051 -0.8051 -0.4953 -0.4953 3.6398 3.6398 3.9748 3.9748 5.8630 5.8630 6.5118 6.5118 6.7228 6.7228 7.9143 7.9143 k = 0.3000-0.1337-0.0250 ( 7641 PWs) bands (ev): -22.6282 -22.6282 -22.3416 -22.3416 -19.9898 -19.9898 -19.6700 -19.6700 -14.0821 -14.0821 -13.9379 -13.9379 -12.7801 -12.7801 -12.4868 -12.4868 -10.8808 -10.8808 -10.4888 -10.4888 -8.3877 -8.3877 -7.6904 -7.6904 -6.5498 -6.5498 -6.1914 -6.1914 -5.9607 -5.9607 -5.6119 -5.6119 -5.4993 -5.4993 -5.4477 -5.4477 -5.1943 -5.1943 -5.0870 -5.0870 -5.0469 -5.0469 -4.9548 -4.9548 -4.5512 -4.5512 -3.3704 -3.3704 -2.2969 -2.2969 -1.9626 -1.9626 -1.8724 -1.8724 -1.3553 -1.3553 -1.1223 -1.1223 -0.9166 -0.9166 -0.8023 -0.8023 -0.5008 -0.5008 3.6354 3.6354 3.9835 3.9835 5.8681 5.8681 6.4902 6.4902 6.6614 6.6614 7.9247 7.9247 k = 0.2857-0.1273-0.0239 ( 7641 PWs) bands (ev): -22.6295 -22.6295 -22.3407 -22.3407 -19.9882 -19.9882 -19.6714 -19.6714 -14.0848 -14.0848 -13.9377 -13.9377 -12.7744 -12.7744 -12.4862 -12.4862 -10.8826 -10.8826 -10.4901 -10.4901 -8.3876 -8.3876 -7.6932 -7.6932 -6.5450 -6.5450 -6.1870 -6.1870 -5.9569 -5.9569 -5.6162 -5.6162 -5.4965 -5.4965 -5.4445 -5.4445 -5.1947 -5.1947 -5.0894 -5.0894 -5.0451 -5.0451 -4.9550 -4.9550 -4.5543 -4.5543 -3.3679 -3.3679 -2.3074 -2.3074 -1.9580 -1.9580 -1.8611 -1.8611 -1.3629 -1.3629 -1.1335 -1.1335 -0.9229 -0.9229 -0.7992 -0.7992 -0.5065 -0.5065 3.6312 3.6312 3.9921 3.9921 5.8734 5.8734 6.4621 6.4621 6.6078 6.6078 7.9346 7.9346 k = 0.2714-0.1210-0.0227 ( 7639 PWs) bands (ev): -22.6309 -22.6309 -22.3397 -22.3397 -19.9865 -19.9865 -19.6728 -19.6728 -14.0875 -14.0875 -13.9375 -13.9375 -12.7684 -12.7684 -12.4857 -12.4857 -10.8844 -10.8844 -10.4914 -10.4914 -8.3875 -8.3875 -7.6961 -7.6961 -6.5402 -6.5402 -6.1828 -6.1828 -5.9521 -5.9521 -5.6204 -5.6204 -5.4939 -5.4939 -5.4420 -5.4420 -5.1950 -5.1950 -5.0917 -5.0917 -5.0426 -5.0426 -4.9556 -4.9556 -4.5576 -4.5576 -3.3654 -3.3654 -2.3178 -2.3178 -1.9535 -1.9535 -1.8495 -1.8495 -1.3710 -1.3710 -1.1450 -1.1450 -0.9294 -0.9294 -0.7961 -0.7961 -0.5123 -0.5123 3.6272 3.6272 4.0006 4.0006 5.8789 5.8789 6.4251 6.4251 6.5646 6.5646 7.9438 7.9438 k = 0.2571-0.1146-0.0215 ( 7643 PWs) bands (ev): -22.6323 -22.6323 -22.3387 -22.3387 -19.9848 -19.9848 -19.6743 -19.6743 -14.0903 -14.0903 -13.9374 -13.9374 -12.7623 -12.7623 -12.4853 -12.4853 -10.8863 -10.8863 -10.4928 -10.4928 -8.3875 -8.3875 -7.6990 -7.6990 -6.5352 -6.5352 -6.1790 -6.1790 -5.9463 -5.9463 -5.6245 -5.6245 -5.4916 -5.4916 -5.4401 -5.4401 -5.1953 -5.1953 -5.0942 -5.0942 -5.0395 -5.0395 -4.9566 -4.9566 -4.5610 -4.5610 -3.3628 -3.3628 -2.3280 -2.3280 -1.9491 -1.9491 -1.8376 -1.8376 -1.3796 -1.3796 -1.1565 -1.1565 -0.9360 -0.9360 -0.7927 -0.7927 -0.5183 -0.5183 3.6234 3.6234 4.0089 4.0089 5.8844 5.8844 6.3796 6.3796 6.5317 6.5317 7.9523 7.9523 k = 0.2429-0.1082-0.0203 ( 7644 PWs) bands (ev): -22.6336 -22.6336 -22.3377 -22.3377 -19.9831 -19.9831 -19.6757 -19.6757 -14.0929 -14.0929 -13.9374 -13.9374 -12.7560 -12.7560 -12.4850 -12.4850 -10.8882 -10.8882 -10.4941 -10.4941 -8.3874 -8.3874 -7.7018 -7.7018 -6.5302 -6.5302 -6.1756 -6.1756 -5.9394 -5.9394 -5.6286 -5.6286 -5.4895 -5.4895 -5.4389 -5.4389 -5.1957 -5.1957 -5.0967 -5.0967 -5.0356 -5.0356 -4.9577 -4.9577 -4.5645 -4.5645 -3.3602 -3.3602 -2.3378 -2.3378 -1.9448 -1.9448 -1.8255 -1.8255 -1.3886 -1.3886 -1.1680 -1.1680 -0.9426 -0.9426 -0.7892 -0.7892 -0.5244 -0.5244 3.6199 3.6199 4.0170 4.0170 5.8899 5.8899 6.3292 6.3292 6.5061 6.5061 7.9603 7.9603 k = 0.2286-0.1019-0.0191 ( 7639 PWs) bands (ev): -22.6350 -22.6350 -22.3368 -22.3368 -19.9813 -19.9813 -19.6772 -19.6772 -14.0956 -14.0956 -13.9373 -13.9373 -12.7497 -12.7497 -12.4848 -12.4848 -10.8901 -10.8901 -10.4955 -10.4955 -8.3873 -8.3873 -7.7047 -7.7047 -6.5252 -6.5252 -6.1726 -6.1726 -5.9313 -5.9313 -5.6324 -5.6324 -5.4880 -5.4880 -5.4383 -5.4383 -5.1962 -5.1962 -5.0994 -5.0994 -5.0312 -5.0312 -4.9590 -4.9590 -4.5681 -4.5681 -3.3576 -3.3576 -2.3474 -2.3474 -1.9405 -1.9405 -1.8133 -1.8133 -1.3980 -1.3980 -1.1794 -1.1794 -0.9491 -0.9491 -0.7855 -0.7855 -0.5306 -0.5306 3.6165 3.6165 4.0248 4.0248 5.8950 5.8950 6.2776 6.2776 6.4845 6.4845 7.9676 7.9676 k = 0.2143-0.0955-0.0179 ( 7639 PWs) bands (ev): -22.6363 -22.6363 -22.3358 -22.3358 -19.9796 -19.9796 -19.6787 -19.6787 -14.0981 -14.0981 -13.9373 -13.9373 -12.7433 -12.7433 -12.4847 -12.4847 -10.8919 -10.8919 -10.4968 -10.4968 -8.3872 -8.3872 -7.7076 -7.7076 -6.5203 -6.5203 -6.1702 -6.1702 -5.9221 -5.9221 -5.6361 -5.6361 -5.4870 -5.4870 -5.4382 -5.4382 -5.1967 -5.1967 -5.1023 -5.1023 -5.0263 -5.0263 -4.9602 -4.9602 -4.5718 -4.5718 -3.3551 -3.3551 -2.3566 -2.3566 -1.9363 -1.9363 -1.8010 -1.8010 -1.4077 -1.4077 -1.1906 -1.1906 -0.9556 -0.9556 -0.7817 -0.7817 -0.5368 -0.5368 3.6134 3.6134 4.0323 4.0323 5.8994 5.8994 6.2273 6.2273 6.4652 6.4652 7.9732 7.9732 k = 0.2000-0.0891-0.0167 ( 7630 PWs) bands (ev): -22.6376 -22.6376 -22.3349 -22.3349 -19.9779 -19.9779 -19.6801 -19.6801 -14.1006 -14.1006 -13.9373 -13.9373 -12.7369 -12.7369 -12.4847 -12.4847 -10.8938 -10.8938 -10.4981 -10.4981 -8.3871 -8.3871 -7.7103 -7.7103 -6.5154 -6.5154 -6.1683 -6.1683 -5.9117 -5.9117 -5.6396 -5.6396 -5.4867 -5.4867 -5.4385 -5.4385 -5.1972 -5.1972 -5.1054 -5.1054 -5.0212 -5.0212 -4.9613 -4.9613 -4.5754 -4.5754 -3.3526 -3.3526 -2.3654 -2.3654 -1.9321 -1.9321 -1.7887 -1.7887 -1.4177 -1.4177 -1.2015 -1.2015 -0.9620 -0.9620 -0.7778 -0.7778 -0.5430 -0.5430 3.6106 3.6106 4.0395 4.0395 5.9024 5.9024 6.1803 6.1803 6.4470 6.4470 7.9730 7.9730 k = 0.1857-0.0828-0.0155 ( 7630 PWs) bands (ev): -22.6389 -22.6389 -22.3340 -22.3340 -19.9762 -19.9762 -19.6816 -19.6816 -14.1030 -14.1030 -13.9374 -13.9374 -12.7306 -12.7306 -12.4848 -12.4848 -10.8957 -10.8957 -10.4994 -10.4994 -8.3870 -8.3870 -7.7130 -7.7130 -6.5107 -6.5107 -6.1669 -6.1669 -5.9003 -5.9003 -5.6429 -5.6429 -5.4873 -5.4873 -5.4391 -5.4391 -5.1979 -5.1979 -5.1087 -5.1087 -5.0161 -5.0161 -4.9621 -4.9621 -4.5790 -4.5790 -3.3502 -3.3502 -2.3737 -2.3737 -1.9281 -1.9281 -1.7764 -1.7764 -1.4278 -1.4278 -1.2120 -1.2120 -0.9682 -0.9682 -0.7738 -0.7738 -0.5492 -0.5492 3.6080 3.6080 4.0462 4.0462 5.9031 5.9031 6.1381 6.1381 6.4295 6.4295 7.9701 7.9701 k = 0.1714-0.0764-0.0143 ( 7634 PWs) bands (ev): -22.6401 -22.6401 -22.3332 -22.3332 -19.9746 -19.9746 -19.6830 -19.6830 -14.1052 -14.1052 -13.9374 -13.9374 -12.7245 -12.7245 -12.4850 -12.4850 -10.8974 -10.8974 -10.5006 -10.5006 -8.3868 -8.3868 -7.7156 -7.7156 -6.5061 -6.5061 -6.1659 -6.1659 -5.8879 -5.8879 -5.6458 -5.6458 -5.4891 -5.4891 -5.4397 -5.4397 -5.1985 -5.1985 -5.1121 -5.1121 -5.0113 -5.0113 -4.9623 -4.9623 -4.5825 -4.5825 -3.3479 -3.3479 -2.3817 -2.3817 -1.9243 -1.9243 -1.7643 -1.7643 -1.4381 -1.4381 -1.2222 -1.2222 -0.9743 -0.9743 -0.7697 -0.7697 -0.5553 -0.5553 3.6056 3.6056 4.0526 4.0526 5.9000 5.9000 6.1026 6.1026 6.4125 6.4125 7.9671 7.9671 k = 0.1571-0.0700-0.0131 ( 7635 PWs) bands (ev): -22.6412 -22.6412 -22.3324 -22.3324 -19.9730 -19.9730 -19.6843 -19.6843 -14.1073 -14.1073 -13.9375 -13.9375 -12.7185 -12.7185 -12.4853 -12.4853 -10.8992 -10.8992 -10.5018 -10.5018 -8.3867 -8.3867 -7.7181 -7.7181 -6.5018 -6.5018 -6.1653 -6.1653 -5.8748 -5.8748 -5.6483 -5.6483 -5.4921 -5.4921 -5.4403 -5.4403 -5.1993 -5.1993 -5.1156 -5.1156 -5.0071 -5.0071 -4.9617 -4.9617 -4.5859 -4.5859 -3.3457 -3.3457 -2.3891 -2.3891 -1.9205 -1.9205 -1.7523 -1.7523 -1.4484 -1.4484 -1.2318 -1.2318 -0.9800 -0.9800 -0.7656 -0.7656 -0.5613 -0.5613 3.6035 3.6035 4.0585 4.0585 5.8917 5.8917 6.0758 6.0758 6.3959 6.3959 7.9642 7.9642 k = 0.1429-0.0637-0.0119 ( 7632 PWs) bands (ev): -22.6423 -22.6423 -22.3317 -22.3317 -19.9715 -19.9715 -19.6856 -19.6856 -14.1093 -14.1093 -13.9376 -13.9376 -12.7127 -12.7127 -12.4857 -12.4857 -10.9008 -10.9008 -10.5029 -10.5029 -8.3866 -8.3866 -7.7204 -7.7204 -6.4977 -6.4977 -6.1651 -6.1651 -5.8610 -5.8610 -5.6504 -5.6504 -5.4965 -5.4965 -5.4407 -5.4407 -5.2000 -5.2000 -5.1190 -5.1190 -5.0039 -5.0039 -4.9601 -4.9601 -4.5891 -4.5891 -3.3436 -3.3436 -2.3959 -2.3959 -1.9170 -1.9170 -1.7406 -1.7406 -1.4585 -1.4585 -1.2409 -1.2409 -0.9855 -0.9855 -0.7615 -0.7615 -0.5672 -0.5672 3.6016 3.6016 4.0639 4.0639 5.8772 5.8772 6.0586 6.0586 6.3796 6.3796 7.9615 7.9615 k = 0.1286-0.0573-0.0107 ( 7628 PWs) bands (ev): -22.6432 -22.6432 -22.3310 -22.3310 -19.9701 -19.9701 -19.6868 -19.6868 -14.1111 -14.1111 -13.9377 -13.9377 -12.7072 -12.7072 -12.4862 -12.4862 -10.9023 -10.9023 -10.5040 -10.5040 -8.3865 -8.3865 -7.7225 -7.7225 -6.4938 -6.4938 -6.1651 -6.1651 -5.8468 -5.8468 -5.6519 -5.6519 -5.5024 -5.5024 -5.4408 -5.4408 -5.2008 -5.2008 -5.1223 -5.1223 -5.0017 -5.0017 -4.9576 -4.9576 -4.5921 -4.5921 -3.3417 -3.3417 -2.4022 -2.4022 -1.9137 -1.9137 -1.7293 -1.7293 -1.4685 -1.4685 -1.2493 -1.2493 -0.9906 -0.9906 -0.7575 -0.7575 -0.5729 -0.5729 3.5999 3.5999 4.0689 4.0689 5.8576 5.8576 6.0500 6.0500 6.3638 6.3638 7.9589 7.9589 k = 0.1143-0.0509-0.0095 ( 7623 PWs) bands (ev): -22.6441 -22.6441 -22.3303 -22.3303 -19.9688 -19.9688 -19.6879 -19.6879 -14.1128 -14.1128 -13.9379 -13.9379 -12.7021 -12.7021 -12.4867 -12.4867 -10.9037 -10.9037 -10.5049 -10.5049 -8.3863 -8.3863 -7.7245 -7.7245 -6.4902 -6.4902 -6.1654 -6.1654 -5.8326 -5.8326 -5.6528 -5.6528 -5.5096 -5.5096 -5.4406 -5.4406 -5.2016 -5.2016 -5.1255 -5.1255 -5.0004 -5.0004 -4.9544 -4.9544 -4.5949 -4.5949 -3.3400 -3.3400 -2.4080 -2.4080 -1.9106 -1.9106 -1.7184 -1.7184 -1.4781 -1.4781 -1.2571 -1.2571 -0.9953 -0.9953 -0.7536 -0.7536 -0.5783 -0.5783 3.5985 3.5985 4.0733 4.0733 5.8353 5.8353 6.0480 6.0480 6.3484 6.3484 7.9566 7.9566 k = 0.1000-0.0446-0.0083 ( 7627 PWs) bands (ev): -22.6449 -22.6449 -22.3298 -22.3298 -19.9676 -19.9676 -19.6890 -19.6890 -14.1143 -14.1143 -13.9380 -13.9380 -12.6974 -12.6974 -12.4873 -12.4873 -10.9050 -10.9050 -10.5058 -10.5058 -8.3862 -8.3862 -7.7263 -7.7263 -6.4870 -6.4870 -6.1658 -6.1658 -5.8185 -5.8185 -5.6529 -5.6529 -5.5180 -5.5180 -5.4403 -5.4403 -5.2024 -5.2024 -5.1284 -5.1284 -4.9998 -4.9998 -4.9507 -4.9507 -4.5974 -4.5974 -3.3384 -3.3384 -2.4131 -2.4131 -1.9078 -1.9078 -1.7080 -1.7080 -1.4873 -1.4873 -1.2642 -1.2642 -0.9996 -0.9996 -0.7499 -0.7499 -0.5833 -0.5833 3.5972 3.5972 4.0772 4.0772 5.8124 5.8124 6.0500 6.0500 6.3337 6.3337 7.9544 7.9544 k = 0.0857-0.0382-0.0072 ( 7633 PWs) bands (ev): -22.6456 -22.6456 -22.3293 -22.3293 -19.9666 -19.9666 -19.6899 -19.6899 -14.1156 -14.1156 -13.9381 -13.9381 -12.6932 -12.6932 -12.4879 -12.4879 -10.9061 -10.9061 -10.5065 -10.5065 -8.3861 -8.3861 -7.7279 -7.7279 -6.4842 -6.4842 -6.1663 -6.1663 -5.8051 -5.8051 -5.6522 -5.6522 -5.5274 -5.5274 -5.4400 -5.4400 -5.2031 -5.2031 -5.1311 -5.1311 -4.9997 -4.9997 -4.9469 -4.9469 -4.5997 -4.5997 -3.3370 -3.3370 -2.4176 -2.4176 -1.9054 -1.9054 -1.6984 -1.6984 -1.4959 -1.4959 -1.2705 -1.2705 -1.0035 -1.0035 -0.7464 -0.7464 -0.5880 -0.5880 3.5962 3.5962 4.0807 4.0807 5.7908 5.7908 6.0546 6.0546 6.3199 6.3199 7.9524 7.9524 k = 0.0714-0.0318-0.0060 ( 7634 PWs) bands (ev): -22.6463 -22.6463 -22.3289 -22.3289 -19.9657 -19.9657 -19.6906 -19.6906 -14.1167 -14.1167 -13.9382 -13.9382 -12.6895 -12.6895 -12.4884 -12.4884 -10.9071 -10.9071 -10.5072 -10.5072 -8.3860 -8.3860 -7.7292 -7.7292 -6.4817 -6.4817 -6.1668 -6.1668 -5.7926 -5.7926 -5.6503 -5.6503 -5.5375 -5.5375 -5.4395 -5.4395 -5.2039 -5.2039 -5.1334 -5.1334 -4.9999 -4.9999 -4.9433 -4.9433 -4.6016 -4.6016 -3.3358 -3.3358 -2.4214 -2.4214 -1.9032 -1.9032 -1.6897 -1.6897 -1.5038 -1.5038 -1.2759 -1.2759 -1.0068 -1.0068 -0.7432 -0.7432 -0.5921 -0.5921 3.5953 3.5953 4.0836 4.0836 5.7714 5.7714 6.0603 6.0603 6.3071 6.3071 7.9507 7.9507 k = 0.0571-0.0255-0.0048 ( 7632 PWs) bands (ev): -22.6468 -22.6468 -22.3285 -22.3285 -19.9649 -19.9649 -19.6913 -19.6913 -14.1176 -14.1176 -13.9383 -13.9383 -12.6864 -12.6864 -12.4889 -12.4889 -10.9079 -10.9079 -10.5077 -10.5077 -8.3860 -8.3860 -7.7303 -7.7303 -6.4797 -6.4797 -6.1673 -6.1673 -5.7817 -5.7817 -5.6473 -5.6473 -5.5480 -5.5480 -5.4391 -5.4391 -5.2045 -5.2045 -5.1353 -5.1353 -5.0002 -5.0002 -4.9400 -4.9400 -4.6032 -4.6032 -3.3348 -3.3348 -2.4246 -2.4246 -1.9014 -1.9014 -1.6820 -1.6820 -1.5107 -1.5107 -1.2805 -1.2805 -1.0095 -1.0095 -0.7404 -0.7404 -0.5957 -0.5957 3.5946 3.5946 4.0859 4.0859 5.7549 5.7549 6.0664 6.0664 6.2958 6.2958 7.9493 7.9493 k = 0.0429-0.0191-0.0036 ( 7626 PWs) bands (ev): -22.6472 -22.6472 -22.3282 -22.3282 -19.9643 -19.9643 -19.6918 -19.6918 -14.1183 -14.1183 -13.9383 -13.9383 -12.6839 -12.6839 -12.4893 -12.4893 -10.9086 -10.9086 -10.5081 -10.5081 -8.3859 -8.3859 -7.7312 -7.7312 -6.4781 -6.4781 -6.1677 -6.1677 -5.7727 -5.7727 -5.6432 -5.6432 -5.5584 -5.5584 -5.4387 -5.4387 -5.2050 -5.2050 -5.1368 -5.1368 -5.0005 -5.0005 -4.9374 -4.9374 -4.6045 -4.6045 -3.3340 -3.3340 -2.4270 -2.4270 -1.9000 -1.9000 -1.6757 -1.6757 -1.5164 -1.5164 -1.2840 -1.2840 -1.0117 -1.0117 -0.7381 -0.7381 -0.5986 -0.5986 3.5941 3.5941 4.0878 4.0878 5.7418 5.7418 6.0721 6.0721 6.2862 6.2862 7.9482 7.9482 k = 0.0286-0.0127-0.0024 ( 7618 PWs) bands (ev): -22.6474 -22.6474 -22.3280 -22.3280 -19.9639 -19.9639 -19.6922 -19.6922 -14.1189 -14.1189 -13.9384 -13.9384 -12.6821 -12.6821 -12.4896 -12.4896 -10.9090 -10.9090 -10.5085 -10.5085 -8.3859 -8.3859 -7.7319 -7.7319 -6.4769 -6.4769 -6.1680 -6.1680 -5.7661 -5.7661 -5.6385 -5.6385 -5.5677 -5.5677 -5.4385 -5.4385 -5.2054 -5.2054 -5.1378 -5.1378 -5.0007 -5.0007 -4.9354 -4.9354 -4.6054 -4.6054 -3.3335 -3.3335 -2.4288 -2.4288 -1.8990 -1.8990 -1.6709 -1.6709 -1.5207 -1.5207 -1.2866 -1.2866 -1.0133 -1.0133 -0.7364 -0.7364 -0.6008 -0.6008 3.5937 3.5937 4.0891 4.0891 5.7323 5.7323 6.0767 6.0767 6.2790 6.2790 7.9473 7.9473 k = 0.0143-0.0064-0.0012 ( 7619 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9636 -19.9636 -19.6924 -19.6924 -14.1192 -14.1192 -13.9384 -13.9384 -12.6810 -12.6810 -12.4898 -12.4898 -10.9093 -10.9093 -10.5086 -10.5086 -8.3858 -8.3858 -7.7322 -7.7322 -6.4762 -6.4762 -6.1683 -6.1683 -5.7620 -5.7620 -5.6344 -5.6344 -5.5747 -5.5747 -5.4383 -5.4383 -5.2057 -5.2057 -5.1385 -5.1385 -5.0009 -5.0009 -4.9342 -4.9342 -4.6060 -4.6060 -3.3331 -3.3331 -2.4299 -2.4299 -1.8984 -1.8984 -1.6679 -1.6679 -1.5234 -1.5234 -1.2882 -1.2882 -1.0142 -1.0142 -0.7354 -0.7354 -0.6021 -0.6021 3.5935 3.5935 4.0899 4.0899 5.7265 5.7265 6.0798 6.0798 6.2744 6.2744 7.9468 7.9468 k = 0.0000 0.0000 0.0000 ( 7611 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1193 -14.1193 -13.9384 -13.9384 -12.6806 -12.6806 -12.4899 -12.4899 -10.9094 -10.9094 -10.5087 -10.5087 -8.3858 -8.3858 -7.7324 -7.7324 -6.4759 -6.4759 -6.1683 -6.1683 -5.7607 -5.7607 -5.6327 -5.6327 -5.5774 -5.5774 -5.4382 -5.4382 -5.2057 -5.2057 -5.1387 -5.1387 -5.0010 -5.0010 -4.9338 -4.9338 -4.6062 -4.6062 -3.3330 -3.3330 -2.4302 -2.4302 -1.8981 -1.8981 -1.6668 -1.6668 -1.5244 -1.5244 -1.2888 -1.2888 -1.0146 -1.0146 -0.7350 -0.7350 -0.6025 -0.6025 3.5934 3.5934 4.0902 4.0902 5.7246 5.7246 6.0808 6.0808 6.2728 6.2728 7.9467 7.9467 k = 0.0000 0.0000 0.0000 ( 7611 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1193 -14.1193 -13.9384 -13.9384 -12.6806 -12.6806 -12.4899 -12.4899 -10.9094 -10.9094 -10.5087 -10.5087 -8.3858 -8.3858 -7.7324 -7.7324 -6.4759 -6.4759 -6.1683 -6.1683 -5.7607 -5.7607 -5.6327 -5.6327 -5.5774 -5.5774 -5.4382 -5.4382 -5.2057 -5.2057 -5.1387 -5.1387 -5.0010 -5.0010 -4.9338 -4.9338 -4.6062 -4.6062 -3.3330 -3.3330 -2.4302 -2.4302 -1.8981 -1.8981 -1.6668 -1.6668 -1.5244 -1.5244 -1.2888 -1.2888 -1.0146 -1.0146 -0.7350 -0.7350 -0.6025 -0.6025 3.5934 3.5934 4.0902 4.0902 5.7246 5.7246 6.0808 6.0808 6.2728 6.2728 7.9467 7.9467 k =-0.0135-0.0042 0.0067 ( 7618 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9636 -19.9636 -19.6924 -19.6924 -14.1191 -14.1191 -13.9385 -13.9385 -12.6808 -12.6808 -12.4899 -12.4899 -10.9094 -10.9094 -10.5087 -10.5087 -8.3860 -8.3860 -7.7319 -7.7319 -6.4764 -6.4764 -6.1684 -6.1684 -5.7619 -5.7619 -5.6363 -5.6363 -5.5730 -5.5730 -5.4386 -5.4386 -5.2056 -5.2056 -5.1387 -5.1387 -5.0007 -5.0007 -4.9338 -4.9338 -4.6057 -4.6057 -3.3332 -3.3332 -2.4299 -2.4299 -1.8985 -1.8985 -1.6700 -1.6700 -1.5215 -1.5215 -1.2882 -1.2882 -1.0144 -1.0144 -0.7359 -0.7359 -0.6015 -0.6015 3.5936 3.5936 4.0898 4.0898 5.7260 5.7260 6.0777 6.0777 6.2766 6.2766 7.9464 7.9464 k =-0.0270-0.0085 0.0135 ( 7619 PWs) bands (ev): -22.6475 -22.6475 -22.3280 -22.3280 -19.9639 -19.9639 -19.6922 -19.6922 -14.1186 -14.1186 -13.9388 -13.9388 -12.6812 -12.6812 -12.4900 -12.4900 -10.9092 -10.9092 -10.5088 -10.5088 -8.3864 -8.3864 -7.7306 -7.7306 -6.4776 -6.4776 -6.1684 -6.1684 -5.7656 -5.7656 -5.6443 -5.6443 -5.5623 -5.5623 -5.4396 -5.4396 -5.2051 -5.2051 -5.1386 -5.1386 -4.9998 -4.9998 -4.9337 -4.9337 -4.6045 -4.6045 -3.3336 -3.3336 -2.4291 -2.4291 -1.8996 -1.8996 -1.6786 -1.6786 -1.5134 -1.5134 -1.2865 -1.2865 -1.0139 -1.0139 -0.7384 -0.7384 -0.5987 -0.5987 3.5943 3.5943 4.0887 4.0887 5.7304 5.7304 6.0692 6.0692 6.2874 6.2874 7.9455 7.9455 k =-0.0405-0.0127 0.0202 ( 7624 PWs) bands (ev): -22.6472 -22.6472 -22.3282 -22.3282 -19.9643 -19.9643 -19.6919 -19.6919 -14.1177 -14.1177 -13.9394 -13.9394 -12.6820 -12.6820 -12.4901 -12.4901 -10.9090 -10.9090 -10.5089 -10.5089 -8.3871 -8.3871 -7.7283 -7.7283 -6.4797 -6.4797 -6.1686 -6.1686 -5.7720 -5.7720 -5.6530 -5.6530 -5.5489 -5.5489 -5.4412 -5.4412 -5.2043 -5.2043 -5.1384 -5.1384 -4.9985 -4.9985 -4.9337 -4.9337 -4.6024 -4.6024 -3.3344 -3.3344 -2.4276 -2.4276 -1.9014 -1.9014 -1.6911 -1.6911 -1.5019 -1.5019 -1.2837 -1.2837 -1.0131 -1.0131 -0.7424 -0.7424 -0.5942 -0.5942 3.5955 3.5955 4.0869 4.0869 5.7374 5.7374 6.0572 6.0572 6.3033 6.3033 7.9440 7.9440 k =-0.0541-0.0169 0.0270 ( 7626 PWs) bands (ev): -22.6468 -22.6468 -22.3285 -22.3285 -19.9648 -19.9648 -19.6914 -19.6914 -14.1165 -14.1165 -13.9401 -13.9401 -12.6830 -12.6830 -12.4902 -12.4902 -10.9086 -10.9086 -10.5091 -10.5091 -8.3881 -8.3881 -7.7253 -7.7253 -6.4824 -6.4824 -6.1688 -6.1688 -5.7813 -5.7813 -5.6606 -5.6606 -5.5349 -5.5349 -5.4433 -5.4433 -5.2032 -5.2032 -5.1381 -5.1381 -4.9967 -4.9967 -4.9336 -4.9336 -4.5995 -4.5995 -3.3354 -3.3354 -2.4256 -2.4256 -1.9040 -1.9040 -1.7060 -1.7060 -1.4884 -1.4884 -1.2799 -1.2799 -1.0120 -1.0120 -0.7475 -0.7475 -0.5884 -0.5884 3.5971 3.5971 4.0843 4.0843 5.7468 5.7468 6.0439 6.0439 6.3225 6.3225 7.9418 7.9418 k =-0.0676-0.0212 0.0337 ( 7628 PWs) bands (ev): -22.6464 -22.6464 -22.3288 -22.3288 -19.9656 -19.9656 -19.6908 -19.6908 -14.1149 -14.1149 -13.9411 -13.9411 -12.6843 -12.6843 -12.4904 -12.4904 -10.9082 -10.9082 -10.5093 -10.5093 -8.3893 -8.3893 -7.7216 -7.7216 -6.4859 -6.4859 -6.1691 -6.1691 -5.7934 -5.7934 -5.6661 -5.6661 -5.5213 -5.5213 -5.4454 -5.4454 -5.2017 -5.2017 -5.1377 -5.1377 -4.9945 -4.9945 -4.9334 -4.9334 -4.5959 -4.5959 -3.3367 -3.3367 -2.4230 -2.4230 -1.9074 -1.9074 -1.7220 -1.7220 -1.4739 -1.4739 -1.2751 -1.2751 -1.0105 -1.0105 -0.7533 -0.7533 -0.5817 -0.5817 3.5991 3.5991 4.0811 4.0811 5.7582 5.7582 6.0310 6.0310 6.3436 6.3436 7.9386 7.9386 k =-0.0811-0.0254 0.0405 ( 7631 PWs) bands (ev): -22.6458 -22.6458 -22.3292 -22.3292 -19.9664 -19.9664 -19.6900 -19.6900 -14.1130 -14.1130 -13.9422 -13.9422 -12.6859 -12.6859 -12.4907 -12.4907 -10.9077 -10.9077 -10.5095 -10.5095 -8.3906 -8.3906 -7.7171 -7.7171 -6.4899 -6.4899 -6.1695 -6.1695 -5.8079 -5.8079 -5.6697 -5.6697 -5.5090 -5.5090 -5.4472 -5.4472 -5.1999 -5.1999 -5.1372 -5.1372 -4.9921 -4.9921 -4.9332 -4.9332 -4.5916 -4.5916 -3.3382 -3.3382 -2.4199 -2.4199 -1.9115 -1.9115 -1.7383 -1.7383 -1.4591 -1.4591 -1.2693 -1.2693 -1.0088 -1.0088 -0.7595 -0.7595 -0.5743 -0.5743 3.6016 3.6016 4.0772 4.0772 5.7707 5.7707 6.0203 6.0203 6.3656 6.3656 7.9343 7.9343 k =-0.0946-0.0296 0.0472 ( 7631 PWs) bands (ev): -22.6451 -22.6451 -22.3297 -22.3297 -19.9675 -19.9675 -19.6891 -19.6891 -14.1108 -14.1108 -13.9436 -13.9436 -12.6877 -12.6877 -12.4910 -12.4910 -10.9071 -10.9071 -10.5098 -10.5098 -8.3920 -8.3920 -7.7122 -7.7122 -6.4943 -6.4943 -6.1699 -6.1699 -5.8242 -5.8242 -5.6716 -5.6716 -5.4991 -5.4991 -5.4475 -5.4475 -5.1977 -5.1977 -5.1365 -5.1365 -4.9896 -4.9896 -4.9328 -4.9328 -4.5868 -4.5868 -3.3398 -3.3398 -2.4162 -2.4162 -1.9164 -1.9164 -1.7544 -1.7544 -1.4445 -1.4445 -1.2628 -1.2628 -1.0067 -1.0067 -0.7660 -0.7660 -0.5666 -0.5666 3.6045 3.6045 4.0726 4.0726 5.7832 5.7832 6.0134 6.0134 6.3879 6.3879 7.9284 7.9284 k =-0.1081-0.0339 0.0540 ( 7632 PWs) bands (ev): -22.6444 -22.6444 -22.3302 -22.3302 -19.9686 -19.9686 -19.6882 -19.6882 -14.1083 -14.1083 -13.9451 -13.9451 -12.6898 -12.6898 -12.4913 -12.4913 -10.9065 -10.9065 -10.5100 -10.5100 -8.3934 -8.3934 -7.7068 -7.7068 -6.4991 -6.4991 -6.1704 -6.1704 -5.8420 -5.8420 -5.6722 -5.6722 -5.4930 -5.4930 -5.4453 -5.4453 -5.1952 -5.1952 -5.1356 -5.1356 -4.9871 -4.9871 -4.9322 -4.9322 -4.5815 -4.5815 -3.3417 -3.3417 -2.4119 -2.4119 -1.9222 -1.9222 -1.7700 -1.7700 -1.4303 -1.4303 -1.2556 -1.2556 -1.0043 -1.0043 -0.7725 -0.7725 -0.5588 -0.5588 3.6079 3.6079 4.0673 4.0673 5.7944 5.7944 6.0122 6.0122 6.4099 6.4099 7.9206 7.9206 k =-0.1216-0.0381 0.0607 ( 7631 PWs) bands (ev): -22.6435 -22.6435 -22.3308 -22.3308 -19.9698 -19.9698 -19.6871 -19.6871 -14.1055 -14.1055 -13.9468 -13.9468 -12.6921 -12.6921 -12.4917 -12.4917 -10.9059 -10.9059 -10.5102 -10.5102 -8.3948 -8.3948 -7.7011 -7.7011 -6.5042 -6.5042 -6.1710 -6.1710 -5.8607 -5.8607 -5.6718 -5.6718 -5.4911 -5.4911 -5.4401 -5.4401 -5.1924 -5.1924 -5.1344 -5.1344 -4.9848 -4.9848 -4.9314 -4.9314 -4.5758 -4.5758 -3.3437 -3.3437 -2.4072 -2.4072 -1.9286 -1.9286 -1.7846 -1.7846 -1.4168 -1.4168 -1.2476 -1.2476 -1.0016 -1.0016 -0.7788 -0.7788 -0.5509 -0.5509 3.6117 3.6117 4.0615 4.0615 5.8029 5.8029 6.0182 6.0182 6.4312 6.4312 7.9107 7.9107 k =-0.1351-0.0423 0.0675 ( 7636 PWs) bands (ev): -22.6426 -22.6426 -22.3314 -22.3314 -19.9712 -19.9712 -19.6860 -19.6860 -14.1024 -14.1024 -13.9486 -13.9486 -12.6946 -12.6946 -12.4922 -12.4922 -10.9054 -10.9054 -10.5104 -10.5104 -8.3960 -8.3960 -7.6953 -7.6953 -6.5093 -6.5093 -6.1716 -6.1716 -5.8800 -5.8800 -5.6710 -5.6710 -5.4923 -5.4923 -5.4329 -5.4329 -5.1891 -5.1891 -5.1331 -5.1331 -4.9827 -4.9827 -4.9305 -4.9305 -4.5698 -4.5698 -3.3457 -3.3457 -2.4019 -2.4019 -1.9357 -1.9357 -1.7983 -1.7983 -1.4042 -1.4042 -1.2391 -1.2391 -0.9987 -0.9987 -0.7850 -0.7850 -0.5432 -0.5432 3.6159 3.6159 4.0551 4.0551 5.8077 5.8077 6.0326 6.0326 6.4516 6.4516 7.8984 7.8984 k =-0.1486-0.0465 0.0742 ( 7637 PWs) bands (ev): -22.6416 -22.6416 -22.3321 -22.3321 -19.9727 -19.9727 -19.6847 -19.6847 -14.0991 -14.0991 -13.9506 -13.9506 -12.6972 -12.6972 -12.4927 -12.4927 -10.9048 -10.9048 -10.5106 -10.5106 -8.3971 -8.3971 -7.6894 -7.6894 -6.5144 -6.5144 -6.1722 -6.1722 -5.8996 -5.8996 -5.6699 -5.6699 -5.4952 -5.4952 -5.4251 -5.4251 -5.1855 -5.1855 -5.1316 -5.1316 -4.9811 -4.9811 -4.9293 -4.9293 -4.5636 -4.5636 -3.3478 -3.3478 -2.3961 -2.3961 -1.9433 -1.9433 -1.8107 -1.8107 -1.3926 -1.3926 -1.2300 -1.2300 -0.9954 -0.9954 -0.7909 -0.7909 -0.5358 -0.5358 3.6204 3.6204 4.0481 4.0481 5.8092 5.8092 6.0552 6.0552 6.4708 6.4708 7.8839 7.8839 k =-0.1622-0.0508 0.0810 ( 7642 PWs) bands (ev): -22.6406 -22.6406 -22.3329 -22.3329 -19.9742 -19.9742 -19.6834 -19.6834 -14.0956 -14.0956 -13.9527 -13.9527 -12.7000 -12.7000 -12.4932 -12.4932 -10.9043 -10.9043 -10.5106 -10.5106 -8.3980 -8.3980 -7.6835 -7.6835 -6.5194 -6.5194 -6.1728 -6.1728 -5.9193 -5.9193 -5.6689 -5.6689 -5.4987 -5.4987 -5.4177 -5.4177 -5.1816 -5.1816 -5.1298 -5.1298 -4.9799 -4.9799 -4.9280 -4.9280 -4.5573 -4.5573 -3.3499 -3.3499 -2.3898 -2.3898 -1.9513 -1.9513 -1.8221 -1.8221 -1.3820 -1.3820 -1.2204 -1.2204 -0.9920 -0.9920 -0.7964 -0.7964 -0.5287 -0.5287 3.6254 3.6254 4.0406 4.0406 5.8084 5.8084 6.0851 6.0851 6.4886 6.4886 7.8674 7.8674 k =-0.1757-0.0550 0.0877 ( 7642 PWs) bands (ev): -22.6394 -22.6394 -22.3337 -22.3337 -19.9758 -19.9758 -19.6821 -19.6821 -14.0919 -14.0919 -13.9549 -13.9549 -12.7030 -12.7030 -12.4938 -12.4938 -10.9039 -10.9039 -10.5106 -10.5106 -8.3986 -8.3986 -7.6779 -7.6779 -6.5241 -6.5241 -6.1734 -6.1734 -5.9388 -5.9388 -5.6682 -5.6682 -5.5020 -5.5020 -5.4110 -5.4110 -5.1773 -5.1773 -5.1279 -5.1279 -4.9790 -4.9790 -4.9266 -4.9266 -4.5509 -4.5509 -3.3519 -3.3519 -2.3830 -2.3830 -1.9593 -1.9593 -1.8323 -1.8323 -1.3727 -1.3727 -1.2103 -1.2103 -0.9882 -0.9882 -0.8015 -0.8015 -0.5221 -0.5221 3.6307 3.6307 4.0327 4.0327 5.8062 5.8062 6.1211 6.1211 6.5050 6.5050 7.8491 7.8491 k =-0.1892-0.0592 0.0945 ( 7644 PWs) bands (ev): -22.6382 -22.6382 -22.3345 -22.3345 -19.9775 -19.9775 -19.6807 -19.6807 -14.0880 -14.0880 -13.9572 -13.9572 -12.7061 -12.7061 -12.4945 -12.4945 -10.9035 -10.9035 -10.5105 -10.5105 -8.3989 -8.3989 -7.6726 -7.6726 -6.5285 -6.5285 -6.1740 -6.1740 -5.9582 -5.9582 -5.6682 -5.6682 -5.5048 -5.5048 -5.4054 -5.4054 -5.1727 -5.1727 -5.1259 -5.1259 -4.9786 -4.9786 -4.9251 -4.9251 -4.5446 -4.5446 -3.3539 -3.3539 -2.3757 -2.3757 -1.9673 -1.9673 -1.8415 -1.8415 -1.3647 -1.3647 -1.1998 -1.1998 -0.9843 -0.9843 -0.8063 -0.8063 -0.5160 -0.5160 3.6363 3.6363 4.0244 4.0244 5.8039 5.8039 6.1621 6.1621 6.5198 6.5198 7.8294 7.8294 k =-0.2027-0.0635 0.1012 ( 7641 PWs) bands (ev): -22.6370 -22.6370 -22.3354 -22.3354 -19.9791 -19.9791 -19.6793 -19.6793 -14.0840 -14.0840 -13.9595 -13.9595 -12.7092 -12.7092 -12.4952 -12.4952 -10.9033 -10.9033 -10.5103 -10.5103 -8.3988 -8.3988 -7.6677 -7.6677 -6.5324 -6.5324 -6.1746 -6.1746 -5.9772 -5.9772 -5.6690 -5.6690 -5.5067 -5.5067 -5.4010 -5.4010 -5.1679 -5.1679 -5.1239 -5.1239 -4.9786 -4.9786 -4.9237 -4.9237 -4.5385 -4.5385 -3.3558 -3.3558 -2.3680 -2.3680 -1.9749 -1.9749 -1.8498 -1.8498 -1.3581 -1.3581 -1.1887 -1.1887 -0.9801 -0.9801 -0.8106 -0.8106 -0.5106 -0.5106 3.6422 3.6422 4.0157 4.0157 5.8022 5.8022 6.2071 6.2071 6.5332 6.5332 7.8086 7.8086 k =-0.2162-0.0677 0.1080 ( 7641 PWs) bands (ev): -22.6357 -22.6357 -22.3363 -22.3363 -19.9809 -19.9809 -19.6778 -19.6778 -14.0798 -14.0798 -13.9619 -13.9619 -12.7125 -12.7125 -12.4959 -12.4959 -10.9031 -10.9031 -10.5101 -10.5101 -8.3983 -8.3983 -7.6634 -7.6634 -6.5358 -6.5358 -6.1751 -6.1751 -5.9957 -5.9957 -5.6707 -5.6707 -5.5075 -5.5075 -5.3977 -5.3977 -5.1630 -5.1630 -5.1219 -5.1219 -4.9788 -4.9788 -4.9224 -4.9224 -4.5325 -4.5325 -3.3575 -3.3575 -2.3599 -2.3599 -1.9820 -1.9820 -1.8572 -1.8572 -1.3530 -1.3530 -1.1773 -1.1773 -0.9758 -0.9758 -0.8144 -0.8144 -0.5057 -0.5057 3.6485 3.6485 4.0067 4.0067 5.8016 5.8016 6.2551 6.2551 6.5454 6.5454 7.7870 7.7870 k =-0.2297-0.0719 0.1147 ( 7639 PWs) bands (ev): -22.6344 -22.6344 -22.3373 -22.3373 -19.9826 -19.9826 -19.6764 -19.6764 -14.0756 -14.0756 -13.9643 -13.9643 -12.7158 -12.7158 -12.4966 -12.4966 -10.9031 -10.9031 -10.5097 -10.5097 -8.3975 -8.3975 -7.6596 -7.6596 -6.5386 -6.5386 -6.1756 -6.1756 -6.0136 -6.0136 -5.6736 -5.6736 -5.5070 -5.5070 -5.3955 -5.3955 -5.1580 -5.1580 -5.1200 -5.1200 -4.9792 -4.9792 -4.9213 -4.9213 -4.5267 -4.5267 -3.3591 -3.3591 -2.3513 -2.3513 -1.9885 -1.9885 -1.8637 -1.8637 -1.3493 -1.3493 -1.1655 -1.1655 -0.9714 -0.9714 -0.8178 -0.8178 -0.5016 -0.5016 3.6550 3.6550 3.9975 3.9975 5.8024 5.8024 6.3052 6.3052 6.5569 6.5569 7.7647 7.7647 k =-0.2432-0.0762 0.1215 ( 7636 PWs) bands (ev): -22.6331 -22.6331 -22.3382 -22.3382 -19.9843 -19.9843 -19.6749 -19.6749 -14.0714 -14.0714 -13.9667 -13.9667 -12.7192 -12.7192 -12.4973 -12.4973 -10.9032 -10.9032 -10.5092 -10.5092 -8.3962 -8.3962 -7.6565 -7.6565 -6.5407 -6.5407 -6.1761 -6.1761 -6.0309 -6.0309 -5.6775 -5.6775 -5.5052 -5.5052 -5.3944 -5.3944 -5.1531 -5.1531 -5.1183 -5.1183 -4.9797 -4.9797 -4.9204 -4.9204 -4.5213 -4.5213 -3.3605 -3.3605 -2.3424 -2.3424 -1.9944 -1.9944 -1.8695 -1.8695 -1.3471 -1.3471 -1.1535 -1.1535 -0.9669 -0.9669 -0.8206 -0.8206 -0.4981 -0.4981 3.6617 3.6617 3.9880 3.9880 5.8050 5.8050 6.3556 6.3556 6.5690 6.5690 7.7420 7.7420 k =-0.2568-0.0804 0.1282 ( 7640 PWs) bands (ev): -22.6317 -22.6317 -22.3392 -22.3392 -19.9861 -19.9861 -19.6735 -19.6735 -14.0672 -14.0672 -13.9691 -13.9691 -12.7225 -12.7225 -12.4981 -12.4981 -10.9034 -10.9034 -10.5086 -10.5086 -8.3945 -8.3945 -7.6541 -7.6541 -6.5422 -6.5422 -6.1766 -6.1766 -6.0473 -6.0473 -5.6824 -5.6824 -5.5021 -5.5021 -5.3941 -5.3941 -5.1485 -5.1485 -5.1168 -5.1168 -4.9802 -4.9802 -4.9199 -4.9199 -4.5161 -4.5161 -3.3617 -3.3617 -2.3331 -2.3331 -1.9996 -1.9996 -1.8743 -1.8743 -1.3464 -1.3464 -1.1413 -1.1413 -0.9624 -0.9624 -0.8229 -0.8229 -0.4954 -0.4954 3.6686 3.6686 3.9784 3.9784 5.8095 5.8095 6.4036 6.4036 6.5840 6.5840 7.7192 7.7192 k =-0.2703-0.0846 0.1349 ( 7642 PWs) bands (ev): -22.6304 -22.6304 -22.3402 -22.3402 -19.9878 -19.9878 -19.6720 -19.6720 -14.0630 -14.0630 -13.9714 -13.9714 -12.7259 -12.7259 -12.4988 -12.4988 -10.9038 -10.9038 -10.5079 -10.5079 -8.3924 -8.3924 -7.6525 -7.6525 -6.5430 -6.5430 -6.1771 -6.1771 -6.0628 -6.0628 -5.6881 -5.6881 -5.4981 -5.4981 -5.3947 -5.3947 -5.1441 -5.1441 -5.1158 -5.1158 -4.9806 -4.9806 -4.9197 -4.9197 -4.5113 -4.5113 -3.3628 -3.3628 -2.3234 -2.3234 -2.0043 -2.0043 -1.8782 -1.8782 -1.3472 -1.3472 -1.1291 -1.1291 -0.9579 -0.9579 -0.8246 -0.8246 -0.4933 -0.4933 3.6757 3.6757 3.9687 3.9687 5.8160 5.8160 6.4442 6.4442 6.6066 6.6066 7.6963 7.6963 k =-0.2838-0.0889 0.1417 ( 7644 PWs) bands (ev): -22.6290 -22.6290 -22.3412 -22.3412 -19.9894 -19.9894 -19.6707 -19.6707 -14.0589 -14.0589 -13.9736 -13.9736 -12.7293 -12.7293 -12.4995 -12.4995 -10.9042 -10.9042 -10.5071 -10.5071 -8.3899 -8.3899 -7.6515 -7.6515 -6.5431 -6.5431 -6.1778 -6.1778 -6.0773 -6.0773 -5.6944 -5.6944 -5.4931 -5.4931 -5.3958 -5.3958 -5.1401 -5.1401 -5.1152 -5.1152 -4.9808 -4.9808 -4.9198 -4.9198 -4.5069 -4.5069 -3.3637 -3.3637 -2.3134 -2.3134 -2.0085 -2.0085 -1.8809 -1.8809 -1.3495 -1.3495 -1.1169 -1.1169 -0.9535 -0.9535 -0.8257 -0.8257 -0.4920 -0.4920 3.6829 3.6829 3.9590 3.9590 5.8246 5.8246 6.4720 6.4720 6.6421 6.6421 7.6737 7.6737 k =-0.2973-0.0931 0.1484 ( 7638 PWs) bands (ev): -22.6277 -22.6277 -22.3421 -22.3421 -19.9911 -19.9911 -19.6693 -19.6693 -14.0550 -14.0550 -13.9757 -13.9757 -12.7326 -12.7326 -12.5002 -12.5002 -10.9048 -10.9048 -10.5063 -10.5063 -8.3870 -8.3870 -7.6513 -7.6513 -6.5425 -6.5425 -6.1788 -6.1788 -6.0906 -6.0906 -5.7011 -5.7011 -5.4875 -5.4875 -5.3975 -5.3975 -5.1366 -5.1366 -5.1150 -5.1150 -4.9808 -4.9808 -4.9202 -4.9202 -4.5028 -4.5028 -3.3644 -3.3644 -2.3031 -2.3031 -2.0124 -2.0124 -1.8824 -1.8824 -1.3532 -1.3532 -1.1048 -1.1048 -0.9492 -0.9492 -0.8261 -0.8261 -0.4914 -0.4914 3.6902 3.6902 3.9493 3.9493 5.8354 5.8354 6.4858 6.4858 6.6914 6.6914 7.6515 7.6515 k =-0.3108-0.0973 0.1552 ( 7641 PWs) bands (ev): -22.6264 -22.6264 -22.3431 -22.3431 -19.9926 -19.9926 -19.6680 -19.6680 -14.0512 -14.0512 -13.9777 -13.9777 -12.7359 -12.7359 -12.5009 -12.5009 -10.9054 -10.9054 -10.5053 -10.5053 -8.3839 -8.3839 -7.6518 -7.6518 -6.5414 -6.5414 -6.1801 -6.1801 -6.1026 -6.1026 -5.7081 -5.7081 -5.4813 -5.4813 -5.3995 -5.3995 -5.1337 -5.1337 -5.1154 -5.1154 -4.9804 -4.9804 -4.9208 -4.9208 -4.4992 -4.4992 -3.3649 -3.3649 -2.2925 -2.2925 -2.0164 -2.0164 -1.8825 -1.8825 -1.3582 -1.3582 -1.0931 -1.0931 -0.9450 -0.9450 -0.8259 -0.8259 -0.4914 -0.4914 3.6976 3.6976 3.9397 3.9397 5.8482 5.8482 6.4892 6.4892 6.7507 6.7507 7.6298 7.6298 k =-0.3243-0.1016 0.1619 ( 7634 PWs) bands (ev): -22.6251 -22.6251 -22.3440 -22.3440 -19.9941 -19.9941 -19.6667 -19.6667 -14.0476 -14.0476 -13.9794 -13.9794 -12.7390 -12.7390 -12.5016 -12.5016 -10.9061 -10.9061 -10.5044 -10.5044 -8.3805 -8.3805 -7.6529 -7.6529 -6.5396 -6.5396 -6.1820 -6.1820 -6.1131 -6.1131 -5.7152 -5.7152 -5.4749 -5.4749 -5.4017 -5.4017 -5.1315 -5.1315 -5.1160 -5.1160 -4.9798 -4.9798 -4.9217 -4.9217 -4.4959 -4.4959 -3.3653 -3.3653 -2.2817 -2.2817 -2.0205 -2.0205 -1.8810 -1.8810 -1.3646 -1.3646 -1.0816 -1.0816 -0.9410 -0.9410 -0.8250 -0.8250 -0.4921 -0.4921 3.7050 3.7050 3.9301 3.9301 5.8631 5.8631 6.4858 6.4858 6.8161 6.8161 7.6088 7.6088 k =-0.3378-0.1058 0.1687 ( 7632 PWs) bands (ev): -22.6239 -22.6239 -22.3449 -22.3449 -19.9955 -19.9955 -19.6656 -19.6656 -14.0443 -14.0443 -13.9810 -13.9810 -12.7421 -12.7421 -12.5022 -12.5022 -10.9069 -10.9069 -10.5034 -10.5034 -8.3769 -8.3769 -7.6545 -7.6545 -6.5374 -6.5374 -6.1847 -6.1847 -6.1218 -6.1218 -5.7223 -5.7223 -5.4683 -5.4683 -5.4040 -5.4040 -5.1303 -5.1303 -5.1168 -5.1168 -4.9788 -4.9788 -4.9228 -4.9228 -4.4930 -4.4930 -3.3655 -3.3655 -2.2708 -2.2708 -2.0249 -2.0249 -1.8779 -1.8779 -1.3723 -1.3723 -1.0707 -1.0707 -0.9373 -0.9373 -0.8236 -0.8236 -0.4933 -0.4933 3.7124 3.7124 3.9208 3.9208 5.8800 5.8800 6.4778 6.4778 6.8855 6.8855 7.5888 7.5888 k =-0.3514-0.1100 0.1754 ( 7632 PWs) bands (ev): -22.6227 -22.6227 -22.3458 -22.3458 -19.9969 -19.9969 -19.6644 -19.6644 -14.0413 -14.0413 -13.9823 -13.9823 -12.7450 -12.7450 -12.5027 -12.5027 -10.9077 -10.9077 -10.5024 -10.5024 -8.3731 -8.3731 -7.6567 -7.6567 -6.5348 -6.5348 -6.1881 -6.1881 -6.1288 -6.1288 -5.7292 -5.7292 -5.4617 -5.4617 -5.4064 -5.4064 -5.1304 -5.1304 -5.1173 -5.1173 -4.9775 -4.9775 -4.9240 -4.9240 -4.4904 -4.4904 -3.3657 -3.3657 -2.2597 -2.2597 -2.0299 -2.0299 -1.8731 -1.8731 -1.3811 -1.3811 -1.0602 -1.0602 -0.9338 -0.9338 -0.8216 -0.8216 -0.4950 -0.4950 3.7197 3.7197 3.9117 3.9117 5.8989 5.8989 6.4661 6.4661 6.9574 6.9574 7.5699 7.5699 k =-0.3649-0.1143 0.1822 ( 7633 PWs) bands (ev): -22.6216 -22.6216 -22.3466 -22.3466 -19.9981 -19.9981 -19.6634 -19.6634 -14.0387 -14.0387 -13.9833 -13.9833 -12.7478 -12.7478 -12.5033 -12.5033 -10.9086 -10.9086 -10.5014 -10.5014 -8.3693 -8.3693 -7.6591 -7.6591 -6.5319 -6.5319 -6.1923 -6.1923 -6.1341 -6.1341 -5.7358 -5.7358 -5.4553 -5.4553 -5.4086 -5.4086 -5.1318 -5.1318 -5.1174 -5.1174 -4.9761 -4.9761 -4.9254 -4.9254 -4.4882 -4.4882 -3.3657 -3.3657 -2.2485 -2.2485 -2.0354 -2.0354 -1.8668 -1.8668 -1.3908 -1.3908 -1.0504 -1.0504 -0.9305 -0.9305 -0.8192 -0.8192 -0.4971 -0.4971 3.7270 3.7270 3.9028 3.9028 5.9195 5.9195 6.4514 6.4514 7.0310 7.0310 7.5524 7.5524 k =-0.3784-0.1185 0.1889 ( 7635 PWs) bands (ev): -22.6206 -22.6206 -22.3473 -22.3473 -19.9993 -19.9993 -19.6625 -19.6625 -14.0364 -14.0364 -13.9841 -13.9841 -12.7503 -12.7503 -12.5038 -12.5038 -10.9094 -10.9094 -10.5004 -10.5004 -8.3655 -8.3655 -7.6619 -7.6619 -6.5289 -6.5289 -6.1970 -6.1970 -6.1379 -6.1379 -5.7421 -5.7421 -5.4492 -5.4492 -5.4106 -5.4106 -5.1343 -5.1343 -5.1170 -5.1170 -4.9745 -4.9745 -4.9267 -4.9267 -4.4863 -4.4863 -3.3656 -3.3656 -2.2374 -2.2374 -2.0414 -2.0414 -1.8592 -1.8592 -1.4014 -1.4014 -1.0412 -1.0412 -0.9275 -0.9275 -0.8164 -0.8164 -0.4994 -0.4994 3.7340 3.7340 3.8943 3.8943 5.9419 5.9419 6.4341 6.4341 7.1055 7.1055 7.5365 7.5365 k =-0.3919-0.1227 0.1957 ( 7634 PWs) bands (ev): -22.6196 -22.6196 -22.3480 -22.3480 -20.0004 -20.0004 -19.6616 -19.6616 -14.0345 -14.0345 -13.9847 -13.9847 -12.7527 -12.7527 -12.5042 -12.5042 -10.9102 -10.9102 -10.4995 -10.4995 -8.3619 -8.3619 -7.6648 -7.6648 -6.5257 -6.5257 -6.2019 -6.2019 -6.1406 -6.1406 -5.7479 -5.7479 -5.4434 -5.4434 -5.4124 -5.4124 -5.1375 -5.1375 -5.1165 -5.1165 -4.9729 -4.9729 -4.9281 -4.9281 -4.4846 -4.4846 -3.3656 -3.3656 -2.2262 -2.2262 -2.0480 -2.0480 -1.8504 -1.8504 -1.4126 -1.4126 -1.0328 -1.0328 -0.9248 -0.9248 -0.8135 -0.8135 -0.5020 -0.5020 3.7409 3.7409 3.8862 3.8862 5.9657 5.9657 6.4147 6.4147 7.1800 7.1800 7.5225 7.5225 k =-0.4054-0.1270 0.2024 ( 7640 PWs) bands (ev): -22.6188 -22.6188 -22.3487 -22.3487 -20.0013 -20.0013 -19.6608 -19.6608 -14.0329 -14.0329 -13.9850 -13.9850 -12.7549 -12.7549 -12.5046 -12.5046 -10.9110 -10.9110 -10.4987 -10.4987 -8.3583 -8.3583 -7.6677 -7.6677 -6.5226 -6.5226 -6.2067 -6.2067 -6.1425 -6.1425 -5.7532 -5.7532 -5.4382 -5.4382 -5.4140 -5.4140 -5.1409 -5.1409 -5.1160 -5.1160 -4.9712 -4.9712 -4.9294 -4.9294 -4.4833 -4.4833 -3.3654 -3.3654 -2.2153 -2.2153 -2.0551 -2.0551 -1.8409 -1.8409 -1.4241 -1.4241 -1.0251 -1.0251 -0.9224 -0.9224 -0.8105 -0.8105 -0.5047 -0.5047 3.7474 3.7474 3.8785 3.8785 5.9910 5.9910 6.3932 6.3932 7.2534 7.2534 7.5113 7.5113 k =-0.4189-0.1312 0.2092 ( 7645 PWs) bands (ev): -22.6180 -22.6180 -22.3493 -22.3493 -20.0021 -20.0021 -19.6601 -19.6601 -14.0317 -14.0317 -13.9851 -13.9851 -12.7568 -12.7568 -12.5049 -12.5049 -10.9117 -10.9117 -10.4979 -10.4979 -8.3551 -8.3551 -7.6705 -7.6705 -6.5197 -6.5197 -6.2111 -6.2111 -6.1438 -6.1438 -5.7579 -5.7579 -5.4335 -5.4335 -5.4152 -5.4152 -5.1445 -5.1445 -5.1155 -5.1155 -4.9697 -4.9697 -4.9307 -4.9307 -4.4822 -4.4822 -3.3652 -3.3652 -2.2045 -2.2045 -2.0624 -2.0624 -1.8311 -1.8311 -1.4356 -1.4356 -1.0183 -1.0183 -0.9202 -0.9202 -0.8075 -0.8075 -0.5073 -0.5073 3.7537 3.7537 3.8713 3.8713 6.0173 6.0173 6.3701 6.3701 7.3233 7.3233 7.5045 7.5045 k =-0.4324-0.1354 0.2159 ( 7641 PWs) bands (ev): -22.6173 -22.6173 -22.3497 -22.3497 -20.0028 -20.0028 -19.6596 -19.6596 -14.0308 -14.0308 -13.9851 -13.9851 -12.7584 -12.7584 -12.5052 -12.5052 -10.9123 -10.9123 -10.4972 -10.4972 -8.3522 -8.3522 -7.6730 -7.6730 -6.5170 -6.5170 -6.2151 -6.2151 -6.1447 -6.1447 -5.7620 -5.7620 -5.4295 -5.4295 -5.4162 -5.4162 -5.1478 -5.1478 -5.1152 -5.1152 -4.9683 -4.9683 -4.9318 -4.9318 -4.4813 -4.4813 -3.3651 -3.3651 -2.1941 -2.1941 -2.0700 -2.0700 -1.8213 -1.8213 -1.4466 -1.4466 -1.0124 -1.0124 -0.9184 -0.9184 -0.8048 -0.8048 -0.5097 -0.5097 3.7595 3.7595 3.8647 3.8647 6.0445 6.0445 6.3456 6.3456 7.3839 7.3839 7.5068 7.5068 k =-0.4459-0.1396 0.2227 ( 7635 PWs) bands (ev): -22.6168 -22.6168 -22.3501 -22.3501 -20.0034 -20.0034 -19.6591 -19.6591 -14.0301 -14.0301 -13.9850 -13.9850 -12.7598 -12.7598 -12.5054 -12.5054 -10.9128 -10.9128 -10.4966 -10.4966 -8.3497 -8.3497 -7.6753 -7.6753 -6.5147 -6.5147 -6.2184 -6.2184 -6.1453 -6.1453 -5.7654 -5.7654 -5.4261 -5.4261 -5.4170 -5.4170 -5.1508 -5.1508 -5.1149 -5.1149 -4.9670 -4.9670 -4.9328 -4.9328 -4.4806 -4.4806 -3.3649 -3.3649 -2.1843 -2.1843 -2.0775 -2.0775 -1.8121 -1.8121 -1.4567 -1.4567 -1.0075 -1.0075 -0.9169 -0.9169 -0.8024 -0.8024 -0.5119 -0.5119 3.7647 3.7647 3.8588 3.8588 6.0723 6.0723 6.3200 6.3200 7.4224 7.4224 7.5294 7.5294 k =-0.4595-0.1439 0.2294 ( 7635 PWs) bands (ev): -22.6164 -22.6164 -22.3505 -22.3505 -20.0039 -20.0039 -19.6587 -19.6587 -14.0296 -14.0296 -13.9848 -13.9848 -12.7609 -12.7609 -12.5056 -12.5056 -10.9133 -10.9133 -10.4962 -10.4962 -8.3477 -8.3477 -7.6772 -7.6772 -6.5128 -6.5128 -6.2210 -6.2210 -6.1457 -6.1457 -5.7681 -5.7681 -5.4235 -5.4235 -5.4175 -5.4175 -5.1532 -5.1532 -5.1148 -5.1148 -4.9660 -4.9660 -4.9336 -4.9336 -4.4800 -4.4800 -3.3648 -3.3648 -2.1754 -2.1754 -2.0847 -2.0847 -1.8042 -1.8042 -1.4654 -1.4654 -1.0036 -1.0036 -0.9157 -0.9157 -0.8004 -0.8004 -0.5138 -0.5138 3.7692 3.7692 3.8539 3.8539 6.1000 6.1000 6.2939 6.2939 7.4356 7.4356 7.5727 7.5727 k =-0.4730-0.1481 0.2362 ( 7638 PWs) bands (ev): -22.6161 -22.6161 -22.3507 -22.3507 -20.0042 -20.0042 -19.6584 -19.6584 -14.0293 -14.0293 -13.9847 -13.9847 -12.7616 -12.7616 -12.5057 -12.5057 -10.9136 -10.9136 -10.4958 -10.4958 -8.3462 -8.3462 -7.6786 -7.6786 -6.5114 -6.5114 -6.2229 -6.2229 -6.1460 -6.1460 -5.7700 -5.7700 -5.4216 -5.4216 -5.4179 -5.4179 -5.1551 -5.1551 -5.1146 -5.1146 -4.9653 -4.9653 -4.9341 -4.9341 -4.4797 -4.4797 -3.3647 -3.3647 -2.1679 -2.1679 -2.0909 -2.0909 -1.7980 -1.7980 -1.4721 -1.4721 -1.0008 -1.0008 -0.9148 -0.9148 -0.7989 -0.7989 -0.5151 -0.5151 3.7726 3.7726 3.8500 3.8500 6.1267 6.1267 6.2684 6.2684 7.4381 7.4381 7.6176 7.6176 k =-0.4865-0.1523 0.2429 ( 7631 PWs) bands (ev): -22.6159 -22.6159 -22.3508 -22.3508 -20.0044 -20.0044 -19.6583 -19.6583 -14.0291 -14.0291 -13.9845 -13.9845 -12.7621 -12.7621 -12.5058 -12.5058 -10.9138 -10.9138 -10.4956 -10.4956 -8.3453 -8.3453 -7.6794 -7.6794 -6.5105 -6.5105 -6.2241 -6.2241 -6.1461 -6.1461 -5.7712 -5.7712 -5.4203 -5.4203 -5.4182 -5.4182 -5.1562 -5.1562 -5.1146 -5.1146 -4.9648 -4.9648 -4.9345 -4.9345 -4.4795 -4.4795 -3.3646 -3.3646 -2.1627 -2.1627 -2.0953 -2.0953 -1.7940 -1.7940 -1.4763 -1.4763 -0.9991 -0.9991 -0.9143 -0.9143 -0.7980 -0.7980 -0.5160 -0.5160 3.7749 3.7749 3.8476 3.8476 6.1496 6.1496 6.2463 6.2463 7.4380 7.4380 7.6498 7.6498 k =-0.5000-0.1566 0.2497 ( 7636 PWs) bands (ev): -22.6158 -22.6158 -22.3509 -22.3509 -20.0045 -20.0045 -19.6582 -19.6582 -14.0291 -14.0291 -13.9845 -13.9845 -12.7623 -12.7623 -12.5058 -12.5058 -10.9138 -10.9138 -10.4956 -10.4956 -8.3450 -8.3450 -7.6797 -7.6797 -6.5102 -6.5102 -6.2245 -6.2245 -6.1462 -6.1462 -5.7716 -5.7716 -5.4199 -5.4199 -5.4183 -5.4183 -5.1566 -5.1566 -5.1146 -5.1146 -4.9647 -4.9647 -4.9346 -4.9346 -4.4794 -4.4794 -3.3646 -3.3646 -2.1608 -2.1608 -2.0970 -2.0970 -1.7926 -1.7926 -1.4778 -1.4778 -0.9985 -0.9985 -0.9141 -0.9141 -0.7977 -0.7977 -0.5163 -0.5163 3.7757 3.7757 3.8467 3.8467 6.1602 6.1602 6.2359 6.2359 7.4379 7.4379 7.6614 7.6614 k =-0.5000-0.5360 0.0576 ( 7602 PWs) bands (ev): -22.6144 -22.6144 -22.3526 -22.3526 -20.0037 -20.0037 -19.6581 -19.6581 -14.0391 -14.0391 -13.9757 -13.9757 -12.7717 -12.7717 -12.5108 -12.5108 -10.9162 -10.9162 -10.4558 -10.4558 -8.3746 -8.3746 -7.7047 -7.7047 -6.5185 -6.5185 -6.0944 -6.0944 -5.9936 -5.9936 -5.7124 -5.7124 -5.6189 -5.6189 -5.4786 -5.4786 -5.3113 -5.3113 -5.0663 -5.0663 -4.9711 -4.9711 -4.8052 -4.8052 -4.6145 -4.6145 -3.3668 -3.3668 -2.1967 -2.1967 -2.0496 -2.0496 -1.7436 -1.7436 -1.3067 -1.3067 -1.0078 -1.0078 -0.8996 -0.8996 -0.8195 -0.8195 -0.6403 -0.6403 3.6271 3.6271 3.8995 3.8995 5.8349 5.8349 6.4731 6.4731 7.8224 7.8224 7.8753 7.8753 k =-0.4894-0.5246 0.0563 ( 7611 PWs) bands (ev): -22.6144 -22.6144 -22.3525 -22.3525 -20.0037 -20.0037 -19.6582 -19.6582 -14.0391 -14.0391 -13.9758 -13.9758 -12.7708 -12.7708 -12.5114 -12.5114 -10.9159 -10.9159 -10.4564 -10.4564 -8.3746 -8.3746 -7.7045 -7.7045 -6.5183 -6.5183 -6.0943 -6.0943 -5.9937 -5.9937 -5.7125 -5.7125 -5.6187 -5.6187 -5.4785 -5.4785 -5.3112 -5.3112 -5.0666 -5.0666 -4.9710 -4.9710 -4.8053 -4.8053 -4.6138 -4.6138 -3.3670 -3.3670 -2.1968 -2.1968 -2.0499 -2.0499 -1.7426 -1.7426 -1.3080 -1.3080 -1.0079 -1.0079 -0.8999 -0.8999 -0.8189 -0.8189 -0.6408 -0.6408 3.6267 3.6267 3.9005 3.9005 5.8369 5.8369 6.4712 6.4712 7.8141 7.8141 7.8772 7.8772 k =-0.4787-0.5132 0.0551 ( 7615 PWs) bands (ev): -22.6146 -22.6146 -22.3525 -22.3525 -20.0036 -20.0036 -19.6582 -19.6582 -14.0392 -14.0392 -13.9763 -13.9763 -12.7682 -12.7682 -12.5133 -12.5133 -10.9147 -10.9147 -10.4583 -10.4583 -8.3747 -8.3747 -7.7040 -7.7040 -6.5178 -6.5178 -6.0943 -6.0943 -5.9938 -5.9938 -5.7127 -5.7127 -5.6182 -5.6182 -5.4783 -5.4783 -5.3111 -5.3111 -5.0676 -5.0676 -4.9708 -4.9708 -4.8055 -4.8055 -4.6119 -4.6119 -3.3678 -3.3678 -2.1970 -2.1970 -2.0506 -2.0506 -1.7397 -1.7397 -1.3119 -1.3119 -1.0085 -1.0085 -0.9008 -0.9008 -0.8171 -0.8171 -0.6422 -0.6422 3.6254 3.6254 3.9035 3.9035 5.8428 5.8428 6.4654 6.4654 7.7920 7.7920 7.8813 7.8813 k =-0.4681-0.5018 0.0539 ( 7611 PWs) bands (ev): -22.6147 -22.6147 -22.3523 -22.3523 -20.0034 -20.0034 -19.6584 -19.6584 -14.0394 -14.0394 -13.9769 -13.9769 -12.7639 -12.7639 -12.5163 -12.5163 -10.9129 -10.9129 -10.4612 -10.4612 -8.3749 -8.3749 -7.7032 -7.7032 -6.5170 -6.5170 -6.0943 -6.0943 -5.9940 -5.9940 -5.7131 -5.7131 -5.6173 -5.6173 -5.4780 -5.4780 -5.3108 -5.3108 -5.0692 -5.0692 -4.9705 -4.9705 -4.8059 -4.8059 -4.6088 -4.6088 -3.3691 -3.3691 -2.1974 -2.1974 -2.0518 -2.0518 -1.7348 -1.7348 -1.3184 -1.3184 -1.0095 -1.0095 -0.9022 -0.9022 -0.8141 -0.8141 -0.6445 -0.6445 3.6235 3.6235 3.9084 3.9084 5.8526 5.8526 6.4558 6.4558 7.7600 7.7600 7.8857 7.8857 k =-0.4574-0.4904 0.0527 ( 7609 PWs) bands (ev): -22.6150 -22.6150 -22.3521 -22.3521 -20.0031 -20.0031 -19.6586 -19.6586 -14.0397 -14.0397 -13.9777 -13.9777 -12.7581 -12.7581 -12.5203 -12.5203 -10.9105 -10.9105 -10.4652 -10.4652 -8.3750 -8.3750 -7.7022 -7.7022 -6.5158 -6.5158 -6.0943 -6.0943 -5.9943 -5.9943 -5.7138 -5.7138 -5.6161 -5.6161 -5.4776 -5.4776 -5.3100 -5.3100 -5.0713 -5.0713 -4.9701 -4.9701 -4.8064 -4.8064 -4.6046 -4.6046 -3.3708 -3.3708 -2.1979 -2.1979 -2.0533 -2.0533 -1.7280 -1.7280 -1.3272 -1.3272 -1.0108 -1.0108 -0.9043 -0.9043 -0.8099 -0.8099 -0.6477 -0.6477 3.6208 3.6208 3.9149 3.9149 5.8661 5.8661 6.4426 6.4426 7.7203 7.7203 7.8901 7.8901 k =-0.4468-0.4790 0.0514 ( 7607 PWs) bands (ev): -22.6153 -22.6153 -22.3519 -22.3519 -20.0028 -20.0028 -19.6588 -19.6588 -14.0401 -14.0401 -13.9786 -13.9786 -12.7509 -12.7509 -12.5252 -12.5252 -10.9077 -10.9077 -10.4701 -10.4701 -8.3752 -8.3752 -7.7010 -7.7010 -6.5144 -6.5144 -6.0944 -6.0944 -5.9946 -5.9946 -5.7148 -5.7148 -5.6146 -5.6146 -5.4771 -5.4771 -5.3087 -5.3087 -5.0740 -5.0740 -4.9696 -4.9696 -4.8072 -4.8072 -4.5996 -4.5996 -3.3728 -3.3728 -2.1988 -2.1988 -2.0553 -2.0553 -1.7196 -1.7196 -1.3383 -1.3383 -1.0126 -1.0126 -0.9071 -0.9071 -0.8045 -0.8045 -0.6516 -0.6516 3.6177 3.6177 3.9231 3.9231 5.8831 5.8831 6.4259 6.4259 7.6744 7.6744 7.8942 7.8942 k =-0.4362-0.4676 0.0502 ( 7607 PWs) bands (ev): -22.6157 -22.6157 -22.3516 -22.3516 -20.0025 -20.0025 -19.6591 -19.6591 -14.0407 -14.0407 -13.9795 -13.9795 -12.7425 -12.7425 -12.5306 -12.5306 -10.9047 -10.9047 -10.4756 -10.4756 -8.3753 -8.3753 -7.6996 -7.6996 -6.5128 -6.5128 -6.0947 -6.0947 -5.9948 -5.9948 -5.7164 -5.7164 -5.6127 -5.6127 -5.4762 -5.4762 -5.3066 -5.3066 -5.0772 -5.0772 -4.9689 -4.9689 -4.8081 -4.8081 -4.5940 -4.5940 -3.3752 -3.3752 -2.1999 -2.1999 -2.0574 -2.0574 -1.7096 -1.7096 -1.3515 -1.3515 -1.0147 -1.0147 -0.9105 -0.9105 -0.7981 -0.7981 -0.6562 -0.6562 3.6143 3.6143 3.9326 3.9326 5.9034 5.9034 6.4061 6.4061 7.6233 7.6233 7.8966 7.8966 k =-0.4255-0.4562 0.0490 ( 7608 PWs) bands (ev): -22.6161 -22.6161 -22.3513 -22.3513 -20.0020 -20.0020 -19.6595 -19.6595 -14.0416 -14.0416 -13.9804 -13.9804 -12.7333 -12.7333 -12.5364 -12.5364 -10.9018 -10.9018 -10.4816 -10.4816 -8.3753 -8.3753 -7.6982 -7.6982 -6.5109 -6.5109 -6.0952 -6.0952 -5.9950 -5.9950 -5.7186 -5.7186 -5.6104 -5.6104 -5.4750 -5.4750 -5.3037 -5.3037 -5.0808 -5.0808 -4.9681 -4.9681 -4.8092 -4.8092 -4.5879 -4.5879 -3.3778 -3.3778 -2.2013 -2.2013 -2.0597 -2.0597 -1.6982 -1.6982 -1.3665 -1.3665 -1.0173 -1.0173 -0.9146 -0.9146 -0.7908 -0.7908 -0.6613 -0.6613 3.6106 3.6106 3.9432 3.9432 5.9268 5.9268 6.3833 6.3833 7.5680 7.5680 7.8935 7.8935 k =-0.4149-0.4448 0.0478 ( 7614 PWs) bands (ev): -22.6166 -22.6166 -22.3510 -22.3510 -20.0015 -20.0015 -19.6599 -19.6599 -14.0428 -14.0428 -13.9811 -13.9811 -12.7237 -12.7237 -12.5422 -12.5422 -10.8991 -10.8991 -10.4878 -10.4878 -8.3752 -8.3752 -7.6968 -7.6968 -6.5089 -6.5089 -6.0960 -6.0960 -5.9949 -5.9949 -5.7215 -5.7215 -5.6076 -5.6076 -5.4732 -5.4732 -5.2999 -5.2999 -5.0848 -5.0848 -4.9671 -4.9671 -4.8106 -4.8106 -4.5817 -4.5817 -3.3804 -3.3804 -2.2032 -2.2032 -2.0621 -2.0621 -1.6857 -1.6857 -1.3830 -1.3830 -1.0203 -1.0203 -0.9193 -0.9193 -0.7829 -0.7829 -0.6666 -0.6666 3.6068 3.6068 3.9547 3.9547 5.9528 5.9528 6.3581 6.3581 7.5091 7.5091 7.8793 7.8793 k =-0.4043-0.4334 0.0465 ( 7615 PWs) bands (ev): -22.6172 -22.6172 -22.3505 -22.3505 -20.0010 -20.0010 -19.6604 -19.6604 -14.0442 -14.0442 -13.9815 -13.9815 -12.7141 -12.7141 -12.5473 -12.5473 -10.8971 -10.8971 -10.4940 -10.4940 -8.3749 -8.3749 -7.6955 -7.6955 -6.5069 -6.5069 -6.0971 -6.0971 -5.9947 -5.9947 -5.7253 -5.7253 -5.6044 -5.6044 -5.4707 -5.4707 -5.2951 -5.2951 -5.0891 -5.0891 -4.9660 -4.9660 -4.8122 -4.8122 -4.5754 -4.5754 -3.3831 -3.3831 -2.2057 -2.2057 -2.0644 -2.0644 -1.6724 -1.6724 -1.4006 -1.4006 -1.0236 -1.0236 -0.9247 -0.9247 -0.7747 -0.7747 -0.6718 -0.6718 3.6031 3.6031 3.9668 3.9668 5.9809 5.9809 6.3307 6.3307 7.4475 7.4475 7.8552 7.8552 k =-0.3936-0.4219 0.0453 ( 7622 PWs) bands (ev): -22.6178 -22.6178 -22.3501 -22.3501 -20.0004 -20.0004 -19.6609 -19.6609 -14.0460 -14.0460 -13.9818 -13.9818 -12.7052 -12.7052 -12.5512 -12.5512 -10.8958 -10.8958 -10.4998 -10.4998 -8.3745 -8.3745 -7.6942 -7.6942 -6.5049 -6.5049 -6.0986 -6.0986 -5.9942 -5.9942 -5.7299 -5.7299 -5.6007 -5.6007 -5.4674 -5.4674 -5.2896 -5.2896 -5.0936 -5.0936 -4.9647 -4.9647 -4.8141 -4.8141 -4.5694 -4.5694 -3.3858 -3.3858 -2.2087 -2.2087 -2.0665 -2.0665 -1.6588 -1.6588 -1.4189 -1.4189 -1.0274 -1.0274 -0.9307 -0.9307 -0.7667 -0.7667 -0.6763 -0.6763 3.5996 3.5996 3.9794 3.9794 6.0106 6.0106 6.3020 6.3020 7.3838 7.3838 7.8264 7.8264 k =-0.3830-0.4105 0.0441 ( 7619 PWs) bands (ev): -22.6185 -22.6185 -22.3496 -22.3496 -19.9997 -19.9997 -19.6615 -19.6615 -14.0480 -14.0480 -13.9818 -13.9818 -12.6977 -12.6977 -12.5533 -12.5533 -10.8955 -10.8955 -10.5050 -10.5050 -8.3740 -8.3740 -7.6930 -7.6930 -6.5029 -6.5029 -6.1006 -6.1006 -5.9933 -5.9933 -5.7353 -5.7353 -5.5963 -5.5963 -5.4632 -5.4632 -5.2834 -5.2834 -5.0983 -5.0983 -4.9633 -4.9633 -4.8162 -4.8162 -4.5636 -4.5636 -3.3883 -3.3883 -2.2123 -2.2123 -2.0682 -2.0682 -1.6455 -1.6455 -1.4370 -1.4370 -1.0316 -1.0316 -0.9373 -0.9373 -0.7598 -0.7598 -0.6793 -0.6793 3.5964 3.5964 3.9922 3.9922 6.0409 6.0409 6.2727 6.2727 7.3186 7.3186 7.7962 7.7962 k =-0.3723-0.3991 0.0429 ( 7619 PWs) bands (ev): -22.6192 -22.6192 -22.3490 -22.3490 -19.9989 -19.9989 -19.6622 -19.6622 -14.0502 -14.0502 -13.9816 -13.9816 -12.6924 -12.6924 -12.5528 -12.5528 -10.8964 -10.8964 -10.5095 -10.5095 -8.3734 -8.3734 -7.6918 -7.6918 -6.5012 -6.5012 -6.1030 -6.1030 -5.9922 -5.9922 -5.7413 -5.7413 -5.5914 -5.5914 -5.4583 -5.4583 -5.2767 -5.2767 -5.1032 -5.1032 -4.9618 -4.9618 -4.8186 -4.8186 -4.5582 -4.5582 -3.3905 -3.3905 -2.2167 -2.2167 -2.0696 -2.0696 -1.6334 -1.6334 -1.4540 -1.4540 -1.0361 -1.0361 -0.9443 -0.9443 -0.7552 -0.7552 -0.6797 -0.6797 3.5935 3.5935 4.0050 4.0050 6.0698 6.0698 6.2449 6.2449 7.2524 7.2524 7.7659 7.7659 k =-0.3617-0.3877 0.0416 ( 7615 PWs) bands (ev): -22.6200 -22.6200 -22.3485 -22.3485 -19.9981 -19.9981 -19.6628 -19.6628 -14.0526 -14.0526 -13.9812 -13.9812 -12.6895 -12.6895 -12.5493 -12.5493 -10.8985 -10.8985 -10.5131 -10.5131 -8.3726 -8.3726 -7.6907 -7.6907 -6.4998 -6.4998 -6.1059 -6.1059 -5.9906 -5.9906 -5.7477 -5.7477 -5.5858 -5.5858 -5.4526 -5.4526 -5.2696 -5.2696 -5.1080 -5.1080 -4.9601 -4.9601 -4.8213 -4.8213 -4.5534 -4.5534 -3.3924 -3.3924 -2.2219 -2.2219 -2.0704 -2.0704 -1.6239 -1.6239 -1.4684 -1.4684 -1.0411 -1.0411 -0.9517 -0.9517 -0.7537 -0.7537 -0.6766 -0.6766 3.5911 3.5911 4.0176 4.0176 6.0930 6.0930 6.2228 6.2228 7.1857 7.1857 7.7368 7.7368 k =-0.3511-0.3763 0.0404 ( 7613 PWs) bands (ev): -22.6209 -22.6209 -22.3478 -22.3478 -19.9972 -19.9972 -19.6636 -19.6636 -14.0550 -14.0550 -13.9808 -13.9808 -12.6892 -12.6892 -12.5431 -12.5431 -10.9018 -10.9018 -10.5157 -10.5157 -8.3719 -8.3719 -7.6895 -7.6895 -6.4987 -6.4987 -6.1091 -6.1091 -5.9887 -5.9887 -5.7541 -5.7541 -5.5797 -5.5797 -5.4465 -5.4465 -5.2623 -5.2623 -5.1129 -5.1129 -4.9584 -4.9584 -4.8242 -4.8242 -4.5490 -4.5490 -3.3939 -3.3939 -2.2278 -2.2278 -2.0707 -2.0707 -1.6192 -1.6192 -1.4782 -1.4782 -1.0465 -1.0465 -0.9595 -0.9595 -0.7553 -0.7553 -0.6701 -0.6701 3.5891 3.5891 4.0298 4.0298 6.1011 6.1011 6.2157 6.2157 7.1188 7.1188 7.7093 7.7093 k =-0.3404-0.3649 0.0392 ( 7616 PWs) bands (ev): -22.6218 -22.6218 -22.3472 -22.3472 -19.9963 -19.9963 -19.6644 -19.6644 -14.0574 -14.0574 -13.9802 -13.9802 -12.6910 -12.6910 -12.5344 -12.5344 -10.9062 -10.9062 -10.5174 -10.5174 -8.3713 -8.3713 -7.6882 -7.6882 -6.4981 -6.4981 -6.1128 -6.1128 -5.9864 -5.9864 -5.7603 -5.7603 -5.5731 -5.5731 -5.4402 -5.4402 -5.2549 -5.2549 -5.1176 -5.1176 -4.9567 -4.9567 -4.8275 -4.8275 -4.5452 -4.5452 -3.3950 -3.3950 -2.2344 -2.2344 -2.0703 -2.0703 -1.6210 -1.6210 -1.4813 -1.4813 -1.0524 -1.0524 -0.9674 -0.9674 -0.7595 -0.7595 -0.6609 -0.6609 3.5878 3.5878 4.0413 4.0413 6.0884 6.0884 6.2294 6.2294 7.0522 7.0522 7.6839 7.6839 k =-0.3298-0.3535 0.0380 ( 7609 PWs) bands (ev): -22.6227 -22.6227 -22.3465 -22.3465 -19.9953 -19.9953 -19.6652 -19.6652 -14.0598 -14.0598 -13.9797 -13.9797 -12.6942 -12.6942 -12.5241 -12.5241 -10.9115 -10.9115 -10.5182 -10.5182 -8.3708 -8.3708 -7.6866 -7.6866 -6.4981 -6.4981 -6.1168 -6.1168 -5.9838 -5.9838 -5.7660 -5.7660 -5.5661 -5.5661 -5.4339 -5.4339 -5.2476 -5.2476 -5.1221 -5.1221 -4.9549 -4.9549 -4.8309 -4.8309 -4.5418 -4.5418 -3.3957 -3.3957 -2.2418 -2.2418 -2.0694 -2.0694 -1.6294 -1.6294 -1.4776 -1.4776 -1.0588 -1.0588 -0.9753 -0.9753 -0.7651 -0.7651 -0.6499 -0.6499 3.5870 3.5870 4.0521 4.0521 6.0632 6.0632 6.2553 6.2553 6.9860 6.9860 7.6611 7.6611 k =-0.3191-0.3421 0.0367 ( 7607 PWs) bands (ev): -22.6236 -22.6236 -22.3458 -22.3458 -19.9943 -19.9943 -19.6661 -19.6661 -14.0620 -14.0620 -13.9793 -13.9793 -12.6983 -12.6983 -12.5129 -12.5129 -10.9175 -10.9175 -10.5183 -10.5183 -8.3705 -8.3705 -7.6848 -7.6848 -6.4986 -6.4986 -6.1211 -6.1211 -5.9808 -5.9808 -5.7708 -5.7708 -5.5587 -5.5587 -5.4279 -5.4279 -5.2405 -5.2405 -5.1264 -5.1264 -4.9531 -4.9531 -4.8346 -4.8346 -4.5390 -4.5390 -3.3959 -3.3959 -2.2498 -2.2498 -2.0678 -2.0678 -1.6430 -1.6430 -1.4687 -1.4687 -1.0658 -1.0658 -0.9831 -0.9831 -0.7715 -0.7715 -0.6380 -0.6380 3.5868 3.5868 4.0619 4.0619 6.0335 6.0335 6.2854 6.2854 6.9206 6.9206 7.6410 7.6410 k =-0.3085-0.3307 0.0355 ( 7606 PWs) bands (ev): -22.6247 -22.6247 -22.3451 -22.3451 -19.9932 -19.9932 -19.6670 -19.6670 -14.0641 -14.0641 -13.9790 -13.9790 -12.7027 -12.7027 -12.5015 -12.5015 -10.9238 -10.9238 -10.5179 -10.5179 -8.3705 -8.3705 -7.6827 -7.6827 -6.4998 -6.4998 -6.1256 -6.1256 -5.9774 -5.9774 -5.7746 -5.7746 -5.5512 -5.5512 -5.4226 -5.4226 -5.2336 -5.2336 -5.1303 -5.1303 -4.9514 -4.9514 -4.8386 -4.8386 -4.5365 -4.5365 -3.3956 -3.3956 -2.2583 -2.2583 -2.0657 -2.0657 -1.6596 -1.6596 -1.4564 -1.4564 -1.0735 -1.0735 -0.9906 -0.9906 -0.7782 -0.7782 -0.6257 -0.6257 3.5873 3.5873 4.0707 4.0707 6.0025 6.0025 6.3163 6.3163 6.8564 6.8564 7.6239 7.6239 k =-0.2979-0.3193 0.0343 ( 7607 PWs) bands (ev): -22.6257 -22.6257 -22.3443 -22.3443 -19.9921 -19.9921 -19.6679 -19.6679 -14.0659 -14.0659 -13.9788 -13.9788 -12.7070 -12.7070 -12.4904 -12.4904 -10.9301 -10.9301 -10.5171 -10.5171 -8.3708 -8.3708 -7.6801 -7.6801 -6.5016 -6.5016 -6.1303 -6.1303 -5.9737 -5.9737 -5.7771 -5.7771 -5.5436 -5.5436 -5.4181 -5.4181 -5.2271 -5.2271 -5.1338 -5.1338 -4.9499 -4.9499 -4.8427 -4.8427 -4.5343 -4.5343 -3.3948 -3.3948 -2.2672 -2.2672 -2.0631 -2.0631 -1.6776 -1.6776 -1.4426 -1.4426 -1.0819 -1.0819 -0.9976 -0.9976 -0.7849 -0.7849 -0.6134 -0.6134 3.5883 3.5883 4.0782 4.0782 5.9718 5.9718 6.3461 6.3461 6.7937 6.7937 7.6100 7.6100 k =-0.2872-0.3079 0.0331 ( 7605 PWs) bands (ev): -22.6267 -22.6267 -22.3435 -22.3435 -19.9909 -19.9909 -19.6689 -19.6689 -14.0675 -14.0675 -13.9788 -13.9788 -12.7108 -12.7108 -12.4799 -12.4799 -10.9361 -10.9361 -10.5161 -10.5161 -8.3716 -8.3716 -7.6771 -7.6771 -6.5040 -6.5040 -6.1350 -6.1350 -5.9696 -5.9696 -5.7783 -5.7783 -5.5360 -5.5360 -5.4148 -5.4148 -5.2210 -5.2210 -5.1369 -5.1369 -4.9485 -4.9485 -4.8469 -4.8469 -4.5324 -4.5324 -3.3936 -3.3936 -2.2764 -2.2764 -2.0600 -2.0600 -1.6959 -1.6959 -1.4281 -1.4281 -1.0910 -1.0910 -1.0040 -1.0040 -0.7912 -0.7912 -0.6014 -0.6014 3.5900 3.5900 4.0846 4.0846 5.9422 5.9422 6.3735 6.3735 6.7330 6.7330 7.5994 7.5994 k =-0.2766-0.2965 0.0318 ( 7605 PWs) bands (ev): -22.6278 -22.6278 -22.3427 -22.3427 -19.9897 -19.9897 -19.6700 -19.6700 -14.0689 -14.0689 -13.9790 -13.9790 -12.7140 -12.7140 -12.4706 -12.4706 -10.9415 -10.9415 -10.5152 -10.5152 -8.3728 -8.3728 -7.6736 -7.6736 -6.5070 -6.5070 -6.1397 -6.1397 -5.9652 -5.9652 -5.7780 -5.7780 -5.5286 -5.5286 -5.4127 -5.4127 -5.2153 -5.2153 -5.1396 -5.1396 -4.9474 -4.9474 -4.8513 -4.8513 -4.5308 -4.5308 -3.3920 -3.3920 -2.2859 -2.2859 -2.0565 -2.0565 -1.7137 -1.7137 -1.4136 -1.4136 -1.1009 -1.1009 -1.0098 -1.0098 -0.7970 -0.7970 -0.5899 -0.5899 3.5922 3.5922 4.0896 4.0896 5.9142 5.9142 6.3972 6.3972 6.6754 6.6754 7.5921 7.5921 k =-0.2660-0.2851 0.0306 ( 7606 PWs) bands (ev): -22.6289 -22.6289 -22.3419 -22.3419 -19.9884 -19.9884 -19.6710 -19.6710 -14.0701 -14.0701 -13.9793 -13.9793 -12.7163 -12.7163 -12.4625 -12.4625 -10.9460 -10.9460 -10.5145 -10.5145 -8.3744 -8.3744 -7.6698 -7.6698 -6.5104 -6.5104 -6.1444 -6.1444 -5.9603 -5.9603 -5.7763 -5.7763 -5.5215 -5.5215 -5.4120 -5.4120 -5.2101 -5.2101 -5.1419 -5.1419 -4.9465 -4.9465 -4.8558 -4.8558 -4.5293 -4.5293 -3.3900 -3.3900 -2.2955 -2.2955 -2.0527 -2.0527 -1.7307 -1.7307 -1.3998 -1.3998 -1.1114 -1.1114 -1.0148 -1.0148 -0.8022 -0.8022 -0.5792 -0.5792 3.5949 3.5949 4.0934 4.0934 5.8882 5.8882 6.4147 6.4147 6.6229 6.6229 7.5882 7.5882 k =-0.2553-0.2737 0.0294 ( 7617 PWs) bands (ev): -22.6300 -22.6300 -22.3411 -22.3411 -19.9871 -19.9871 -19.6721 -19.6721 -14.0711 -14.0711 -13.9798 -13.9798 -12.7176 -12.7176 -12.4560 -12.4560 -10.9495 -10.9495 -10.5140 -10.5140 -8.3765 -8.3765 -7.6656 -7.6656 -6.5143 -6.5143 -6.1488 -6.1488 -5.9549 -5.9549 -5.7730 -5.7730 -5.5147 -5.5147 -5.4128 -5.4128 -5.2052 -5.2052 -5.1440 -5.1440 -4.9460 -4.9460 -4.8603 -4.8603 -4.5280 -4.5280 -3.3877 -3.3877 -2.3051 -2.3051 -2.0485 -2.0485 -1.7463 -1.7463 -1.3869 -1.3869 -1.1226 -1.1226 -1.0190 -1.0190 -0.8066 -0.8066 -0.5693 -0.5693 3.5980 3.5980 4.0959 4.0959 5.8647 5.8647 6.4212 6.4212 6.5801 6.5801 7.5878 7.5878 k =-0.2447-0.2623 0.0282 ( 7622 PWs) bands (ev): -22.6311 -22.6311 -22.3403 -22.3403 -19.9858 -19.9858 -19.6733 -19.6733 -14.0720 -14.0720 -13.9804 -13.9804 -12.7179 -12.7179 -12.4512 -12.4512 -10.9517 -10.9517 -10.5139 -10.5139 -8.3790 -8.3790 -7.6613 -7.6613 -6.5183 -6.5183 -6.1530 -6.1530 -5.9491 -5.9491 -5.7684 -5.7684 -5.5085 -5.5085 -5.4149 -5.4149 -5.2006 -5.2006 -5.1459 -5.1459 -4.9459 -4.9459 -4.8647 -4.8647 -4.5269 -4.5269 -3.3851 -3.3851 -2.3147 -2.3147 -2.0441 -2.0441 -1.7603 -1.7603 -1.3753 -1.3753 -1.1341 -1.1341 -1.0226 -1.0226 -0.8103 -0.8103 -0.5605 -0.5605 3.6014 3.6014 4.0971 4.0971 5.8438 5.8438 6.4094 6.4094 6.5541 6.5541 7.5906 7.5906 k =-0.2340-0.2509 0.0269 ( 7624 PWs) bands (ev): -22.6323 -22.6323 -22.3394 -22.3394 -19.9845 -19.9845 -19.6744 -19.6744 -14.0728 -14.0728 -13.9809 -13.9809 -12.7172 -12.7172 -12.4481 -12.4481 -10.9527 -10.9527 -10.5142 -10.5142 -8.3817 -8.3817 -7.6569 -7.6569 -6.5224 -6.5224 -6.1570 -6.1570 -5.9428 -5.9428 -5.7625 -5.7625 -5.5030 -5.5030 -5.4182 -5.4182 -5.1965 -5.1965 -5.1477 -5.1477 -4.9462 -4.9462 -4.8692 -4.8692 -4.5260 -4.5260 -3.3823 -3.3823 -2.3241 -2.3241 -2.0394 -2.0394 -1.7725 -1.7725 -1.3651 -1.3651 -1.1458 -1.1458 -1.0254 -1.0254 -0.8131 -0.8131 -0.5528 -0.5528 3.6051 3.6051 4.0974 4.0974 5.8257 5.8257 6.3780 6.3780 6.5462 6.5462 7.5968 7.5968 k =-0.2234-0.2395 0.0257 ( 7626 PWs) bands (ev): -22.6334 -22.6334 -22.3386 -22.3386 -19.9831 -19.9831 -19.6756 -19.6756 -14.0736 -14.0736 -13.9814 -13.9814 -12.7155 -12.7155 -12.4467 -12.4467 -10.9523 -10.9523 -10.5150 -10.5150 -8.3847 -8.3847 -7.6527 -7.6527 -6.5264 -6.5264 -6.1605 -6.1605 -5.9360 -5.9360 -5.7554 -5.7554 -5.4984 -5.4984 -5.4224 -5.4224 -5.1926 -5.1926 -5.1496 -5.1496 -4.9470 -4.9470 -4.8735 -4.8735 -4.5254 -4.5254 -3.3793 -3.3793 -2.3333 -2.3333 -2.0345 -2.0345 -1.7828 -1.7828 -1.3566 -1.3566 -1.1575 -1.1575 -1.0276 -1.0276 -0.8151 -0.8151 -0.5462 -0.5462 3.6088 3.6088 4.0966 4.0966 5.8107 5.8107 6.3355 6.3355 6.5478 6.5478 7.6061 7.6061 k =-0.2128-0.2281 0.0245 ( 7629 PWs) bands (ev): -22.6345 -22.6345 -22.3378 -22.3378 -19.9818 -19.9818 -19.6767 -19.6767 -14.0745 -14.0745 -13.9817 -13.9817 -12.7128 -12.7128 -12.4471 -12.4471 -10.9507 -10.9507 -10.5161 -10.5161 -8.3878 -8.3878 -7.6488 -7.6488 -6.5301 -6.5301 -6.1637 -6.1637 -5.9286 -5.9286 -5.7472 -5.7472 -5.4948 -5.4948 -5.4273 -5.4273 -5.1890 -5.1890 -5.1516 -5.1516 -4.9482 -4.9482 -4.8777 -4.8777 -4.5251 -4.5251 -3.3761 -3.3761 -2.3422 -2.3422 -2.0293 -2.0293 -1.7911 -1.7911 -1.3501 -1.3501 -1.1691 -1.1691 -1.0293 -1.0293 -0.8162 -0.8162 -0.5409 -0.5409 3.6125 3.6125 4.0951 4.0951 5.7988 5.7988 6.2891 6.2891 6.5518 6.5518 7.6184 7.6184 k =-0.2021-0.2167 0.0233 ( 7632 PWs) bands (ev): -22.6356 -22.6356 -22.3370 -22.3370 -19.9804 -19.9804 -19.6779 -19.6779 -14.0756 -14.0756 -13.9818 -13.9818 -12.7092 -12.7092 -12.4490 -12.4490 -10.9479 -10.9479 -10.5176 -10.5176 -8.3909 -8.3909 -7.6456 -7.6456 -6.5334 -6.5334 -6.1664 -6.1664 -5.9207 -5.9207 -5.7382 -5.7382 -5.4925 -5.4925 -5.4326 -5.4326 -5.1856 -5.1856 -5.1539 -5.1539 -4.9500 -4.9500 -4.8819 -4.8819 -4.5252 -4.5252 -3.3728 -3.3728 -2.3508 -2.3508 -2.0239 -2.0239 -1.7973 -1.7973 -1.3456 -1.3456 -1.1802 -1.1802 -1.0304 -1.0304 -0.8165 -0.8165 -0.5368 -0.5368 3.6160 3.6160 4.0929 4.0929 5.7901 5.7901 6.2419 6.2419 6.5551 6.5551 7.6335 7.6335 k =-0.1915-0.2053 0.0220 ( 7637 PWs) bands (ev): -22.6366 -22.6366 -22.3362 -22.3362 -19.9790 -19.9790 -19.6791 -19.6791 -14.0769 -14.0769 -13.9814 -13.9814 -12.7049 -12.7049 -12.4522 -12.4522 -10.9442 -10.9442 -10.5193 -10.5193 -8.3939 -8.3939 -7.6432 -7.6432 -6.5359 -6.5359 -6.1687 -6.1687 -5.9122 -5.9122 -5.7286 -5.7286 -5.4916 -5.4916 -5.4378 -5.4378 -5.1825 -5.1825 -5.1563 -5.1563 -4.9522 -4.9522 -4.8859 -4.8859 -4.5259 -4.5259 -3.3695 -3.3695 -2.3590 -2.3590 -2.0181 -2.0181 -1.8015 -1.8015 -1.3432 -1.3432 -1.1908 -1.1908 -1.0310 -1.0310 -0.8159 -0.8159 -0.5339 -0.5339 3.6191 3.6191 4.0904 4.0904 5.7847 5.7847 6.1954 6.1954 6.5563 6.5563 7.6511 7.6511 k =-0.1809-0.1939 0.0208 ( 7633 PWs) bands (ev): -22.6377 -22.6377 -22.3354 -22.3354 -19.9777 -19.9777 -19.6802 -19.6802 -14.0786 -14.0786 -13.9806 -13.9806 -12.7000 -12.7000 -12.4567 -12.4567 -10.9397 -10.9397 -10.5212 -10.5212 -8.3966 -8.3966 -7.6418 -7.6418 -6.5376 -6.5376 -6.1705 -6.1705 -5.9031 -5.9031 -5.7186 -5.7186 -5.4921 -5.4921 -5.4426 -5.4426 -5.1798 -5.1798 -5.1588 -5.1588 -4.9549 -4.9549 -4.8897 -4.8897 -4.5271 -4.5271 -3.3662 -3.3662 -2.3668 -2.3668 -2.0119 -2.0119 -1.8037 -1.8037 -1.3432 -1.3432 -1.2007 -1.2007 -1.0312 -1.0312 -0.8146 -0.8146 -0.5324 -0.5324 3.6218 3.6218 4.0877 4.0877 5.7825 5.7825 6.1505 6.1505 6.5551 6.5551 7.6709 7.6709 k =-0.1702-0.1825 0.0196 ( 7630 PWs) bands (ev): -22.6387 -22.6387 -22.3346 -22.3346 -19.9763 -19.9763 -19.6814 -19.6814 -14.0807 -14.0807 -13.9793 -13.9793 -12.6947 -12.6947 -12.4620 -12.4620 -10.9348 -10.9348 -10.5231 -10.5231 -8.3990 -8.3990 -7.6417 -7.6417 -6.5383 -6.5383 -6.1718 -6.1718 -5.8935 -5.8935 -5.7085 -5.7085 -5.4939 -5.4939 -5.4471 -5.4471 -5.1776 -5.1776 -5.1612 -5.1612 -4.9579 -4.9579 -4.8935 -4.8935 -4.5290 -4.5290 -3.3629 -3.3629 -2.3742 -2.3742 -2.0052 -2.0052 -1.8041 -1.8041 -1.3455 -1.3455 -1.2097 -1.2097 -1.0310 -1.0310 -0.8126 -0.8126 -0.5320 -0.5320 3.6239 3.6239 4.0850 4.0850 5.7833 5.7833 6.1074 6.1074 6.5510 6.5510 7.6926 7.6926 k =-0.1596-0.1711 0.0184 ( 7631 PWs) bands (ev): -22.6397 -22.6397 -22.3339 -22.3339 -19.9750 -19.9750 -19.6825 -19.6825 -14.0830 -14.0830 -13.9775 -13.9775 -12.6892 -12.6892 -12.4680 -12.4680 -10.9296 -10.9296 -10.5248 -10.5248 -8.4010 -8.4010 -7.6428 -7.6428 -6.5380 -6.5380 -6.1728 -6.1728 -5.8833 -5.8833 -5.6987 -5.6987 -5.4966 -5.4966 -5.4511 -5.4511 -5.1765 -5.1765 -5.1628 -5.1628 -4.9613 -4.9613 -4.8973 -4.8973 -4.5316 -4.5316 -3.3597 -3.3597 -2.3811 -2.3811 -1.9980 -1.9980 -1.8028 -1.8028 -1.3499 -1.3499 -1.2179 -1.2179 -1.0305 -1.0305 -0.8098 -0.8098 -0.5327 -0.5327 3.6252 3.6252 4.0826 4.0826 5.7870 5.7870 6.0667 6.0667 6.5442 6.5442 7.7159 7.7159 k =-0.1489-0.1597 0.0171 ( 7633 PWs) bands (ev): -22.6406 -22.6406 -22.3332 -22.3332 -19.9737 -19.9737 -19.6836 -19.6836 -14.0858 -14.0858 -13.9752 -13.9752 -12.6839 -12.6839 -12.4742 -12.4742 -10.9245 -10.9245 -10.5262 -10.5262 -8.4025 -8.4025 -7.6454 -7.6454 -6.5365 -6.5365 -6.1734 -6.1734 -5.8728 -5.8728 -5.6894 -5.6894 -5.4995 -5.4995 -5.4552 -5.4552 -5.1770 -5.1770 -5.1630 -5.1630 -4.9649 -4.9649 -4.9009 -4.9009 -4.5350 -4.5350 -3.3566 -3.3566 -2.3876 -2.3876 -1.9903 -1.9903 -1.7999 -1.7999 -1.3564 -1.3564 -1.2254 -1.2254 -1.0298 -1.0298 -0.8064 -0.8064 -0.5346 -0.5346 3.6258 3.6258 4.0805 4.0805 5.7932 5.7932 6.0288 6.0288 6.5347 6.5347 7.7404 7.7404 k =-0.1383-0.1483 0.0159 ( 7635 PWs) bands (ev): -22.6415 -22.6415 -22.3325 -22.3325 -19.9725 -19.9725 -19.6847 -19.6847 -14.0888 -14.0888 -13.9725 -13.9725 -12.6789 -12.6789 -12.4802 -12.4802 -10.9197 -10.9197 -10.5272 -10.5272 -8.4033 -8.4033 -7.6494 -7.6494 -6.5340 -6.5340 -6.1736 -6.1736 -5.8618 -5.8618 -5.6812 -5.6812 -5.5020 -5.5020 -5.4594 -5.4594 -5.1792 -5.1792 -5.1617 -5.1617 -4.9686 -4.9686 -4.9045 -4.9045 -4.5392 -4.5392 -3.3536 -3.3536 -2.3936 -2.3936 -1.9820 -1.9820 -1.7955 -1.7955 -1.3648 -1.3648 -1.2324 -1.2324 -1.0288 -1.0288 -0.8024 -0.8024 -0.5375 -0.5375 3.6255 3.6255 4.0789 4.0789 5.8013 5.8013 5.9942 5.9942 6.5225 6.5225 7.7657 7.7657 k =-0.1277-0.1368 0.0147 ( 7638 PWs) bands (ev): -22.6424 -22.6424 -22.3319 -22.3319 -19.9713 -19.9713 -19.6857 -19.6857 -14.0920 -14.0920 -13.9694 -13.9694 -12.6745 -12.6745 -12.4858 -12.4858 -10.9155 -10.9155 -10.5276 -10.5276 -8.4036 -8.4036 -7.6547 -7.6547 -6.5304 -6.5304 -6.1735 -6.1735 -5.8505 -5.8505 -5.6743 -5.6743 -5.5035 -5.5035 -5.4639 -5.4639 -5.1821 -5.1821 -5.1596 -5.1596 -4.9724 -4.9724 -4.9080 -4.9080 -4.5441 -4.5441 -3.3507 -3.3507 -2.3991 -2.3991 -1.9733 -1.9733 -1.7897 -1.7897 -1.3747 -1.3747 -1.2390 -1.2390 -1.0275 -1.0275 -0.7978 -0.7978 -0.5413 -0.5413 3.6243 3.6243 4.0780 4.0780 5.8103 5.8103 5.9640 5.9640 6.5079 6.5079 7.7913 7.7913 k =-0.1170-0.1254 0.0135 ( 7632 PWs) bands (ev): -22.6432 -22.6432 -22.3313 -22.3313 -19.9702 -19.9702 -19.6867 -19.6867 -14.0954 -14.0954 -13.9660 -13.9660 -12.6711 -12.6711 -12.4905 -12.4905 -10.9120 -10.9120 -10.5274 -10.5274 -8.4033 -8.4033 -7.6611 -7.6611 -6.5259 -6.5259 -6.1732 -6.1732 -5.8391 -5.8391 -5.6690 -5.6690 -5.5040 -5.5040 -5.4686 -5.4686 -5.1854 -5.1854 -5.1572 -5.1572 -4.9763 -4.9763 -4.9114 -4.9114 -4.5497 -4.5497 -3.3480 -3.3480 -2.4042 -2.4042 -1.9643 -1.9643 -1.7825 -1.7825 -1.3859 -1.3859 -1.2453 -1.2453 -1.0262 -1.0262 -0.7926 -0.7926 -0.5459 -0.5459 3.6224 3.6224 4.0777 4.0777 5.8181 5.8181 5.9401 5.9401 6.4911 6.4911 7.8167 7.8167 k =-0.1064-0.1140 0.0122 ( 7627 PWs) bands (ev): -22.6439 -22.6439 -22.3307 -22.3307 -19.9691 -19.9691 -19.6876 -19.6876 -14.0987 -14.0987 -13.9624 -13.9624 -12.6688 -12.6688 -12.4942 -12.4942 -10.9093 -10.9093 -10.5266 -10.5266 -8.4025 -8.4025 -7.6686 -7.6686 -6.5207 -6.5207 -6.1727 -6.1727 -5.8275 -5.8275 -5.6652 -5.6652 -5.5041 -5.5041 -5.4727 -5.4727 -5.1886 -5.1886 -5.1547 -5.1547 -4.9800 -4.9800 -4.9147 -4.9147 -4.5559 -4.5559 -3.3455 -3.3455 -2.4088 -2.4088 -1.9551 -1.9551 -1.7741 -1.7741 -1.3983 -1.3983 -1.2514 -1.2514 -1.0247 -1.0247 -0.7869 -0.7869 -0.5512 -0.5512 3.6199 3.6199 4.0779 4.0779 5.8208 5.8208 5.9261 5.9261 6.4723 6.4723 7.8415 7.8415 k =-0.0957-0.1026 0.0110 ( 7628 PWs) bands (ev): -22.6446 -22.6446 -22.3302 -22.3302 -19.9681 -19.9681 -19.6885 -19.6885 -14.1021 -14.1021 -13.9588 -13.9588 -12.6677 -12.6677 -12.4966 -12.4966 -10.9074 -10.9074 -10.5251 -10.5251 -8.4011 -8.4011 -7.6769 -7.6769 -6.5149 -6.5149 -6.1721 -6.1721 -5.8162 -5.8162 -5.6627 -5.6627 -5.5054 -5.5054 -5.4749 -5.4749 -5.1918 -5.1918 -5.1521 -5.1521 -4.9836 -4.9836 -4.9178 -4.9178 -4.5625 -4.5625 -3.3432 -3.3432 -2.4129 -2.4129 -1.9459 -1.9459 -1.7645 -1.7645 -1.4117 -1.4117 -1.2573 -1.2573 -1.0232 -1.0232 -0.7808 -0.7808 -0.5570 -0.5570 3.6168 3.6168 4.0788 4.0788 5.8152 5.8152 5.9253 5.9253 6.4517 6.4517 7.8649 7.8649 k =-0.0851-0.0912 0.0098 ( 7627 PWs) bands (ev): -22.6452 -22.6452 -22.3297 -22.3297 -19.9672 -19.9672 -19.6893 -19.6893 -14.1053 -14.1053 -13.9552 -13.9552 -12.6678 -12.6678 -12.4977 -12.4977 -10.9063 -10.9063 -10.5232 -10.5232 -8.3993 -8.3993 -7.6856 -7.6856 -6.5087 -6.5087 -6.1715 -6.1715 -5.8052 -5.8052 -5.6610 -5.6610 -5.5096 -5.5096 -5.4737 -5.4737 -5.1947 -5.1947 -5.1497 -5.1497 -4.9870 -4.9870 -4.9208 -4.9208 -4.5694 -4.5694 -3.3411 -3.3411 -2.4166 -2.4166 -1.9369 -1.9369 -1.7537 -1.7537 -1.4259 -1.4259 -1.2630 -1.2630 -1.0217 -1.0217 -0.7744 -0.7744 -0.5634 -0.5634 3.6133 3.6133 4.0800 4.0800 5.8026 5.8026 5.9358 5.9358 6.4295 6.4295 7.8863 7.8863 k =-0.0745-0.0798 0.0086 ( 7620 PWs) bands (ev): -22.6458 -22.6458 -22.3293 -22.3293 -19.9664 -19.9664 -19.6900 -19.6900 -14.1083 -14.1083 -13.9517 -13.9517 -12.6689 -12.6689 -12.4978 -12.4978 -10.9059 -10.9059 -10.5209 -10.5209 -8.3972 -8.3972 -7.6945 -7.6945 -6.5025 -6.5025 -6.1708 -6.1708 -5.7950 -5.7950 -5.6595 -5.6595 -5.5168 -5.5168 -5.4695 -5.4695 -5.1973 -5.1973 -5.1474 -5.1474 -4.9901 -4.9901 -4.9236 -4.9236 -4.5764 -4.5764 -3.3393 -3.3393 -2.4198 -2.4198 -1.9285 -1.9285 -1.7418 -1.7418 -1.4407 -1.4407 -1.2684 -1.2684 -1.0203 -1.0203 -0.7677 -0.7677 -0.5700 -0.5700 3.6096 3.6096 4.0816 4.0816 5.7873 5.7873 5.9532 5.9532 6.4062 6.4062 7.9050 7.9050 k =-0.0638-0.0684 0.0073 ( 7617 PWs) bands (ev): -22.6463 -22.6463 -22.3289 -22.3289 -19.9656 -19.9656 -19.6907 -19.6907 -14.1110 -14.1110 -13.9485 -13.9485 -12.6707 -12.6707 -12.4969 -12.4969 -10.9061 -10.9061 -10.5184 -10.5184 -8.3949 -8.3949 -7.7031 -7.7031 -6.4964 -6.4964 -6.1702 -6.1702 -5.7857 -5.7857 -5.6576 -5.6576 -5.5259 -5.5259 -5.4635 -5.4635 -5.1995 -5.1995 -5.1452 -5.1452 -4.9929 -4.9929 -4.9261 -4.9261 -4.5831 -4.5831 -3.3376 -3.3376 -2.4226 -2.4226 -1.9209 -1.9209 -1.7289 -1.7289 -1.4561 -1.4561 -1.2734 -1.2734 -1.0189 -1.0189 -0.7610 -0.7610 -0.5766 -0.5766 3.6060 3.6060 4.0833 4.0833 5.7720 5.7720 5.9743 5.9743 6.3821 6.3821 7.9201 7.9201 k =-0.0532-0.0570 0.0061 ( 7619 PWs) bands (ev): -22.6467 -22.6467 -22.3286 -22.3286 -19.9650 -19.9650 -19.6912 -19.6912 -14.1134 -14.1134 -13.9456 -13.9456 -12.6730 -12.6730 -12.4955 -12.4955 -10.9066 -10.9066 -10.5159 -10.5159 -8.3926 -8.3926 -7.7112 -7.7112 -6.4907 -6.4907 -6.1696 -6.1696 -5.7777 -5.7777 -5.6548 -5.6548 -5.5362 -5.5362 -5.4571 -5.4571 -5.2014 -5.2014 -5.1434 -5.1434 -4.9953 -4.9953 -4.9284 -4.9284 -4.5894 -4.5894 -3.3362 -3.3362 -2.4249 -2.4249 -1.9141 -1.9141 -1.7155 -1.7155 -1.4716 -1.4716 -1.2778 -1.2778 -1.0176 -1.0176 -0.7544 -0.7544 -0.5832 -0.5832 3.6025 3.6025 4.0851 4.0851 5.7581 5.7581 5.9972 5.9972 6.3576 6.3576 7.9313 7.9313 k =-0.0426-0.0456 0.0049 ( 7621 PWs) bands (ev): -22.6470 -22.6470 -22.3284 -22.3284 -19.9645 -19.9645 -19.6917 -19.6917 -14.1155 -14.1155 -13.9431 -13.9431 -12.6753 -12.6753 -12.4939 -12.4939 -10.9074 -10.9074 -10.5136 -10.5136 -8.3904 -8.3904 -7.7183 -7.7183 -6.4857 -6.4857 -6.1692 -6.1692 -5.7712 -5.7712 -5.6507 -5.6507 -5.5470 -5.5470 -5.4510 -5.4510 -5.2030 -5.2030 -5.1417 -5.1417 -4.9974 -4.9974 -4.9303 -4.9303 -4.5951 -4.5951 -3.3351 -3.3351 -2.4268 -2.4268 -1.9085 -1.9085 -1.7019 -1.7019 -1.4868 -1.4868 -1.2816 -1.2816 -1.0166 -1.0166 -0.7483 -0.7483 -0.5893 -0.5893 3.5995 3.5995 4.0868 4.0868 5.7463 5.7463 6.0205 6.0205 6.3335 6.3335 7.9386 7.9386 k =-0.0319-0.0342 0.0037 ( 7623 PWs) bands (ev): -22.6473 -22.6473 -22.3281 -22.3281 -19.9641 -19.9641 -19.6920 -19.6920 -14.1171 -14.1171 -13.9411 -13.9411 -12.6775 -12.6775 -12.4923 -12.4923 -10.9082 -10.9082 -10.5115 -10.5115 -8.3885 -8.3885 -7.7242 -7.7242 -6.4816 -6.4816 -6.1688 -6.1688 -5.7664 -5.7664 -5.6455 -5.6455 -5.5577 -5.5577 -5.4457 -5.4457 -5.2042 -5.2042 -5.1404 -5.1404 -4.9989 -4.9989 -4.9318 -4.9318 -4.5997 -4.5997 -3.3342 -3.3342 -2.4283 -2.4283 -1.9040 -1.9040 -1.6889 -1.6889 -1.5009 -1.5009 -1.2847 -1.2847 -1.0157 -1.0157 -0.7429 -0.7429 -0.5946 -0.5946 3.5969 3.5969 4.0882 4.0882 5.7369 5.7369 6.0428 6.0428 6.3110 6.3110 7.9430 7.9430 k =-0.0213-0.0228 0.0024 ( 7617 PWs) bands (ev): -22.6475 -22.6475 -22.3280 -22.3280 -19.9638 -19.9638 -19.6923 -19.6923 -14.1183 -14.1183 -13.9396 -13.9396 -12.6792 -12.6792 -12.4910 -12.4910 -10.9088 -10.9088 -10.5100 -10.5100 -8.3871 -8.3871 -7.7287 -7.7287 -6.4785 -6.4785 -6.1685 -6.1685 -5.7631 -5.7631 -5.6397 -5.6397 -5.5673 -5.5673 -5.4416 -5.4416 -5.2051 -5.2051 -5.1395 -5.1395 -5.0001 -5.0001 -4.9329 -4.9329 -4.6032 -4.6032 -3.3335 -3.3335 -2.4294 -2.4294 -1.9008 -1.9008 -1.6776 -1.6776 -1.5130 -1.5130 -1.2869 -1.2869 -1.0151 -1.0151 -0.7387 -0.7387 -0.5989 -0.5989 3.5950 3.5950 4.0893 4.0893 5.7301 5.7301 6.0621 6.0621 6.2916 6.2916 7.9453 7.9453 k =-0.0106-0.0114 0.0012 ( 7617 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9636 -19.9636 -19.6924 -19.6924 -14.1190 -14.1190 -13.9387 -13.9387 -12.6802 -12.6802 -12.4902 -12.4902 -10.9093 -10.9093 -10.5090 -10.5090 -8.3861 -8.3861 -7.7314 -7.7314 -6.4766 -6.4766 -6.1684 -6.1684 -5.7613 -5.7613 -5.6348 -5.6348 -5.5746 -5.5746 -5.4391 -5.4391 -5.2056 -5.2056 -5.1389 -5.1389 -5.0007 -5.0007 -4.9335 -4.9335 -4.6054 -4.6054 -3.3332 -3.3332 -2.4300 -2.4300 -1.8988 -1.8988 -1.6697 -1.6697 -1.5213 -1.5213 -1.2883 -1.2883 -1.0147 -1.0147 -0.7360 -0.7360 -0.6016 -0.6016 3.5938 3.5938 4.0899 4.0899 5.7259 5.7259 6.0758 6.0758 6.2778 6.2778 7.9464 7.9464 k = 0.0000 0.0000 0.0000 ( 7611 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1193 -14.1193 -13.9384 -13.9384 -12.6806 -12.6806 -12.4899 -12.4899 -10.9094 -10.9094 -10.5087 -10.5087 -8.3858 -8.3858 -7.7324 -7.7324 -6.4759 -6.4759 -6.1683 -6.1683 -5.7607 -5.7607 -5.6327 -5.6327 -5.5774 -5.5774 -5.4382 -5.4382 -5.2057 -5.2057 -5.1387 -5.1387 -5.0010 -5.0010 -4.9338 -4.9338 -4.6062 -4.6062 -3.3330 -3.3330 -2.4302 -2.4302 -1.8981 -1.8981 -1.6668 -1.6668 -1.5244 -1.5244 -1.2888 -1.2888 -1.0146 -1.0146 -0.7350 -0.7350 -0.6025 -0.6025 3.5934 3.5934 4.0902 4.0902 5.7246 5.7246 6.0808 6.0808 6.2728 6.2728 7.9467 7.9467 k = 0.0000 0.0000 0.0000 ( 7611 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1193 -14.1193 -13.9384 -13.9384 -12.6806 -12.6806 -12.4899 -12.4899 -10.9094 -10.9094 -10.5087 -10.5087 -8.3858 -8.3858 -7.7324 -7.7324 -6.4759 -6.4759 -6.1683 -6.1683 -5.7607 -5.7607 -5.6327 -5.6327 -5.5774 -5.5774 -5.4382 -5.4382 -5.2057 -5.2057 -5.1387 -5.1387 -5.0010 -5.0010 -4.9338 -4.9338 -4.6062 -4.6062 -3.3330 -3.3330 -2.4302 -2.4302 -1.8981 -1.8981 -1.6668 -1.6668 -1.5244 -1.5244 -1.2888 -1.2888 -1.0146 -1.0146 -0.7350 -0.7350 -0.6025 -0.6025 3.5934 3.5934 4.0902 4.0902 5.7246 5.7246 6.0808 6.0808 6.2728 6.2728 7.9467 7.9467 k = 0.0000 0.0000 0.0154 ( 7615 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1191 -14.1191 -13.9386 -13.9386 -12.6805 -12.6805 -12.4899 -12.4899 -10.9094 -10.9094 -10.5088 -10.5088 -8.3859 -8.3859 -7.7322 -7.7322 -6.4763 -6.4763 -6.1679 -6.1679 -5.7606 -5.7606 -5.6337 -5.6337 -5.5762 -5.5762 -5.4383 -5.4383 -5.2063 -5.2063 -5.1386 -5.1386 -5.0005 -5.0005 -4.9340 -4.9340 -4.6061 -4.6061 -3.3334 -3.3334 -2.4301 -2.4301 -1.8981 -1.8981 -1.6671 -1.6671 -1.5239 -1.5239 -1.2886 -1.2886 -1.0147 -1.0147 -0.7350 -0.7350 -0.6028 -0.6028 3.5935 3.5935 4.0899 4.0899 5.7260 5.7260 6.0808 6.0808 6.2735 6.2735 7.9466 7.9466 k = 0.0000 0.0000 0.0308 ( 7612 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1187 -14.1187 -13.9392 -13.9392 -12.6801 -12.6801 -12.4899 -12.4899 -10.9093 -10.9093 -10.5092 -10.5092 -8.3862 -8.3862 -7.7318 -7.7318 -6.4772 -6.4772 -6.1667 -6.1667 -5.7605 -5.7605 -5.6363 -5.6363 -5.5727 -5.5727 -5.4387 -5.4387 -5.2079 -5.2079 -5.1381 -5.1381 -4.9992 -4.9992 -4.9347 -4.9347 -4.6061 -4.6061 -3.3346 -3.3346 -2.4296 -2.4296 -1.8980 -1.8980 -1.6679 -1.6679 -1.5224 -1.5224 -1.2883 -1.2883 -1.0150 -1.0150 -0.7351 -0.7351 -0.6038 -0.6038 3.5938 3.5938 4.0889 4.0889 5.7303 5.7303 6.0805 6.0805 6.2755 6.2755 7.9465 7.9465 k = 0.0000 0.0000 0.0462 ( 7619 PWs) bands (ev): -22.6476 -22.6476 -22.3280 -22.3280 -19.9636 -19.9636 -19.6924 -19.6924 -14.1180 -14.1180 -13.9402 -13.9402 -12.6794 -12.6794 -12.4899 -12.4899 -10.9092 -10.9092 -10.5098 -10.5098 -8.3866 -8.3866 -7.7311 -7.7311 -6.4786 -6.4786 -6.1646 -6.1646 -5.7603 -5.7603 -5.6401 -5.6401 -5.5674 -5.5674 -5.4393 -5.4393 -5.2105 -5.2105 -5.1374 -5.1374 -4.9972 -4.9972 -4.9358 -4.9358 -4.6060 -4.6060 -3.3366 -3.3366 -2.4288 -2.4288 -1.8979 -1.8979 -1.6691 -1.6691 -1.5201 -1.5201 -1.2877 -1.2877 -1.0156 -1.0156 -0.7352 -0.7352 -0.6053 -0.6053 3.5944 3.5944 4.0872 4.0872 5.7373 5.7373 6.0802 6.0802 6.2789 6.2789 7.9463 7.9463 k = 0.0000 0.0000 0.0615 ( 7621 PWs) bands (ev): -22.6475 -22.6475 -22.3281 -22.3281 -19.9636 -19.9636 -19.6924 -19.6924 -14.1170 -14.1170 -13.9416 -13.9416 -12.6785 -12.6785 -12.4899 -12.4899 -10.9091 -10.9091 -10.5107 -10.5107 -8.3873 -8.3873 -7.7302 -7.7302 -6.4807 -6.4807 -6.1619 -6.1619 -5.7600 -5.7600 -5.6446 -5.6446 -5.5609 -5.5609 -5.4402 -5.4402 -5.2137 -5.2137 -5.1364 -5.1364 -4.9948 -4.9948 -4.9372 -4.9372 -4.6058 -4.6058 -3.3393 -3.3393 -2.4277 -2.4277 -1.8978 -1.8978 -1.6706 -1.6706 -1.5171 -1.5171 -1.2869 -1.2869 -1.0164 -1.0164 -0.7353 -0.7353 -0.6074 -0.6074 3.5952 3.5952 4.0850 4.0850 5.7469 5.7469 6.0797 6.0797 6.2837 6.2837 7.9460 7.9460 k = 0.0000 0.0000 0.0769 ( 7624 PWs) bands (ev): -22.6474 -22.6474 -22.3281 -22.3281 -19.9637 -19.9637 -19.6924 -19.6924 -14.1158 -14.1158 -13.9434 -13.9434 -12.6774 -12.6774 -12.4899 -12.4899 -10.9089 -10.9089 -10.5118 -10.5118 -8.3881 -8.3881 -7.7290 -7.7290 -6.4831 -6.4831 -6.1585 -6.1585 -5.7596 -5.7596 -5.6496 -5.6496 -5.5535 -5.5535 -5.4413 -5.4413 -5.2174 -5.2174 -5.1350 -5.1350 -4.9922 -4.9922 -4.9390 -4.9390 -4.6056 -4.6056 -3.3427 -3.3427 -2.4263 -2.4263 -1.8976 -1.8976 -1.6721 -1.6721 -1.5137 -1.5137 -1.2858 -1.2858 -1.0174 -1.0174 -0.7354 -0.7354 -0.6101 -0.6101 3.5961 3.5961 4.0821 4.0821 5.7590 5.7590 6.0791 6.0791 6.2901 6.2901 7.9455 7.9455 k = 0.0000 0.0000 0.0923 ( 7626 PWs) bands (ev): -22.6473 -22.6473 -22.3283 -22.3283 -19.9637 -19.9637 -19.6923 -19.6923 -14.1142 -14.1142 -13.9455 -13.9455 -12.6761 -12.6761 -12.4899 -12.4899 -10.9087 -10.9087 -10.5131 -10.5131 -8.3890 -8.3890 -7.7276 -7.7276 -6.4860 -6.4860 -6.1546 -6.1546 -5.7592 -5.7592 -5.6546 -5.6546 -5.5455 -5.5455 -5.4426 -5.4426 -5.2213 -5.2213 -5.1334 -5.1334 -4.9899 -4.9899 -4.9410 -4.9410 -4.6054 -4.6054 -3.3468 -3.3468 -2.4247 -2.4247 -1.8973 -1.8973 -1.6735 -1.6735 -1.5102 -1.5102 -1.2845 -1.2845 -1.0185 -1.0185 -0.7356 -0.7356 -0.6133 -0.6133 3.5973 3.5973 4.0787 4.0787 5.7734 5.7734 6.0783 6.0783 6.2982 6.2982 7.9448 7.9448 k = 0.0000 0.0000 0.1077 ( 7625 PWs) bands (ev): -22.6472 -22.6472 -22.3284 -22.3284 -19.9638 -19.9638 -19.6923 -19.6923 -14.1125 -14.1125 -13.9480 -13.9480 -12.6745 -12.6745 -12.4900 -12.4900 -10.9084 -10.9084 -10.5146 -10.5146 -8.3901 -8.3901 -7.7259 -7.7259 -6.4891 -6.4891 -6.1503 -6.1503 -5.7587 -5.7587 -5.6598 -5.6598 -5.5370 -5.5370 -5.4440 -5.4440 -5.2250 -5.2250 -5.1315 -5.1315 -4.9880 -4.9880 -4.9432 -4.9432 -4.6051 -4.6051 -3.3515 -3.3515 -2.4229 -2.4229 -1.8970 -1.8970 -1.6747 -1.6747 -1.5066 -1.5066 -1.2828 -1.2828 -1.0198 -1.0198 -0.7358 -0.7358 -0.6169 -0.6169 3.5987 3.5987 4.0748 4.0748 5.7897 5.7897 6.0774 6.0774 6.3081 6.3081 7.9437 7.9437 k = 0.0000 0.0000 0.1231 ( 7631 PWs) bands (ev): -22.6471 -22.6471 -22.3285 -22.3285 -19.9639 -19.9639 -19.6922 -19.6922 -14.1104 -14.1104 -13.9508 -13.9508 -12.6728 -12.6728 -12.4900 -12.4900 -10.9081 -10.9081 -10.5163 -10.5163 -8.3912 -8.3912 -7.7242 -7.7242 -6.4925 -6.4925 -6.1457 -6.1457 -5.7581 -5.7581 -5.6648 -5.6648 -5.5282 -5.5282 -5.4457 -5.4457 -5.2284 -5.2284 -5.1292 -5.1292 -4.9869 -4.9869 -4.9454 -4.9454 -4.6047 -4.6047 -3.3568 -3.3568 -2.4208 -2.4208 -1.8967 -1.8967 -1.6754 -1.6754 -1.5034 -1.5034 -1.2809 -1.2809 -1.0212 -1.0212 -0.7360 -0.7360 -0.6211 -0.6211 3.6003 3.6003 4.0704 4.0704 5.8076 5.8076 6.0765 6.0765 6.3202 6.3202 7.9419 7.9419 k = 0.0000 0.0000 0.1385 ( 7630 PWs) bands (ev): -22.6469 -22.6469 -22.3287 -22.3287 -19.9640 -19.9640 -19.6921 -19.6921 -14.1081 -14.1081 -13.9540 -13.9540 -12.6709 -12.6709 -12.4901 -12.4901 -10.9078 -10.9078 -10.5181 -10.5181 -8.3925 -8.3925 -7.7223 -7.7223 -6.4960 -6.4960 -6.1408 -6.1408 -5.7575 -5.7575 -5.6698 -5.6698 -5.5193 -5.5193 -5.4475 -5.4475 -5.2312 -5.2312 -5.1268 -5.1268 -4.9869 -4.9869 -4.9475 -4.9475 -4.6043 -4.6043 -3.3625 -3.3625 -2.4185 -2.4185 -1.8964 -1.8964 -1.6756 -1.6756 -1.5005 -1.5005 -1.2788 -1.2788 -1.0226 -1.0226 -0.7361 -0.7361 -0.6256 -0.6256 3.6020 3.6020 4.0656 4.0656 5.8267 5.8267 6.0754 6.0754 6.3345 6.3345 7.9391 7.9391 k = 0.0000 0.0000 0.1538 ( 7634 PWs) bands (ev): -22.6468 -22.6468 -22.3288 -22.3288 -19.9641 -19.9641 -19.6920 -19.6920 -14.1055 -14.1055 -13.9574 -13.9574 -12.6689 -12.6689 -12.4901 -12.4901 -10.9075 -10.9075 -10.5201 -10.5201 -8.3938 -8.3938 -7.7202 -7.7202 -6.4996 -6.4996 -6.1359 -6.1359 -5.7568 -5.7568 -5.6747 -5.6747 -5.5102 -5.5102 -5.4494 -5.4494 -5.2331 -5.2331 -5.1242 -5.1242 -4.9880 -4.9880 -4.9497 -4.9497 -4.6039 -4.6039 -3.3686 -3.3686 -2.4161 -2.4161 -1.8961 -1.8961 -1.6751 -1.6751 -1.4983 -1.4983 -1.2764 -1.2764 -1.0239 -1.0239 -0.7362 -0.7362 -0.6304 -0.6304 3.6039 3.6039 4.0604 4.0604 5.8466 5.8466 6.0742 6.0742 6.3515 6.3515 7.9346 7.9346 k = 0.0000 0.0000 0.1692 ( 7632 PWs) bands (ev): -22.6466 -22.6466 -22.3290 -22.3290 -19.9642 -19.9642 -19.6919 -19.6919 -14.1027 -14.1027 -13.9612 -13.9612 -12.6668 -12.6668 -12.4902 -12.4902 -10.9071 -10.9071 -10.5222 -10.5222 -8.3952 -8.3952 -7.7182 -7.7182 -6.5031 -6.5031 -6.1310 -6.1310 -5.7560 -5.7560 -5.6794 -5.6794 -5.5011 -5.5011 -5.4514 -5.4514 -5.2340 -5.2340 -5.1213 -5.1213 -4.9902 -4.9902 -4.9520 -4.9520 -4.6034 -4.6034 -3.3749 -3.3749 -2.4136 -2.4136 -1.8958 -1.8958 -1.6739 -1.6739 -1.4967 -1.4967 -1.2739 -1.2739 -1.0252 -1.0252 -0.7363 -0.7363 -0.6355 -0.6355 3.6059 3.6059 4.0550 4.0550 5.8668 5.8668 6.0729 6.0729 6.3713 6.3713 7.9269 7.9269 k = 0.0000 0.0000 0.1846 ( 7632 PWs) bands (ev): -22.6464 -22.6464 -22.3292 -22.3292 -19.9643 -19.9643 -19.6919 -19.6919 -14.0996 -14.0996 -13.9652 -13.9652 -12.6646 -12.6646 -12.4902 -12.4902 -10.9067 -10.9067 -10.5243 -10.5243 -8.3966 -8.3966 -7.7160 -7.7160 -6.5067 -6.5067 -6.1261 -6.1261 -5.7552 -5.7552 -5.6840 -5.6840 -5.4922 -5.4922 -5.4535 -5.4535 -5.2338 -5.2338 -5.1184 -5.1184 -4.9934 -4.9934 -4.9545 -4.9545 -4.6029 -4.6029 -3.3815 -3.3815 -2.4110 -2.4110 -1.8954 -1.8954 -1.6719 -1.6719 -1.4959 -1.4959 -1.2713 -1.2713 -1.0264 -1.0264 -0.7363 -0.7363 -0.6408 -0.6408 3.6080 3.6080 4.0493 4.0493 5.8869 5.8869 6.0716 6.0716 6.3944 6.3944 7.9139 7.9139 k = 0.0000 0.0000 0.2000 ( 7635 PWs) bands (ev): -22.6463 -22.6463 -22.3294 -22.3294 -19.9644 -19.9644 -19.6918 -19.6918 -14.0963 -14.0963 -13.9695 -13.9695 -12.6624 -12.6624 -12.4903 -12.4903 -10.9063 -10.9063 -10.5265 -10.5265 -8.3980 -8.3980 -7.7139 -7.7139 -6.5101 -6.5101 -6.1215 -6.1215 -5.7543 -5.7543 -5.6885 -5.6885 -5.4834 -5.4834 -5.4556 -5.4556 -5.2324 -5.2324 -5.1153 -5.1153 -4.9974 -4.9974 -4.9576 -4.9576 -4.6023 -4.6023 -3.3882 -3.3882 -2.4084 -2.4084 -1.8952 -1.8952 -1.6691 -1.6691 -1.4959 -1.4959 -1.2688 -1.2688 -1.0274 -1.0274 -0.7363 -0.7363 -0.6463 -0.6463 3.6102 3.6102 4.0435 4.0435 5.9064 5.9064 6.0702 6.0702 6.4209 6.4209 7.8929 7.8929 k = 0.0000 0.0000 0.2154 ( 7635 PWs) bands (ev): -22.6461 -22.6461 -22.3296 -22.3296 -19.9645 -19.9645 -19.6917 -19.6917 -14.0928 -14.0928 -13.9739 -13.9739 -12.6602 -12.6602 -12.4904 -12.4904 -10.9059 -10.9059 -10.5287 -10.5287 -8.3994 -8.3994 -7.7118 -7.7118 -6.5134 -6.5134 -6.1172 -6.1172 -5.7533 -5.7533 -5.6927 -5.6927 -5.4750 -5.4750 -5.4576 -5.4576 -5.2297 -5.2297 -5.1122 -5.1122 -5.0020 -5.0020 -4.9613 -4.9613 -4.6017 -4.6017 -3.3949 -3.3949 -2.4057 -2.4057 -1.8949 -1.8949 -1.6654 -1.6654 -1.4968 -1.4968 -1.2664 -1.2664 -1.0283 -1.0283 -0.7361 -0.7361 -0.6518 -0.6518 3.6125 3.6125 4.0376 4.0376 5.9249 5.9249 6.0687 6.0687 6.4510 6.4510 7.8622 7.8622 k = 0.0000 0.0000 0.2308 ( 7638 PWs) bands (ev): -22.6459 -22.6459 -22.3297 -22.3297 -19.9646 -19.9646 -19.6916 -19.6916 -14.0890 -14.0890 -13.9786 -13.9786 -12.6580 -12.6580 -12.4905 -12.4905 -10.9055 -10.9055 -10.5308 -10.5308 -8.4008 -8.4008 -7.7097 -7.7097 -6.5164 -6.5164 -6.1131 -6.1131 -5.7522 -5.7522 -5.6968 -5.6968 -5.4674 -5.4674 -5.4592 -5.4592 -5.2257 -5.2257 -5.1090 -5.1090 -5.0070 -5.0070 -4.9657 -4.9657 -4.6011 -4.6011 -3.4015 -3.4015 -2.4032 -2.4032 -1.8947 -1.8947 -1.6609 -1.6609 -1.4985 -1.4985 -1.2641 -1.2641 -1.0288 -1.0288 -0.7358 -0.7358 -0.6574 -0.6574 3.6148 3.6148 4.0318 4.0318 5.9421 5.9421 6.0671 6.0671 6.4848 6.4848 7.8222 7.8222 k = 0.0000 0.0000 0.2461 ( 7632 PWs) bands (ev): -22.6458 -22.6458 -22.3299 -22.3299 -19.9647 -19.9647 -19.6915 -19.6915 -14.0851 -14.0851 -13.9834 -13.9834 -12.6558 -12.6558 -12.4906 -12.4906 -10.9051 -10.9051 -10.5329 -10.5329 -8.4021 -8.4021 -7.7078 -7.7078 -6.5193 -6.5193 -6.1095 -6.1095 -5.7510 -5.7510 -5.7007 -5.7007 -5.4636 -5.4636 -5.4573 -5.4573 -5.2204 -5.2204 -5.1058 -5.1058 -5.0124 -5.0124 -4.9710 -4.9710 -4.6005 -4.6005 -3.4079 -3.4079 -2.4006 -2.4006 -1.8946 -1.8946 -1.6557 -1.6557 -1.5010 -1.5010 -1.2621 -1.2621 -1.0291 -1.0291 -0.7354 -0.7354 -0.6630 -0.6630 3.6171 3.6171 4.0261 4.0261 5.9579 5.9579 6.0655 6.0655 6.5223 6.5223 7.7750 7.7750 k = 0.0000 0.0000 0.2615 ( 7635 PWs) bands (ev): -22.6456 -22.6456 -22.3301 -22.3301 -19.9648 -19.9648 -19.6914 -19.6914 -14.0810 -14.0810 -13.9884 -13.9884 -12.6538 -12.6538 -12.4907 -12.4907 -10.9047 -10.9047 -10.5349 -10.5349 -8.4034 -8.4034 -7.7059 -7.7059 -6.5219 -6.5219 -6.1062 -6.1062 -5.7497 -5.7497 -5.7044 -5.7044 -5.4648 -5.4648 -5.4509 -5.4509 -5.2140 -5.2140 -5.1027 -5.1027 -5.0180 -5.0180 -4.9770 -4.9770 -4.5999 -4.5999 -3.4140 -3.4140 -2.3982 -2.3982 -1.8945 -1.8945 -1.6497 -1.6497 -1.5044 -1.5044 -1.2604 -1.2604 -1.0291 -1.0291 -0.7348 -0.7348 -0.6686 -0.6686 3.6193 3.6193 4.0206 4.0206 5.9721 5.9721 6.0637 6.0637 6.5633 6.5633 7.7224 7.7224 k = 0.0000 0.0000 0.2769 ( 7638 PWs) bands (ev): -22.6455 -22.6455 -22.3302 -22.3302 -19.9649 -19.9649 -19.6914 -19.6914 -14.0766 -14.0766 -13.9936 -13.9936 -12.6519 -12.6519 -12.4908 -12.4908 -10.9043 -10.9043 -10.5368 -10.5368 -8.4046 -8.4046 -7.7042 -7.7042 -6.5243 -6.5243 -6.1033 -6.1033 -5.7482 -5.7482 -5.7079 -5.7079 -5.4666 -5.4666 -5.4444 -5.4444 -5.2065 -5.2065 -5.0995 -5.0995 -5.0237 -5.0237 -4.9838 -4.9838 -4.5993 -4.5993 -3.4197 -3.4197 -2.3959 -2.3959 -1.8944 -1.8944 -1.6431 -1.6431 -1.5085 -1.5085 -1.2590 -1.2590 -1.0290 -1.0290 -0.7340 -0.7340 -0.6740 -0.6740 3.6215 3.6215 4.0154 4.0154 5.9847 5.9847 6.0619 6.0619 6.6074 6.6074 7.6662 7.6662 k = 0.0000 0.0000 0.2923 ( 7637 PWs) bands (ev): -22.6453 -22.6453 -22.3304 -22.3304 -19.9650 -19.9650 -19.6913 -19.6913 -14.0721 -14.0721 -13.9988 -13.9988 -12.6501 -12.6501 -12.4909 -12.4909 -10.9039 -10.9039 -10.5386 -10.5386 -8.4056 -8.4056 -7.7026 -7.7026 -6.5264 -6.5264 -6.1009 -6.1009 -5.7466 -5.7466 -5.7113 -5.7113 -5.4683 -5.4683 -5.4384 -5.4384 -5.1982 -5.1982 -5.0965 -5.0965 -5.0294 -5.0294 -4.9911 -4.9911 -4.5987 -4.5987 -3.4250 -3.4250 -2.3938 -2.3938 -1.8944 -1.8944 -1.6359 -1.6359 -1.5132 -1.5132 -1.2579 -1.2579 -1.0286 -1.0286 -0.7331 -0.7331 -0.6792 -0.6792 3.6235 3.6235 4.0105 4.0105 5.9957 5.9957 6.0600 6.0600 6.6544 6.6544 7.6076 7.6076 k = 0.0000 0.0000 0.3077 ( 7633 PWs) bands (ev): -22.6452 -22.6452 -22.3305 -22.3305 -19.9650 -19.9650 -19.6912 -19.6912 -14.0675 -14.0675 -14.0041 -14.0041 -12.6485 -12.6485 -12.4910 -12.4910 -10.9036 -10.9036 -10.5402 -10.5402 -8.4066 -8.4066 -7.7012 -7.7012 -6.5282 -6.5282 -6.0988 -6.0988 -5.7448 -5.7448 -5.7145 -5.7145 -5.4698 -5.4698 -5.4331 -5.4331 -5.1891 -5.1891 -5.0937 -5.0937 -5.0350 -5.0350 -4.9988 -4.9988 -4.5982 -4.5982 -3.4297 -3.4297 -2.3919 -2.3919 -1.8944 -1.8944 -1.6282 -1.6282 -1.5187 -1.5187 -1.2571 -1.2571 -1.0280 -1.0280 -0.7319 -0.7319 -0.6842 -0.6842 3.6254 3.6254 4.0061 4.0061 6.0054 6.0054 6.0580 6.0580 6.7035 6.7035 7.5478 7.5478 k = 0.0000 0.0000 0.3231 ( 7629 PWs) bands (ev): -22.6451 -22.6451 -22.3306 -22.3306 -19.9651 -19.9651 -19.6912 -19.6912 -14.0627 -14.0627 -14.0095 -14.0095 -12.6470 -12.6470 -12.4911 -12.4911 -10.9033 -10.9033 -10.5416 -10.5416 -8.4074 -8.4074 -7.7000 -7.7000 -6.5298 -6.5298 -6.0971 -6.0971 -5.7429 -5.7429 -5.7176 -5.7176 -5.4713 -5.4713 -5.4285 -5.4285 -5.1797 -5.1797 -5.0910 -5.0910 -5.0406 -5.0406 -5.0066 -5.0066 -4.5977 -4.5977 -3.4339 -3.4339 -2.3902 -2.3902 -1.8944 -1.8944 -1.6203 -1.6203 -1.5246 -1.5246 -1.2565 -1.2565 -1.0274 -1.0274 -0.7306 -0.7306 -0.6889 -0.6889 3.6270 3.6270 4.0023 4.0023 6.0137 6.0137 6.0559 6.0559 6.7539 6.7539 7.4880 7.4880 k = 0.0000 0.0000 0.3385 ( 7633 PWs) bands (ev): -22.6450 -22.6450 -22.3307 -22.3307 -19.9651 -19.9651 -19.6911 -19.6911 -14.0577 -14.0577 -14.0149 -14.0149 -12.6459 -12.6459 -12.4911 -12.4911 -10.9031 -10.9031 -10.5427 -10.5427 -8.4081 -8.4081 -7.6990 -7.6990 -6.5310 -6.5310 -6.0958 -6.0958 -5.7409 -5.7409 -5.7205 -5.7205 -5.4724 -5.4724 -5.4247 -5.4247 -5.1703 -5.1703 -5.0887 -5.0887 -5.0459 -5.0459 -5.0141 -5.0141 -4.5973 -4.5973 -3.4374 -3.4374 -2.3888 -2.3888 -1.8945 -1.8945 -1.6123 -1.6123 -1.5309 -1.5309 -1.2561 -1.2561 -1.0268 -1.0268 -0.7291 -0.7291 -0.6931 -0.6931 3.6284 3.6284 3.9990 3.9990 6.0210 6.0210 6.0535 6.0535 6.8044 6.8044 7.4297 7.4297 k = 0.0000 0.0000 0.3538 ( 7633 PWs) bands (ev): -22.6450 -22.6450 -22.3308 -22.3308 -19.9652 -19.9652 -19.6911 -19.6911 -14.0527 -14.0527 -14.0203 -14.0203 -12.6449 -12.6449 -12.4912 -12.4912 -10.9029 -10.9029 -10.5437 -10.5437 -8.4086 -8.4086 -7.6982 -7.6982 -6.5320 -6.5320 -6.0948 -6.0948 -5.7387 -5.7387 -5.7233 -5.7233 -5.4734 -5.4734 -5.4217 -5.4217 -5.1614 -5.1614 -5.0869 -5.0869 -5.0507 -5.0507 -5.0208 -5.0208 -4.5970 -4.5970 -3.4401 -3.4401 -2.3877 -2.3877 -1.8945 -1.8945 -1.6046 -1.6046 -1.5372 -1.5372 -1.2559 -1.2559 -1.0263 -1.0263 -0.7276 -0.7276 -0.6969 -0.6969 3.6296 3.6296 3.9964 3.9964 6.0272 6.0272 6.0510 6.0510 6.8530 6.8530 7.3749 7.3749 k = 0.0000 0.0000 0.3692 ( 7630 PWs) bands (ev): -22.6449 -22.6449 -22.3308 -22.3308 -19.9652 -19.9652 -19.6911 -19.6911 -14.0476 -14.0476 -14.0257 -14.0257 -12.6443 -12.6443 -12.4912 -12.4912 -10.9027 -10.9027 -10.5443 -10.5443 -8.4090 -8.4090 -7.6976 -7.6976 -6.5327 -6.5327 -6.0941 -6.0941 -5.7365 -5.7365 -5.7260 -5.7260 -5.4741 -5.4741 -5.4195 -5.4195 -5.1539 -5.1539 -5.0858 -5.0858 -5.0546 -5.0546 -5.0261 -5.0261 -4.5967 -4.5967 -3.4421 -3.4421 -2.3869 -2.3869 -1.8946 -1.8946 -1.5977 -1.5977 -1.5431 -1.5431 -1.2558 -1.2558 -1.0258 -1.0258 -0.7262 -0.7262 -0.6999 -0.6999 3.6304 3.6304 3.9945 3.9945 6.0325 6.0325 6.0482 6.0482 6.8961 6.8961 7.3272 7.3272 k = 0.0000 0.0000 0.3846 ( 7629 PWs) bands (ev): -22.6449 -22.6449 -22.3309 -22.3309 -19.9652 -19.9652 -19.6911 -19.6911 -14.0426 -14.0426 -14.0309 -14.0309 -12.6438 -12.6438 -12.4913 -12.4913 -10.9027 -10.9027 -10.5447 -10.5447 -8.4092 -8.4092 -7.6973 -7.6973 -6.5331 -6.5331 -6.0937 -6.0937 -5.7343 -5.7343 -5.7285 -5.7285 -5.4745 -5.4745 -5.4181 -5.4181 -5.1487 -5.1487 -5.0854 -5.0854 -5.0572 -5.0572 -5.0295 -5.0295 -4.5966 -4.5966 -3.4433 -3.4433 -2.3864 -2.3864 -1.8946 -1.8946 -1.5925 -1.5925 -1.5477 -1.5477 -1.2557 -1.2557 -1.0255 -1.0255 -0.7252 -0.7252 -0.7019 -0.7019 3.6309 3.6309 3.9933 3.9933 6.0371 6.0371 6.0452 6.0452 6.9278 6.9278 7.2928 7.2928 k = 0.0000 0.0000 0.4000 ( 7626 PWs) bands (ev): -22.6449 -22.6449 -22.3309 -22.3309 -19.9652 -19.9652 -19.6910 -19.6910 -14.0391 -14.0391 -14.0345 -14.0345 -12.6437 -12.6437 -12.4913 -12.4913 -10.9026 -10.9026 -10.5449 -10.5449 -8.4093 -8.4093 -7.6971 -7.6971 -6.5333 -6.5333 -6.0936 -6.0936 -5.7328 -5.7328 -5.7301 -5.7301 -5.4747 -5.4747 -5.4177 -5.4177 -5.1468 -5.1468 -5.0853 -5.0853 -5.0580 -5.0580 -5.0307 -5.0307 -4.5965 -4.5965 -3.4437 -3.4437 -2.3863 -2.3863 -1.8946 -1.8946 -1.5905 -1.5905 -1.5495 -1.5495 -1.2557 -1.2557 -1.0254 -1.0254 -0.7248 -0.7248 -0.7027 -0.7027 3.6311 3.6311 3.9930 3.9930 6.0399 6.0399 6.0428 6.0428 6.9399 6.9399 7.2798 7.2798 k = 0.0000-0.3794 0.2079 ( 7622 PWs) bands (ev): -22.6462 -22.6462 -22.3290 -22.3290 -19.9658 -19.9658 -19.6912 -19.6912 -14.0568 -14.0568 -14.0225 -14.0225 -12.6113 -12.6113 -12.5061 -12.5061 -10.9415 -10.9415 -10.5378 -10.5378 -8.4021 -8.4021 -7.6562 -7.6562 -6.5072 -6.5072 -6.1764 -6.1764 -5.6993 -5.6993 -5.6550 -5.6550 -5.5293 -5.5293 -5.4865 -5.4865 -5.1327 -5.1327 -5.1054 -5.1054 -5.0272 -5.0272 -4.9544 -4.9544 -4.6097 -4.6097 -3.3416 -3.3416 -2.3939 -2.3939 -2.0008 -2.0008 -1.8743 -1.8743 -1.3721 -1.3721 -1.2491 -1.2491 -1.1038 -1.1038 -0.8109 -0.8109 -0.5476 -0.5476 3.5519 3.5519 4.2289 4.2289 5.8746 5.8746 6.4151 6.4151 6.9218 6.9218 7.1417 7.1417 k = 0.0000-0.3659 0.2005 ( 7631 PWs) bands (ev): -22.6462 -22.6462 -22.3290 -22.3290 -19.9658 -19.9658 -19.6912 -19.6912 -14.0575 -14.0575 -14.0218 -14.0218 -12.6115 -12.6115 -12.5060 -12.5060 -10.9414 -10.9414 -10.5377 -10.5377 -8.4021 -8.4021 -7.6564 -7.6564 -6.5071 -6.5071 -6.1764 -6.1764 -5.6995 -5.6995 -5.6552 -5.6552 -5.5291 -5.5291 -5.4863 -5.4863 -5.1329 -5.1329 -5.1049 -5.1049 -5.0277 -5.0277 -4.9545 -4.9545 -4.6097 -4.6097 -3.3415 -3.3415 -2.3941 -2.3941 -2.0005 -2.0005 -1.8737 -1.8737 -1.3722 -1.3722 -1.2498 -1.2498 -1.1031 -1.1031 -0.8107 -0.8107 -0.5477 -0.5477 3.5520 3.5520 4.2285 4.2285 5.8750 5.8750 6.4144 6.4144 6.9045 6.9045 7.1587 7.1587 k = 0.0000-0.3523 0.1931 ( 7622 PWs) bands (ev): -22.6462 -22.6462 -22.3290 -22.3290 -19.9658 -19.9658 -19.6912 -19.6912 -14.0593 -14.0593 -14.0198 -14.0198 -12.6124 -12.6124 -12.5057 -12.5057 -10.9411 -10.9411 -10.5375 -10.5375 -8.4019 -8.4019 -7.6571 -7.6571 -6.5068 -6.5068 -6.1763 -6.1763 -5.7001 -5.7001 -5.6559 -5.6559 -5.5287 -5.5287 -5.4859 -5.4859 -5.1334 -5.1334 -5.1034 -5.1034 -5.0290 -5.0290 -4.9548 -4.9548 -4.6095 -4.6095 -3.3415 -3.3415 -2.3947 -2.3947 -1.9996 -1.9996 -1.8720 -1.8720 -1.3725 -1.3725 -1.2520 -1.2520 -1.1011 -1.1011 -0.8102 -0.8102 -0.5481 -0.5481 3.5523 3.5523 4.2273 4.2273 5.8763 5.8763 6.4121 6.4121 6.8630 6.8630 7.1994 7.1994 k = 0.0000-0.3388 0.1856 ( 7625 PWs) bands (ev): -22.6462 -22.6462 -22.3290 -22.3290 -19.9657 -19.9657 -19.6913 -19.6913 -14.0620 -14.0620 -14.0168 -14.0168 -12.6137 -12.6137 -12.5052 -12.5052 -10.9406 -10.9406 -10.5370 -10.5370 -8.4017 -8.4017 -7.6583 -7.6583 -6.5064 -6.5064 -6.1763 -6.1763 -5.7011 -5.7011 -5.6569 -5.6569 -5.5280 -5.5280 -5.4851 -5.4851 -5.1342 -5.1342 -5.1011 -5.1011 -5.0311 -5.0311 -4.9553 -4.9553 -4.6092 -4.6092 -3.3413 -3.3413 -2.3956 -2.3956 -1.9981 -1.9981 -1.8692 -1.8692 -1.3731 -1.3731 -1.2554 -1.2554 -1.0979 -1.0979 -0.8093 -0.8093 -0.5487 -0.5487 3.5528 3.5528 4.2253 4.2253 5.8783 5.8783 6.4083 6.4083 6.8110 6.8110 7.2503 7.2503 k = 0.0000-0.3252 0.1782 ( 7621 PWs) bands (ev): -22.6462 -22.6462 -22.3290 -22.3290 -19.9657 -19.9657 -19.6913 -19.6913 -14.0651 -14.0651 -14.0132 -14.0132 -12.6155 -12.6155 -12.5045 -12.5045 -10.9399 -10.9399 -10.5364 -10.5364 -8.4014 -8.4014 -7.6599 -7.6599 -6.5058 -6.5058 -6.1762 -6.1762 -5.7025 -5.7025 -5.6582 -5.6582 -5.5270 -5.5270 -5.4841 -5.4841 -5.1351 -5.1351 -5.0984 -5.0984 -5.0337 -5.0337 -4.9560 -4.9560 -4.6088 -4.6088 -3.3412 -3.3412 -2.3968 -2.3968 -1.9960 -1.9960 -1.8653 -1.8653 -1.3738 -1.3738 -1.2599 -1.2599 -1.0938 -1.0938 -0.8081 -0.8081 -0.5496 -0.5496 3.5534 3.5534 4.2225 4.2225 5.8812 5.8812 6.4026 6.4026 6.7551 6.7551 7.3049 7.3049 k = 0.0000-0.3117 0.1708 ( 7625 PWs) bands (ev): -22.6463 -22.6463 -22.3289 -22.3289 -19.9656 -19.9656 -19.6913 -19.6913 -14.0686 -14.0686 -14.0092 -14.0092 -12.6177 -12.6177 -12.5037 -12.5037 -10.9390 -10.9390 -10.5356 -10.5356 -8.4010 -8.4010 -7.6619 -7.6619 -6.5050 -6.5050 -6.1761 -6.1761 -5.7042 -5.7042 -5.6598 -5.6598 -5.5259 -5.5259 -5.4828 -5.4828 -5.1360 -5.1360 -5.0957 -5.0957 -5.0366 -5.0366 -4.9568 -4.9568 -4.6084 -4.6084 -3.3410 -3.3410 -2.3984 -2.3984 -1.9932 -1.9932 -1.8605 -1.8605 -1.3747 -1.3747 -1.2652 -1.2652 -1.0889 -1.0889 -0.8065 -0.8065 -0.5507 -0.5507 3.5543 3.5543 4.2190 4.2190 5.8847 5.8847 6.3948 6.3948 6.6984 6.6984 7.3607 7.3607 k = 0.0000-0.2981 0.1634 ( 7625 PWs) bands (ev): -22.6463 -22.6463 -22.3289 -22.3289 -19.9656 -19.9656 -19.6914 -19.6914 -14.0722 -14.0722 -14.0049 -14.0049 -12.6204 -12.6204 -12.5028 -12.5028 -10.9379 -10.9379 -10.5347 -10.5347 -8.4005 -8.4005 -7.6644 -7.6644 -6.5041 -6.5041 -6.1760 -6.1760 -5.7062 -5.7062 -5.6616 -5.6616 -5.5246 -5.5246 -5.4813 -5.4813 -5.1369 -5.1369 -5.0935 -5.0935 -5.0391 -5.0391 -4.9578 -4.9578 -4.6079 -4.6079 -3.3407 -3.3407 -2.4001 -2.4001 -1.9899 -1.9899 -1.8549 -1.8549 -1.3758 -1.3758 -1.2712 -1.2712 -1.0835 -1.0835 -0.8046 -0.8046 -0.5520 -0.5520 3.5554 3.5554 4.2148 4.2148 5.8890 5.8890 6.3843 6.3843 6.6429 6.6429 7.4163 7.4163 k = 0.0000-0.2846 0.1559 ( 7626 PWs) bands (ev): -22.6464 -22.6464 -22.3289 -22.3289 -19.9655 -19.9655 -19.6914 -19.6914 -14.0758 -14.0758 -14.0005 -14.0005 -12.6233 -12.6233 -12.5019 -12.5019 -10.9367 -10.9367 -10.5336 -10.5336 -8.4000 -8.4000 -7.6672 -7.6672 -6.5030 -6.5030 -6.1758 -6.1758 -5.7086 -5.7086 -5.6634 -5.6634 -5.5233 -5.5233 -5.4796 -5.4796 -5.1378 -5.1378 -5.0925 -5.0925 -5.0407 -5.0407 -4.9590 -4.9590 -4.6073 -4.6073 -3.3404 -3.3404 -2.4020 -2.4020 -1.9860 -1.9860 -1.8485 -1.8485 -1.3772 -1.3772 -1.2774 -1.2774 -1.0777 -1.0777 -0.8023 -0.8023 -0.5535 -0.5535 3.5566 3.5566 4.2100 4.2100 5.8939 5.8939 6.3702 6.3702 6.5903 6.5903 7.4710 7.4710 k = 0.0000-0.2710 0.1485 ( 7628 PWs) bands (ev): -22.6465 -22.6465 -22.3288 -22.3288 -19.9654 -19.9654 -19.6915 -19.6915 -14.0794 -14.0794 -13.9959 -13.9959 -12.6266 -12.6266 -12.5008 -12.5008 -10.9353 -10.9353 -10.5324 -10.5324 -8.3993 -8.3993 -7.6703 -7.6703 -6.5017 -6.5017 -6.1756 -6.1756 -5.7113 -5.7113 -5.6653 -5.6653 -5.5221 -5.5221 -5.4777 -5.4777 -5.1386 -5.1386 -5.0934 -5.0934 -5.0406 -5.0406 -4.9603 -4.9603 -4.6068 -4.6068 -3.3401 -3.3401 -2.4041 -2.4041 -1.9816 -1.9816 -1.8415 -1.8415 -1.3789 -1.3789 -1.2838 -1.2838 -1.0719 -1.0719 -0.7998 -0.7998 -0.5553 -0.5553 3.5580 3.5580 4.2045 4.2045 5.8993 5.8993 6.3511 6.3511 6.5426 6.5426 7.5242 7.5242 k = 0.0000-0.2575 0.1411 ( 7624 PWs) bands (ev): -22.6465 -22.6465 -22.3288 -22.3288 -19.9653 -19.9653 -19.6915 -19.6915 -14.0830 -14.0830 -13.9914 -13.9914 -12.6300 -12.6300 -12.4998 -12.4998 -10.9338 -10.9338 -10.5311 -10.5311 -8.3987 -8.3987 -7.6737 -7.6737 -6.5004 -6.5004 -6.1753 -6.1753 -5.7142 -5.7142 -5.6670 -5.6670 -5.5210 -5.5210 -5.4756 -5.4756 -5.1394 -5.1394 -5.0966 -5.0966 -5.0385 -5.0385 -4.9617 -4.9617 -4.6062 -4.6062 -3.3397 -3.3397 -2.4063 -2.4063 -1.9767 -1.9767 -1.8340 -1.8340 -1.3809 -1.3809 -1.2901 -1.2901 -1.0660 -1.0660 -0.7969 -0.7969 -0.5572 -0.5572 3.5596 3.5596 4.1985 4.1985 5.9051 5.9051 6.3255 6.3255 6.5019 6.5019 7.5756 7.5756 k = 0.0000-0.2439 0.1337 ( 7633 PWs) bands (ev): -22.6466 -22.6466 -22.3287 -22.3287 -19.9652 -19.9652 -19.6916 -19.6916 -14.0865 -14.0865 -13.9869 -13.9869 -12.6337 -12.6337 -12.4988 -12.4988 -10.9323 -10.9323 -10.5297 -10.5297 -8.3979 -8.3979 -7.6774 -7.6774 -6.4989 -6.4989 -6.1751 -6.1751 -5.7173 -5.7173 -5.6685 -5.6685 -5.5201 -5.5201 -5.4734 -5.4734 -5.1402 -5.1402 -5.1017 -5.1017 -5.0346 -5.0346 -4.9632 -4.9632 -4.6058 -4.6058 -3.3393 -3.3393 -2.4085 -2.4085 -1.9714 -1.9714 -1.8260 -1.8260 -1.3835 -1.3835 -1.2960 -1.2960 -1.0602 -1.0602 -0.7938 -0.7938 -0.5594 -0.5594 3.5614 3.5614 4.1920 4.1920 5.9112 5.9112 6.2930 6.2930 6.4692 6.4692 7.6247 7.6247 k = 0.0000-0.2304 0.1262 ( 7639 PWs) bands (ev): -22.6467 -22.6467 -22.3286 -22.3286 -19.9651 -19.9651 -19.6917 -19.6917 -14.0898 -14.0898 -13.9824 -13.9824 -12.6374 -12.6374 -12.4978 -12.4978 -10.9306 -10.9306 -10.5282 -10.5282 -8.3971 -8.3971 -7.6814 -7.6814 -6.4973 -6.4973 -6.1747 -6.1747 -5.7206 -5.7206 -5.6697 -5.6697 -5.5195 -5.5195 -5.4711 -5.4711 -5.1410 -5.1410 -5.1081 -5.1081 -5.0295 -5.0295 -4.9647 -4.9647 -4.6053 -4.6053 -3.3389 -3.3389 -2.4106 -2.4106 -1.9657 -1.9657 -1.8177 -1.8177 -1.3867 -1.3867 -1.3013 -1.3013 -1.0546 -1.0546 -0.7905 -0.7905 -0.5617 -0.5617 3.5633 3.5633 4.1851 4.1851 5.9172 5.9172 6.2547 6.2547 6.4438 6.4438 7.6712 7.6712 k = 0.0000-0.2168 0.1188 ( 7642 PWs) bands (ev): -22.6468 -22.6468 -22.3286 -22.3286 -19.9649 -19.9649 -19.6917 -19.6917 -14.0930 -14.0930 -13.9781 -13.9781 -12.6413 -12.6413 -12.4968 -12.4968 -10.9289 -10.9289 -10.5266 -10.5266 -8.3963 -8.3963 -7.6854 -7.6854 -6.4957 -6.4957 -6.1744 -6.1744 -5.7240 -5.7240 -5.6706 -5.6706 -5.5193 -5.5193 -5.4686 -5.4686 -5.1420 -5.1420 -5.1153 -5.1153 -5.0236 -5.0236 -4.9661 -4.9661 -4.6050 -4.6050 -3.3385 -3.3385 -2.4128 -2.4128 -1.9598 -1.9598 -1.8090 -1.8090 -1.3908 -1.3908 -1.3058 -1.3058 -1.0492 -1.0492 -0.7869 -0.7869 -0.5642 -0.5642 3.5653 3.5653 4.1778 4.1778 5.9230 5.9230 6.2133 6.2133 6.4236 6.4236 7.7146 7.7146 k = 0.0000-0.2033 0.1114 ( 7640 PWs) bands (ev): -22.6468 -22.6468 -22.3285 -22.3285 -19.9648 -19.9648 -19.6918 -19.6918 -14.0961 -14.0961 -13.9738 -13.9738 -12.6451 -12.6451 -12.4959 -12.4959 -10.9271 -10.9271 -10.5250 -10.5250 -8.3954 -8.3954 -7.6896 -7.6896 -6.4940 -6.4940 -6.1740 -6.1740 -5.7275 -5.7275 -5.6711 -5.6711 -5.5197 -5.5197 -5.4660 -5.4660 -5.1434 -5.1434 -5.1225 -5.1225 -5.0173 -5.0173 -4.9674 -4.9674 -4.6047 -4.6047 -3.3380 -3.3380 -2.4149 -2.4149 -1.9536 -1.9536 -1.8001 -1.8001 -1.3959 -1.3959 -1.3091 -1.3091 -1.0442 -1.0442 -0.7831 -0.7831 -0.5669 -0.5669 3.5675 3.5675 4.1703 4.1703 5.9278 5.9278 6.1715 6.1715 6.4069 6.4069 7.7545 7.7545 k = 0.0000-0.1897 0.1040 ( 7642 PWs) bands (ev): -22.6469 -22.6469 -22.3285 -22.3285 -19.9647 -19.9647 -19.6919 -19.6919 -14.0990 -14.0990 -13.9697 -13.9697 -12.6489 -12.6489 -12.4950 -12.4950 -10.9253 -10.9253 -10.5234 -10.5234 -8.3945 -8.3945 -7.6939 -7.6939 -6.4923 -6.4923 -6.1735 -6.1735 -5.7310 -5.7310 -5.6712 -5.6712 -5.5206 -5.5206 -5.4633 -5.4633 -5.1459 -5.1459 -5.1289 -5.1289 -5.0111 -5.0111 -4.9684 -4.9684 -4.6045 -4.6045 -3.3375 -3.3375 -2.4168 -2.4168 -1.9474 -1.9474 -1.7909 -1.7909 -1.4022 -1.4022 -1.3113 -1.3113 -1.0396 -1.0396 -0.7792 -0.7792 -0.5697 -0.5697 3.5697 3.5697 4.1626 4.1626 5.9308 5.9308 6.1317 6.1317 6.3923 6.3923 7.7905 7.7905 k = 0.0000-0.1762 0.0965 ( 7641 PWs) bands (ev): -22.6470 -22.6470 -22.3284 -22.3284 -19.9645 -19.9645 -19.6919 -19.6919 -14.1017 -14.1017 -13.9658 -13.9658 -12.6527 -12.6527 -12.4943 -12.4943 -10.9235 -10.9235 -10.5218 -10.5218 -8.3936 -8.3936 -7.6981 -7.6981 -6.4905 -6.4905 -6.1731 -6.1731 -5.7345 -5.7345 -5.6708 -5.6708 -5.5222 -5.5222 -5.4606 -5.4606 -5.1502 -5.1502 -5.1334 -5.1334 -5.0055 -5.0055 -4.9688 -4.9688 -4.6044 -4.6044 -3.3370 -3.3370 -2.4187 -2.4187 -1.9413 -1.9413 -1.7815 -1.7815 -1.4095 -1.4095 -1.3123 -1.3123 -1.0354 -1.0354 -0.7751 -0.7751 -0.5726 -0.5726 3.5720 3.5720 4.1548 4.1548 5.9304 5.9304 6.0967 6.0967 6.3790 6.3790 7.8222 7.8222 k = 0.0000-0.1626 0.0891 ( 7647 PWs) bands (ev): -22.6471 -22.6471 -22.3283 -22.3283 -19.9644 -19.9644 -19.6920 -19.6920 -14.1042 -14.1042 -13.9620 -13.9620 -12.6563 -12.6563 -12.4935 -12.4935 -10.9217 -10.9217 -10.5201 -10.5201 -8.3927 -8.3927 -7.7024 -7.7024 -6.4888 -6.4888 -6.1726 -6.1726 -5.7379 -5.7379 -5.6698 -5.6698 -5.5244 -5.5244 -5.4579 -5.4579 -5.1562 -5.1562 -5.1359 -5.1359 -5.0007 -5.0007 -4.9684 -4.9684 -4.6043 -4.6043 -3.3366 -3.3366 -2.4204 -2.4204 -1.9353 -1.9353 -1.7718 -1.7718 -1.4179 -1.4179 -1.3122 -1.3122 -1.0316 -1.0316 -0.7709 -0.7709 -0.5756 -0.5756 3.5743 3.5743 4.1471 4.1471 5.9242 5.9242 6.0694 6.0694 6.3665 6.3665 7.8495 7.8495 k = 0.0000-0.1491 0.0817 ( 7638 PWs) bands (ev): -22.6472 -22.6472 -22.3283 -22.3283 -19.9643 -19.9643 -19.6921 -19.6921 -14.1066 -14.1066 -13.9585 -13.9585 -12.6598 -12.6598 -12.4929 -12.4929 -10.9200 -10.9200 -10.5186 -10.5186 -8.3917 -8.3917 -7.7065 -7.7065 -6.4870 -6.4870 -6.1721 -6.1721 -5.7412 -5.7412 -5.6683 -5.6683 -5.5273 -5.5273 -5.4552 -5.4552 -5.1631 -5.1631 -5.1372 -5.1372 -4.9974 -4.9974 -4.9667 -4.9667 -4.6044 -4.6044 -3.3361 -3.3361 -2.4220 -2.4220 -1.9295 -1.9295 -1.7618 -1.7618 -1.4272 -1.4272 -1.3111 -1.3111 -1.0283 -1.0283 -0.7667 -0.7667 -0.5786 -0.5786 3.5767 3.5767 4.1395 4.1395 5.9102 5.9102 6.0521 6.0521 6.3546 6.3546 7.8723 7.8723 k = 0.0000-0.1355 0.0743 ( 7641 PWs) bands (ev): -22.6472 -22.6472 -22.3282 -22.3282 -19.9642 -19.9642 -19.6921 -19.6921 -14.1088 -14.1088 -13.9552 -13.9552 -12.6632 -12.6632 -12.4923 -12.4923 -10.9184 -10.9184 -10.5170 -10.5170 -8.3909 -8.3909 -7.7105 -7.7105 -6.4854 -6.4854 -6.1716 -6.1716 -5.7443 -5.7443 -5.6663 -5.6663 -5.5309 -5.5309 -5.4526 -5.4526 -5.1701 -5.1701 -5.1379 -5.1379 -4.9956 -4.9956 -4.9637 -4.9637 -4.6045 -4.6045 -3.3356 -3.3356 -2.4235 -2.4235 -1.9241 -1.9241 -1.7516 -1.7516 -1.4372 -1.4372 -1.3093 -1.3093 -1.0254 -1.0254 -0.7625 -0.7625 -0.5817 -0.5817 3.5791 3.5791 4.1321 4.1321 5.8893 5.8893 6.0445 6.0445 6.3431 6.3431 7.8909 7.8909 k = 0.0000-0.1220 0.0668 ( 7638 PWs) bands (ev): -22.6473 -22.6473 -22.3282 -22.3282 -19.9641 -19.9641 -19.6922 -19.6922 -14.1107 -14.1107 -13.9521 -13.9521 -12.6663 -12.6663 -12.4918 -12.4918 -10.9168 -10.9168 -10.5156 -10.5156 -8.3900 -8.3900 -7.7142 -7.7142 -6.4838 -6.4838 -6.1710 -6.1710 -5.7472 -5.7472 -5.6637 -5.6637 -5.5352 -5.5352 -5.4501 -5.4501 -5.1767 -5.1767 -5.1383 -5.1383 -4.9951 -4.9951 -4.9598 -4.9598 -4.6046 -4.6046 -3.3352 -3.3352 -2.4248 -2.4248 -1.9192 -1.9192 -1.7411 -1.7411 -1.4478 -1.4478 -1.3070 -1.3070 -1.0229 -1.0229 -0.7583 -0.7583 -0.5848 -0.5848 3.5814 3.5814 4.1250 4.1250 5.8644 5.8644 6.0436 6.0436 6.3322 6.3322 7.9057 7.9057 k = 0.0000-0.1084 0.0594 ( 7644 PWs) bands (ev): -22.6474 -22.6474 -22.3281 -22.3281 -19.9640 -19.9640 -19.6923 -19.6923 -14.1125 -14.1125 -13.9493 -13.9493 -12.6691 -12.6691 -12.4914 -12.4914 -10.9154 -10.9154 -10.5143 -10.5143 -8.3892 -8.3892 -7.7178 -7.7178 -6.4823 -6.4823 -6.1706 -6.1706 -5.7499 -5.7499 -5.6606 -5.6606 -5.5401 -5.5401 -5.4478 -5.4478 -5.1827 -5.1827 -5.1385 -5.1385 -4.9955 -4.9955 -4.9554 -4.9554 -4.6049 -4.6049 -3.3348 -3.3348 -2.4260 -2.4260 -1.9147 -1.9147 -1.7304 -1.7304 -1.4588 -1.4588 -1.3043 -1.3043 -1.0208 -1.0208 -0.7542 -0.7542 -0.5878 -0.5878 3.5836 3.5836 4.1183 4.1183 5.8386 5.8386 6.0466 6.0466 6.3217 6.3217 7.9171 7.9171 k = 0.0000-0.0949 0.0520 ( 7635 PWs) bands (ev): -22.6474 -22.6474 -22.3281 -22.3281 -19.9639 -19.9639 -19.6923 -19.6923 -14.1141 -14.1141 -13.9468 -13.9468 -12.6717 -12.6717 -12.4910 -12.4910 -10.9140 -10.9140 -10.5130 -10.5130 -8.3885 -8.3885 -7.7210 -7.7210 -6.4809 -6.4809 -6.1701 -6.1701 -5.7523 -5.7523 -5.6570 -5.6570 -5.5454 -5.5454 -5.4457 -5.4457 -5.1882 -5.1882 -5.1387 -5.1387 -4.9962 -4.9962 -4.9510 -4.9510 -4.6051 -4.6051 -3.3344 -3.3344 -2.4270 -2.4270 -1.9107 -1.9107 -1.7196 -1.7196 -1.4700 -1.4700 -1.3015 -1.3015 -1.0191 -1.0191 -0.7503 -0.7503 -0.5908 -0.5908 3.5856 3.5856 4.1122 4.1122 5.8139 5.8139 6.0515 6.0515 6.3119 6.3119 7.9258 7.9258 k = 0.0000-0.0813 0.0446 ( 7633 PWs) bands (ev): -22.6475 -22.6475 -22.3280 -22.3280 -19.9638 -19.9638 -19.6924 -19.6924 -14.1155 -14.1155 -13.9446 -13.9446 -12.6740 -12.6740 -12.4907 -12.4907 -10.9129 -10.9129 -10.5119 -10.5119 -8.3878 -8.3878 -7.7239 -7.7239 -6.4796 -6.4796 -6.1697 -6.1697 -5.7545 -5.7545 -5.6530 -5.6530 -5.5512 -5.5512 -5.4438 -5.4438 -5.1929 -5.1929 -5.1387 -5.1387 -4.9972 -4.9972 -4.9468 -4.9468 -4.6053 -4.6053 -3.3341 -3.3341 -2.4279 -2.4279 -1.9073 -1.9073 -1.7088 -1.7088 -1.4811 -1.4811 -1.2986 -1.2986 -1.0177 -1.0177 -0.7467 -0.7467 -0.5935 -0.5935 3.5875 3.5875 4.1066 4.1066 5.7913 5.7913 6.0574 6.0574 6.3027 6.3027 7.9324 7.9324 k = 0.0000-0.0678 0.0371 ( 7625 PWs) bands (ev): -22.6475 -22.6475 -22.3280 -22.3280 -19.9637 -19.9637 -19.6924 -19.6924 -14.1166 -14.1166 -13.9428 -13.9428 -12.6760 -12.6760 -12.4905 -12.4905 -10.9118 -10.9118 -10.5110 -10.5110 -8.3872 -8.3872 -7.7264 -7.7264 -6.4785 -6.4785 -6.1693 -6.1693 -5.7563 -5.7563 -5.6487 -5.6487 -5.5571 -5.5571 -5.4421 -5.4421 -5.1968 -5.1968 -5.1388 -5.1388 -4.9982 -4.9982 -4.9430 -4.9430 -4.6055 -4.6055 -3.3337 -3.3337 -2.4286 -2.4286 -1.9045 -1.9045 -1.6984 -1.6984 -1.4919 -1.4919 -1.2959 -1.2959 -1.0167 -1.0167 -0.7434 -0.7434 -0.5960 -0.5960 3.5892 3.5892 4.1018 4.1018 5.7715 5.7715 6.0633 6.0633 6.2944 6.2944 7.9373 7.9373 k = 0.0000-0.0542 0.0297 ( 7623 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9636 -19.9636 -19.6924 -19.6924 -14.1176 -14.1176 -13.9412 -13.9412 -12.6776 -12.6776 -12.4902 -12.4902 -10.9110 -10.9110 -10.5102 -10.5102 -8.3867 -8.3867 -7.7285 -7.7285 -6.4776 -6.4776 -6.1689 -6.1689 -5.7579 -5.7579 -5.6443 -5.6443 -5.5630 -5.5630 -5.4407 -5.4407 -5.2001 -5.2001 -5.1388 -5.1388 -4.9991 -4.9991 -4.9398 -4.9398 -4.6057 -4.6057 -3.3335 -3.3335 -2.4292 -2.4292 -1.9022 -1.9022 -1.6886 -1.6886 -1.5020 -1.5020 -1.2935 -1.2935 -1.0158 -1.0158 -0.7405 -0.7405 -0.5982 -0.5982 3.5907 3.5907 4.0977 4.0977 5.7549 5.7549 6.0690 6.0690 6.2871 6.2871 7.9410 7.9410 k = 0.0000-0.0407 0.0223 ( 7619 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9636 -19.9636 -19.6925 -19.6925 -14.1183 -14.1183 -13.9400 -13.9400 -12.6789 -12.6789 -12.4901 -12.4901 -10.9103 -10.9103 -10.5095 -10.5095 -8.3863 -8.3863 -7.7302 -7.7302 -6.4769 -6.4769 -6.1687 -6.1687 -5.7591 -5.7591 -5.6400 -5.6400 -5.5684 -5.5684 -5.4396 -5.4396 -5.2026 -5.2026 -5.1387 -5.1387 -4.9999 -4.9999 -4.9372 -4.9372 -4.6059 -4.6059 -3.3333 -3.3333 -2.4296 -2.4296 -1.9004 -1.9004 -1.6799 -1.6799 -1.5109 -1.5109 -1.2915 -1.2915 -1.0153 -1.0153 -0.7382 -0.7382 -0.6000 -0.6000 3.5918 3.5918 4.0945 4.0945 5.7417 5.7417 6.0739 6.0739 6.2811 6.2811 7.9436 7.9436 k = 0.0000-0.0271 0.0149 ( 7614 PWs) bands (ev): -22.6476 -22.6476 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1188 -14.1188 -13.9391 -13.9391 -12.6799 -12.6799 -12.4900 -12.4900 -10.9098 -10.9098 -10.5091 -10.5091 -8.3861 -8.3861 -7.7314 -7.7314 -6.4764 -6.4764 -6.1685 -6.1685 -5.7600 -5.7600 -5.6363 -5.6363 -5.5731 -5.5731 -5.4389 -5.4389 -5.2043 -5.2043 -5.1387 -5.1387 -5.0005 -5.0005 -4.9353 -4.9353 -4.6061 -4.6061 -3.3331 -3.3331 -2.4300 -2.4300 -1.8991 -1.8991 -1.6730 -1.6730 -1.5181 -1.5181 -1.2900 -1.2900 -1.0149 -1.0149 -0.7364 -0.7364 -0.6014 -0.6014 3.5927 3.5927 4.0921 4.0921 5.7322 5.7322 6.0776 6.0776 6.2766 6.2766 7.9453 7.9453 k = 0.0000-0.0136 0.0074 ( 7618 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1192 -14.1192 -13.9386 -13.9386 -12.6804 -12.6804 -12.4899 -12.4899 -10.9095 -10.9095 -10.5088 -10.5088 -8.3859 -8.3859 -7.7321 -7.7321 -6.4761 -6.4761 -6.1684 -6.1684 -5.7605 -5.7605 -5.6337 -5.6337 -5.5763 -5.5763 -5.4384 -5.4384 -5.2054 -5.2054 -5.1387 -5.1387 -5.0008 -5.0008 -4.9342 -4.9342 -4.6061 -4.6061 -3.3331 -3.3331 -2.4301 -2.4301 -1.8984 -1.8984 -1.6684 -1.6684 -1.5227 -1.5227 -1.2891 -1.2891 -1.0146 -1.0146 -0.7354 -0.7354 -0.6022 -0.6022 3.5932 3.5932 4.0907 4.0907 5.7265 5.7265 6.0800 6.0800 6.2737 6.2737 7.9463 7.9463 k = 0.0000 0.0000 0.0000 ( 7611 PWs) bands (ev): -22.6477 -22.6477 -22.3279 -22.3279 -19.9635 -19.9635 -19.6925 -19.6925 -14.1193 -14.1193 -13.9384 -13.9384 -12.6806 -12.6806 -12.4899 -12.4899 -10.9094 -10.9094 -10.5087 -10.5087 -8.3858 -8.3858 -7.7324 -7.7324 -6.4759 -6.4759 -6.1683 -6.1683 -5.7607 -5.7607 -5.6327 -5.6327 -5.5774 -5.5774 -5.4382 -5.4382 -5.2057 -5.2057 -5.1387 -5.1387 -5.0010 -5.0010 -4.9338 -4.9338 -4.6062 -4.6062 -3.3330 -3.3330 -2.4302 -2.4302 -1.8981 -1.8981 -1.6668 -1.6668 -1.5244 -1.5244 -1.2888 -1.2888 -1.0146 -1.0146 -0.7350 -0.7350 -0.6025 -0.6025 3.5934 3.5934 4.0902 4.0902 5.7246 5.7246 6.0808 6.0808 6.2728 6.2728 7.9467 7.9467 Writing output data file H2C2O.save init_run : 0.16s CPU 0.30s WALL ( 1 calls) electrons : 315.11s CPU 319.16s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 315.11s CPU 319.15s 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 : 0.04s CPU 0.04s WALL ( 242 calls) cegterg : 291.96s CPU 295.28s WALL ( 484 calls) Called by sum_band: Called by *egterg: h_psi : 155.25s CPU 158.69s WALL ( 6845 calls) s_psi : 5.34s CPU 5.52s WALL ( 6845 calls) g_psi : 0.26s CPU 0.25s WALL ( 6119 calls) cdiaghg : 121.81s CPU 122.00s WALL ( 6361 calls) cegterg:over : 12.58s CPU 12.57s WALL ( 6119 calls) cegterg:upda : 8.20s CPU 8.20s WALL ( 6119 calls) cegterg:last : 4.26s CPU 4.28s WALL ( 968 calls) cdiaghg:chol : 5.37s CPU 5.31s WALL ( 6361 calls) cdiaghg:inve : 3.88s CPU 3.90s WALL ( 6361 calls) cdiaghg:para : 7.44s CPU 7.56s WALL ( 12722 calls) Called by h_psi: h_psi:vloc : 140.35s CPU 143.71s WALL ( 6845 calls) h_psi:vnl : 14.62s CPU 14.70s WALL ( 6845 calls) add_vuspsi : 5.95s CPU 6.13s WALL ( 6845 calls) General routines calbec : 8.64s CPU 8.55s WALL ( 6845 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 133.23s CPU 136.59s WALL ( 973796 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.14s CPU 0.19s WALL ( 484 calls) Parallel routines fft_scatter : 87.68s CPU 89.77s WALL ( 973819 calls) PWSCF : 5m49.46s CPU 6m 8.19s WALL This run was terminated on: 4:33:15 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=