Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:16: 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 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Si.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 16 16 5 198 198 35 Max 17 17 6 202 202 37 Sum 607 607 189 7205 7205 1285 Message from routine sym_rho_init: likely internal error: no G-vectors found bravais-lattice index = 14 lattice parameter (alat) = 6.6282 a.u. unit-cell volume = 183.4913 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 1 number of electrons = 8.00 number of Kohn-Sham states= 16 kinetic-energy cutoff = 44.0000 Ry charge density cutoff = 176.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.628177 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.735723 celldm(5)= -0.176259 celldm(6)= -0.088018 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.088018 0.996119 0.000000 ) a(3) = ( -0.176259 -0.754164 0.632590 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.088361 0.383974 ) b(2) = ( 0.000000 1.003896 1.196829 ) b(3) = ( 0.000000 0.000000 1.580803 ) PseudoPot. # 1 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 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 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Si 4.00 28.08550 Si( 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= 575 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017391 k( 2) = ( -0.0040306 0.0036901 0.0096478), wk = 0.0017391 k( 3) = ( -0.0080611 0.0073803 0.0192956), wk = 0.0017391 k( 4) = ( -0.0120917 0.0110704 0.0289435), wk = 0.0017391 k( 5) = ( -0.0161223 0.0147605 0.0385913), wk = 0.0017391 k( 6) = ( -0.0201529 0.0184507 0.0482391), wk = 0.0017391 k( 7) = ( -0.0241834 0.0221408 0.0578869), wk = 0.0017391 k( 8) = ( -0.0282140 0.0258309 0.0675347), wk = 0.0017391 k( 9) = ( -0.0322446 0.0295211 0.0771826), wk = 0.0017391 k( 10) = ( -0.0362752 0.0332112 0.0868304), wk = 0.0017391 k( 11) = ( -0.0403057 0.0369013 0.0964782), wk = 0.0017391 k( 12) = ( -0.0443363 0.0405915 0.1061260), wk = 0.0017391 k( 13) = ( -0.0483669 0.0442816 0.1157738), wk = 0.0017391 k( 14) = ( -0.0523974 0.0479717 0.1254216), wk = 0.0017391 k( 15) = ( -0.0564280 0.0516619 0.1350695), wk = 0.0017391 k( 16) = ( -0.0604586 0.0553520 0.1447173), wk = 0.0017391 k( 17) = ( -0.0644892 0.0590421 0.1543651), wk = 0.0017391 k( 18) = ( -0.0685198 0.0627323 0.1640129), wk = 0.0017391 k( 19) = ( -0.0725503 0.0664224 0.1736607), wk = 0.0017391 k( 20) = ( -0.0765809 0.0701125 0.1833085), wk = 0.0017391 k( 21) = ( -0.0806115 0.0738026 0.1929564), wk = 0.0017391 k( 22) = ( -0.0846420 0.0774928 0.2026042), wk = 0.0017391 k( 23) = ( -0.0886726 0.0811829 0.2122520), wk = 0.0017391 k( 24) = ( -0.0927032 0.0848730 0.2218998), wk = 0.0017391 k( 25) = ( -0.0967338 0.0885632 0.2315476), wk = 0.0017391 k( 26) = ( -0.1007643 0.0922533 0.2411954), wk = 0.0017391 k( 27) = ( -0.1047949 0.0959434 0.2508433), wk = 0.0017391 k( 28) = ( -0.1088255 0.0996336 0.2604911), wk = 0.0017391 k( 29) = ( -0.1128560 0.1033237 0.2701389), wk = 0.0017391 k( 30) = ( -0.1168866 0.1070138 0.2797867), wk = 0.0017391 k( 31) = ( -0.1209172 0.1107040 0.2894345), wk = 0.0017391 k( 32) = ( -0.1249478 0.1143941 0.2990824), wk = 0.0017391 k( 33) = ( -0.1289783 0.1180842 0.3087302), wk = 0.0017391 k( 34) = ( -0.1330089 0.1217744 0.3183780), wk = 0.0017391 k( 35) = ( -0.1370395 0.1254645 0.3280258), wk = 0.0017391 k( 36) = ( -0.1410701 0.1291546 0.3376736), wk = 0.0017391 k( 37) = ( -0.1451006 0.1328448 0.3473214), wk = 0.0017391 k( 38) = ( -0.1491312 0.1365349 0.3569693), wk = 0.0017391 k( 39) = ( -0.1531618 0.1402250 0.3666171), wk = 0.0017391 k( 40) = ( -0.1571924 0.1439152 0.3762649), wk = 0.0017391 k( 41) = ( -0.1612229 0.1476053 0.3859127), wk = 0.0017391 k( 42) = ( -0.1652535 0.1512954 0.3955605), wk = 0.0017391 k( 43) = ( -0.1692841 0.1549856 0.4052084), wk = 0.0017391 k( 44) = ( -0.1733146 0.1586757 0.4148562), wk = 0.0017391 k( 45) = ( -0.1773452 0.1623658 0.4245040), wk = 0.0017391 k( 46) = ( -0.1813758 0.1660560 0.4341518), wk = 0.0017391 k( 47) = ( -0.1854064 0.1697461 0.4437996), wk = 0.0017391 k( 48) = ( -0.1894369 0.1734362 0.4534475), wk = 0.0017391 k( 49) = ( -0.1934675 0.1771264 0.4630953), wk = 0.0017391 k( 50) = ( -0.1974981 0.1808165 0.4727431), wk = 0.0017391 k( 51) = ( -0.2015287 0.1845066 0.4823909), wk = 0.0017391 k( 52) = ( -0.2055592 0.1881967 0.4920387), wk = 0.0017391 k( 53) = ( -0.2095898 0.1918869 0.5016865), wk = 0.0017391 k( 54) = ( -0.2136204 0.1955770 0.5113344), wk = 0.0017391 k( 55) = ( -0.2176510 0.1992671 0.5209822), wk = 0.0017391 k( 56) = ( -0.2216815 0.2029573 0.5306300), wk = 0.0017391 k( 57) = ( -0.2257121 0.2066474 0.5402778), wk = 0.0017391 k( 58) = ( -0.2297427 0.2103375 0.5499256), wk = 0.0017391 k( 59) = ( -0.2337732 0.2140277 0.5595734), wk = 0.0017391 k( 60) = ( -0.2378038 0.2177178 0.5692213), wk = 0.0017391 k( 61) = ( -0.2418344 0.2214079 0.5788691), wk = 0.0017391 k( 62) = ( -0.2458650 0.2250981 0.5885169), wk = 0.0017391 k( 63) = ( -0.2498955 0.2287882 0.5981647), wk = 0.0017391 k( 64) = ( -0.2539261 0.2324783 0.6078125), wk = 0.0017391 k( 65) = ( -0.2579567 0.2361685 0.6174603), wk = 0.0017391 k( 66) = ( -0.2619873 0.2398586 0.6271082), wk = 0.0017391 k( 67) = ( -0.2660178 0.2435487 0.6367560), wk = 0.0017391 k( 68) = ( -0.2700484 0.2472389 0.6464038), wk = 0.0017391 k( 69) = ( -0.2740790 0.2509290 0.6560516), wk = 0.0017391 k( 70) = ( -0.2781096 0.2546191 0.6656994), wk = 0.0017391 k( 71) = ( -0.2821401 0.2583093 0.6753473), wk = 0.0017391 k( 72) = ( -0.2861707 0.2619994 0.6849951), wk = 0.0017391 k( 73) = ( -0.2902013 0.2656895 0.6946429), wk = 0.0017391 k( 74) = ( -0.2942319 0.2693797 0.7042907), wk = 0.0017391 k( 75) = ( -0.2982624 0.2730698 0.7139385), wk = 0.0017391 k( 76) = ( -0.3022930 0.2767599 0.7235864), wk = 0.0017391 k( 77) = ( -0.3063236 0.2804501 0.7332342), wk = 0.0017391 k( 78) = ( -0.3103541 0.2841402 0.7428820), wk = 0.0017391 k( 79) = ( -0.3143847 0.2878303 0.7525298), wk = 0.0017391 k( 80) = ( -0.3184153 0.2915204 0.7621776), wk = 0.0017391 k( 81) = ( -0.3224459 0.2952106 0.7718254), wk = 0.0017391 k( 82) = ( -0.3224459 0.2952106 0.7718254), wk = 0.0017391 k( 83) = ( -0.3163985 0.2896740 0.7764695), wk = 0.0017391 k( 84) = ( -0.3103511 0.2841374 0.7811136), wk = 0.0017391 k( 85) = ( -0.3043038 0.2786009 0.7857576), wk = 0.0017391 k( 86) = ( -0.2982564 0.2730643 0.7904017), wk = 0.0017391 k( 87) = ( -0.2982564 0.2730643 0.7904017), wk = 0.0017391 k( 88) = ( -0.2901954 0.2656842 0.7904017), wk = 0.0017391 k( 89) = ( -0.2821344 0.2583040 0.7904017), wk = 0.0017391 k( 90) = ( -0.2740735 0.2509239 0.7904017), wk = 0.0017391 k( 91) = ( -0.2660125 0.2435438 0.7904017), wk = 0.0017391 k( 92) = ( -0.2579515 0.2361637 0.7904017), wk = 0.0017391 k( 93) = ( -0.2498905 0.2287836 0.7904017), wk = 0.0017391 k( 94) = ( -0.2418295 0.2214035 0.7904017), wk = 0.0017391 k( 95) = ( -0.2337685 0.2140234 0.7904017), wk = 0.0017391 k( 96) = ( -0.2257076 0.2066432 0.7904017), wk = 0.0017391 k( 97) = ( -0.2176466 0.1992631 0.7904017), wk = 0.0017391 k( 98) = ( -0.2095856 0.1918830 0.7904017), wk = 0.0017391 k( 99) = ( -0.2015246 0.1845029 0.7904017), wk = 0.0017391 k( 100) = ( -0.1934636 0.1771228 0.7904017), wk = 0.0017391 k( 101) = ( -0.1854026 0.1697427 0.7904017), wk = 0.0017391 k( 102) = ( -0.1773416 0.1623625 0.7904017), wk = 0.0017391 k( 103) = ( -0.1692807 0.1549824 0.7904017), wk = 0.0017391 k( 104) = ( -0.1612197 0.1476023 0.7904017), wk = 0.0017391 k( 105) = ( -0.1531587 0.1402222 0.7904017), wk = 0.0017391 k( 106) = ( -0.1450977 0.1328421 0.7904017), wk = 0.0017391 k( 107) = ( -0.1370367 0.1254620 0.7904017), wk = 0.0017391 k( 108) = ( -0.1289758 0.1180819 0.7904017), wk = 0.0017391 k( 109) = ( -0.1209148 0.1107017 0.7904017), wk = 0.0017391 k( 110) = ( -0.1128538 0.1033216 0.7904017), wk = 0.0017391 k( 111) = ( -0.1047928 0.0959415 0.7904017), wk = 0.0017391 k( 112) = ( -0.0967318 0.0885614 0.7904017), wk = 0.0017391 k( 113) = ( -0.0886708 0.0811813 0.7904017), wk = 0.0017391 k( 114) = ( -0.0806098 0.0738012 0.7904017), wk = 0.0017391 k( 115) = ( -0.0725489 0.0664210 0.7904017), wk = 0.0017391 k( 116) = ( -0.0644879 0.0590409 0.7904017), wk = 0.0017391 k( 117) = ( -0.0564269 0.0516608 0.7904017), wk = 0.0017391 k( 118) = ( -0.0483659 0.0442807 0.7904017), wk = 0.0017391 k( 119) = ( -0.0403049 0.0369006 0.7904017), wk = 0.0017391 k( 120) = ( -0.0322439 0.0295205 0.7904017), wk = 0.0017391 k( 121) = ( -0.0241830 0.0221403 0.7904017), wk = 0.0017391 k( 122) = ( -0.0161220 0.0147602 0.7904017), wk = 0.0017391 k( 123) = ( -0.0080610 0.0073801 0.7904017), wk = 0.0017391 k( 124) = ( 0.0000000 0.0000000 0.7904017), wk = 0.0017391 k( 125) = ( 0.0000000 0.0000000 0.7904017), wk = 0.0017391 k( 126) = ( 0.0073529 0.0080313 0.7904017), wk = 0.0017391 k( 127) = ( 0.0147059 0.0160626 0.7904017), wk = 0.0017391 k( 128) = ( 0.0220588 0.0240939 0.7904017), wk = 0.0017391 k( 129) = ( 0.0294118 0.0321252 0.7904017), wk = 0.0017391 k( 130) = ( 0.0367647 0.0401565 0.7904017), wk = 0.0017391 k( 131) = ( 0.0441177 0.0481878 0.7904017), wk = 0.0017391 k( 132) = ( 0.0514706 0.0562191 0.7904017), wk = 0.0017391 k( 133) = ( 0.0588235 0.0642504 0.7904017), wk = 0.0017391 k( 134) = ( 0.0661765 0.0722817 0.7904017), wk = 0.0017391 k( 135) = ( 0.0735294 0.0803130 0.7904017), wk = 0.0017391 k( 136) = ( 0.0808824 0.0883443 0.7904017), wk = 0.0017391 k( 137) = ( 0.0882353 0.0963756 0.7904017), wk = 0.0017391 k( 138) = ( 0.0955882 0.1044069 0.7904017), wk = 0.0017391 k( 139) = ( 0.1029412 0.1124382 0.7904017), wk = 0.0017391 k( 140) = ( 0.1102941 0.1204695 0.7904017), wk = 0.0017391 k( 141) = ( 0.1176471 0.1285008 0.7904017), wk = 0.0017391 k( 142) = ( 0.1250000 0.1365321 0.7904017), wk = 0.0017391 k( 143) = ( 0.1323529 0.1445634 0.7904017), wk = 0.0017391 k( 144) = ( 0.1397059 0.1525947 0.7904017), wk = 0.0017391 k( 145) = ( 0.1470588 0.1606260 0.7904017), wk = 0.0017391 k( 146) = ( 0.1544118 0.1686573 0.7904017), wk = 0.0017391 k( 147) = ( 0.1617647 0.1766887 0.7904017), wk = 0.0017391 k( 148) = ( 0.1691177 0.1847200 0.7904017), wk = 0.0017391 k( 149) = ( 0.1764706 0.1927513 0.7904017), wk = 0.0017391 k( 150) = ( 0.1838235 0.2007826 0.7904017), wk = 0.0017391 k( 151) = ( 0.1911765 0.2088139 0.7904017), wk = 0.0017391 k( 152) = ( 0.1985294 0.2168452 0.7904017), wk = 0.0017391 k( 153) = ( 0.2058823 0.2248765 0.7904017), wk = 0.0017391 k( 154) = ( 0.2132353 0.2329078 0.7904017), wk = 0.0017391 k( 155) = ( 0.2205882 0.2409391 0.7904017), wk = 0.0017391 k( 156) = ( 0.2279412 0.2489704 0.7904017), wk = 0.0017391 k( 157) = ( 0.2352941 0.2570017 0.7904017), wk = 0.0017391 k( 158) = ( 0.2426471 0.2650330 0.7904017), wk = 0.0017391 k( 159) = ( 0.2500000 0.2730643 0.7904017), wk = 0.0017391 k( 160) = ( 0.2500000 0.2730643 0.7904017), wk = 0.0017391 k( 161) = ( 0.2428571 0.2796038 0.7849163), wk = 0.0017391 k( 162) = ( 0.2357143 0.2861434 0.7794310), wk = 0.0017391 k( 163) = ( 0.2285714 0.2926829 0.7739457), wk = 0.0017391 k( 164) = ( 0.2214286 0.2992224 0.7684603), wk = 0.0017391 k( 165) = ( 0.2142857 0.3057620 0.7629750), wk = 0.0017391 k( 166) = ( 0.2071429 0.3123015 0.7574896), wk = 0.0017391 k( 167) = ( 0.2000000 0.3188410 0.7520043), wk = 0.0017391 k( 168) = ( 0.1928571 0.3253806 0.7465189), wk = 0.0017391 k( 169) = ( 0.1857143 0.3319201 0.7410336), wk = 0.0017391 k( 170) = ( 0.1785714 0.3384597 0.7355483), wk = 0.0017391 k( 171) = ( 0.1714286 0.3449992 0.7300629), wk = 0.0017391 k( 172) = ( 0.1642857 0.3515387 0.7245776), wk = 0.0017391 k( 173) = ( 0.1571429 0.3580783 0.7190922), wk = 0.0017391 k( 174) = ( 0.1500000 0.3646178 0.7136069), wk = 0.0017391 k( 175) = ( 0.1428571 0.3711574 0.7081216), wk = 0.0017391 k( 176) = ( 0.1357143 0.3776969 0.7026362), wk = 0.0017391 k( 177) = ( 0.1285714 0.3842364 0.6971509), wk = 0.0017391 k( 178) = ( 0.1214286 0.3907760 0.6916655), wk = 0.0017391 k( 179) = ( 0.1142857 0.3973155 0.6861802), wk = 0.0017391 k( 180) = ( 0.1071429 0.4038550 0.6806949), wk = 0.0017391 k( 181) = ( 0.1000000 0.4103946 0.6752095), wk = 0.0017391 k( 182) = ( 0.0928571 0.4169341 0.6697242), wk = 0.0017391 k( 183) = ( 0.0857143 0.4234737 0.6642388), wk = 0.0017391 k( 184) = ( 0.0785714 0.4300132 0.6587535), wk = 0.0017391 k( 185) = ( 0.0714286 0.4365527 0.6532682), wk = 0.0017391 k( 186) = ( 0.0642857 0.4430923 0.6477828), wk = 0.0017391 k( 187) = ( 0.0571429 0.4496318 0.6422975), wk = 0.0017391 k( 188) = ( 0.0500000 0.4561714 0.6368121), wk = 0.0017391 k( 189) = ( 0.0428571 0.4627109 0.6313268), wk = 0.0017391 k( 190) = ( 0.0357143 0.4692504 0.6258415), wk = 0.0017391 k( 191) = ( 0.0285714 0.4757900 0.6203561), wk = 0.0017391 k( 192) = ( 0.0214286 0.4823295 0.6148708), wk = 0.0017391 k( 193) = ( 0.0142857 0.4888690 0.6093854), wk = 0.0017391 k( 194) = ( 0.0071429 0.4954086 0.6039001), wk = 0.0017391 k( 195) = ( 0.0000000 0.5019481 0.5984147), wk = 0.0017391 k( 196) = ( 0.0000000 0.5019481 0.5984147), wk = 0.0017391 k( 197) = ( 0.0084854 0.5073886 0.5938513), wk = 0.0017391 k( 198) = ( 0.0169708 0.5128290 0.5892879), wk = 0.0017391 k( 199) = ( 0.0254562 0.5182695 0.5847244), wk = 0.0017391 k( 200) = ( 0.0339417 0.5237100 0.5801610), wk = 0.0017391 k( 201) = ( 0.0424271 0.5291504 0.5755975), wk = 0.0017391 k( 202) = ( 0.0509125 0.5345909 0.5710341), wk = 0.0017391 k( 203) = ( 0.0593979 0.5400313 0.5664707), wk = 0.0017391 k( 204) = ( 0.0678833 0.5454718 0.5619072), wk = 0.0017391 k( 205) = ( 0.0763688 0.5509123 0.5573438), wk = 0.0017391 k( 206) = ( 0.0848542 0.5563527 0.5527804), wk = 0.0017391 k( 207) = ( 0.0933396 0.5617932 0.5482169), wk = 0.0017391 k( 208) = ( 0.1018250 0.5672337 0.5436535), wk = 0.0017391 k( 209) = ( 0.1103104 0.5726741 0.5390900), wk = 0.0017391 k( 210) = ( 0.1187958 0.5781146 0.5345266), wk = 0.0017391 k( 211) = ( 0.1272813 0.5835550 0.5299632), wk = 0.0017391 k( 212) = ( 0.1357667 0.5889955 0.5253997), wk = 0.0017391 k( 213) = ( 0.1442521 0.5944360 0.5208363), wk = 0.0017391 k( 214) = ( 0.1527375 0.5998764 0.5162728), wk = 0.0017391 k( 215) = ( 0.1612229 0.6053169 0.5117094), wk = 0.0017391 k( 216) = ( 0.1697084 0.6107573 0.5071460), wk = 0.0017391 k( 217) = ( 0.1781938 0.6161978 0.5025825), wk = 0.0017391 k( 218) = ( 0.1866792 0.6216383 0.4980191), wk = 0.0017391 k( 219) = ( 0.1951646 0.6270787 0.4934556), wk = 0.0017391 k( 220) = ( 0.2036500 0.6325192 0.4888922), wk = 0.0017391 k( 221) = ( 0.2121354 0.6379597 0.4843288), wk = 0.0017391 k( 222) = ( 0.2206209 0.6434001 0.4797653), wk = 0.0017391 k( 223) = ( 0.2291063 0.6488406 0.4752019), wk = 0.0017391 k( 224) = ( 0.2375917 0.6542810 0.4706384), wk = 0.0017391 k( 225) = ( 0.2460771 0.6597215 0.4660750), wk = 0.0017391 k( 226) = ( 0.2545625 0.6651620 0.4615116), wk = 0.0017391 k( 227) = ( 0.2630479 0.6706024 0.4569481), wk = 0.0017391 k( 228) = ( 0.2715334 0.6760429 0.4523847), wk = 0.0017391 k( 229) = ( 0.2800188 0.6814833 0.4478212), wk = 0.0017391 k( 230) = ( 0.2885042 0.6869238 0.4432578), wk = 0.0017391 k( 231) = ( 0.2969896 0.6923643 0.4386944), wk = 0.0017391 k( 232) = ( 0.3054750 0.6978047 0.4341309), wk = 0.0017391 k( 233) = ( 0.3139605 0.7032452 0.4295675), wk = 0.0017391 k( 234) = ( 0.3224459 0.7086857 0.4250041), wk = 0.0017391 k( 235) = ( 0.3224459 0.7086857 0.4250041), wk = 0.0017391 k( 236) = ( 0.3264812 0.7049912 0.4153449), wk = 0.0017391 k( 237) = ( 0.3305165 0.7012967 0.4056857), wk = 0.0017391 k( 238) = ( 0.3345518 0.6976022 0.3960265), wk = 0.0017391 k( 239) = ( 0.3385872 0.6939077 0.3863673), wk = 0.0017391 k( 240) = ( 0.3426225 0.6902133 0.3767081), wk = 0.0017391 k( 241) = ( 0.3466578 0.6865188 0.3670490), wk = 0.0017391 k( 242) = ( 0.3506931 0.6828243 0.3573898), wk = 0.0017391 k( 243) = ( 0.3547284 0.6791298 0.3477306), wk = 0.0017391 k( 244) = ( 0.3587638 0.6754353 0.3380714), wk = 0.0017391 k( 245) = ( 0.3627991 0.6717409 0.3284122), wk = 0.0017391 k( 246) = ( 0.3668344 0.6680464 0.3187530), wk = 0.0017391 k( 247) = ( 0.3708697 0.6643519 0.3090939), wk = 0.0017391 k( 248) = ( 0.3749050 0.6606574 0.2994347), wk = 0.0017391 k( 249) = ( 0.3789404 0.6569629 0.2897755), wk = 0.0017391 k( 250) = ( 0.3829757 0.6532685 0.2801163), wk = 0.0017391 k( 251) = ( 0.3870110 0.6495740 0.2704571), wk = 0.0017391 k( 252) = ( 0.3910463 0.6458795 0.2607979), wk = 0.0017391 k( 253) = ( 0.3950817 0.6421850 0.2511387), wk = 0.0017391 k( 254) = ( 0.3991170 0.6384905 0.2414796), wk = 0.0017391 k( 255) = ( 0.4031523 0.6347961 0.2318204), wk = 0.0017391 k( 256) = ( 0.4071876 0.6311016 0.2221612), wk = 0.0017391 k( 257) = ( 0.4112229 0.6274071 0.2125020), wk = 0.0017391 k( 258) = ( 0.4152582 0.6237126 0.2028429), wk = 0.0017391 k( 259) = ( 0.4192936 0.6200182 0.1931837), wk = 0.0017391 k( 260) = ( 0.4233289 0.6163237 0.1835245), wk = 0.0017391 k( 261) = ( 0.4273642 0.6126292 0.1738653), wk = 0.0017391 k( 262) = ( 0.4313995 0.6089347 0.1642061), wk = 0.0017391 k( 263) = ( 0.4354349 0.6052402 0.1545469), wk = 0.0017391 k( 264) = ( 0.4394702 0.6015458 0.1448877), wk = 0.0017391 k( 265) = ( 0.4435055 0.5978513 0.1352286), wk = 0.0017391 k( 266) = ( 0.4475408 0.5941568 0.1255694), wk = 0.0017391 k( 267) = ( 0.4515761 0.5904623 0.1159102), wk = 0.0017391 k( 268) = ( 0.4556115 0.5867678 0.1062510), wk = 0.0017391 k( 269) = ( 0.4596468 0.5830734 0.0965918), wk = 0.0017391 k( 270) = ( 0.4636821 0.5793789 0.0869326), wk = 0.0017391 k( 271) = ( 0.4677174 0.5756844 0.0772735), wk = 0.0017391 k( 272) = ( 0.4717527 0.5719899 0.0676143), wk = 0.0017391 k( 273) = ( 0.4757881 0.5682954 0.0579551), wk = 0.0017391 k( 274) = ( 0.4798234 0.5646010 0.0482959), wk = 0.0017391 k( 275) = ( 0.4838587 0.5609065 0.0386367), wk = 0.0017391 k( 276) = ( 0.4878940 0.5572120 0.0289775), wk = 0.0017391 k( 277) = ( 0.4919294 0.5535175 0.0193184), wk = 0.0017391 k( 278) = ( 0.4959647 0.5498230 0.0096592), wk = 0.0017391 k( 279) = ( 0.5000000 0.5461286 -0.0000000), wk = 0.0017391 k( 280) = ( 0.5000000 0.5461286 -0.0000000), wk = 0.0017391 k( 281) = ( 0.4925373 0.5379774 -0.0000000), wk = 0.0017391 k( 282) = ( 0.4850746 0.5298262 -0.0000000), wk = 0.0017391 k( 283) = ( 0.4776119 0.5216750 -0.0000000), wk = 0.0017391 k( 284) = ( 0.4701493 0.5135239 -0.0000000), wk = 0.0017391 k( 285) = ( 0.4626866 0.5053727 -0.0000000), wk = 0.0017391 k( 286) = ( 0.4552239 0.4972215 -0.0000000), wk = 0.0017391 k( 287) = ( 0.4477612 0.4890704 -0.0000000), wk = 0.0017391 k( 288) = ( 0.4402985 0.4809192 -0.0000000), wk = 0.0017391 k( 289) = ( 0.4328358 0.4727680 -0.0000000), wk = 0.0017391 k( 290) = ( 0.4253731 0.4646168 -0.0000000), wk = 0.0017391 k( 291) = ( 0.4179104 0.4564657 -0.0000000), wk = 0.0017391 k( 292) = ( 0.4104478 0.4483145 -0.0000000), wk = 0.0017391 k( 293) = ( 0.4029851 0.4401633 -0.0000000), wk = 0.0017391 k( 294) = ( 0.3955224 0.4320122 -0.0000000), wk = 0.0017391 k( 295) = ( 0.3880597 0.4238610 -0.0000000), wk = 0.0017391 k( 296) = ( 0.3805970 0.4157098 -0.0000000), wk = 0.0017391 k( 297) = ( 0.3731343 0.4075586 -0.0000000), wk = 0.0017391 k( 298) = ( 0.3656716 0.3994075 -0.0000000), wk = 0.0017391 k( 299) = ( 0.3582090 0.3912563 -0.0000000), wk = 0.0017391 k( 300) = ( 0.3507463 0.3831051 -0.0000000), wk = 0.0017391 k( 301) = ( 0.3432836 0.3749539 -0.0000000), wk = 0.0017391 k( 302) = ( 0.3358209 0.3668028 -0.0000000), wk = 0.0017391 k( 303) = ( 0.3283582 0.3586516 -0.0000000), wk = 0.0017391 k( 304) = ( 0.3208955 0.3505004 -0.0000000), wk = 0.0017391 k( 305) = ( 0.3134328 0.3423493 -0.0000000), wk = 0.0017391 k( 306) = ( 0.3059701 0.3341981 -0.0000000), wk = 0.0017391 k( 307) = ( 0.2985075 0.3260469 -0.0000000), wk = 0.0017391 k( 308) = ( 0.2910448 0.3178957 -0.0000000), wk = 0.0017391 k( 309) = ( 0.2835821 0.3097446 -0.0000000), wk = 0.0017391 k( 310) = ( 0.2761194 0.3015934 -0.0000000), wk = 0.0017391 k( 311) = ( 0.2686567 0.2934422 -0.0000000), wk = 0.0017391 k( 312) = ( 0.2611940 0.2852910 -0.0000000), wk = 0.0017391 k( 313) = ( 0.2537313 0.2771399 -0.0000000), wk = 0.0017391 k( 314) = ( 0.2462687 0.2689887 -0.0000000), wk = 0.0017391 k( 315) = ( 0.2388060 0.2608375 -0.0000000), wk = 0.0017391 k( 316) = ( 0.2313433 0.2526863 -0.0000000), wk = 0.0017391 k( 317) = ( 0.2238806 0.2445352 -0.0000000), wk = 0.0017391 k( 318) = ( 0.2164179 0.2363840 -0.0000000), wk = 0.0017391 k( 319) = ( 0.2089552 0.2282328 -0.0000000), wk = 0.0017391 k( 320) = ( 0.2014925 0.2200817 -0.0000000), wk = 0.0017391 k( 321) = ( 0.1940299 0.2119305 -0.0000000), wk = 0.0017391 k( 322) = ( 0.1865672 0.2037793 -0.0000000), wk = 0.0017391 k( 323) = ( 0.1791045 0.1956281 -0.0000000), wk = 0.0017391 k( 324) = ( 0.1716418 0.1874770 -0.0000000), wk = 0.0017391 k( 325) = ( 0.1641791 0.1793258 -0.0000000), wk = 0.0017391 k( 326) = ( 0.1567164 0.1711746 -0.0000000), wk = 0.0017391 k( 327) = ( 0.1492537 0.1630235 -0.0000000), wk = 0.0017391 k( 328) = ( 0.1417910 0.1548723 -0.0000000), wk = 0.0017391 k( 329) = ( 0.1343284 0.1467211 -0.0000000), wk = 0.0017391 k( 330) = ( 0.1268657 0.1385699 -0.0000000), wk = 0.0017391 k( 331) = ( 0.1194030 0.1304188 -0.0000000), wk = 0.0017391 k( 332) = ( 0.1119403 0.1222676 -0.0000000), wk = 0.0017391 k( 333) = ( 0.1044776 0.1141164 -0.0000000), wk = 0.0017391 k( 334) = ( 0.0970149 0.1059652 -0.0000000), wk = 0.0017391 k( 335) = ( 0.0895522 0.0978141 -0.0000000), wk = 0.0017391 k( 336) = ( 0.0820895 0.0896629 -0.0000000), wk = 0.0017391 k( 337) = ( 0.0746269 0.0815117 -0.0000000), wk = 0.0017391 k( 338) = ( 0.0671642 0.0733606 -0.0000000), wk = 0.0017391 k( 339) = ( 0.0597015 0.0652094 -0.0000000), wk = 0.0017391 k( 340) = ( 0.0522388 0.0570582 -0.0000000), wk = 0.0017391 k( 341) = ( 0.0447761 0.0489070 -0.0000000), wk = 0.0017391 k( 342) = ( 0.0373134 0.0407559 -0.0000000), wk = 0.0017391 k( 343) = ( 0.0298507 0.0326047 -0.0000000), wk = 0.0017391 k( 344) = ( 0.0223881 0.0244535 -0.0000000), wk = 0.0017391 k( 345) = ( 0.0149254 0.0163023 -0.0000000), wk = 0.0017391 k( 346) = ( 0.0074627 0.0081512 -0.0000000), wk = 0.0017391 k( 347) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017391 k( 348) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017391 k( 349) = ( 0.0071017 -0.0065018 0.0054537), wk = 0.0017391 k( 350) = ( 0.0142033 -0.0130036 0.0109074), wk = 0.0017391 k( 351) = ( 0.0213049 -0.0195054 0.0163611), wk = 0.0017391 k( 352) = ( 0.0284066 -0.0260072 0.0218148), wk = 0.0017391 k( 353) = ( 0.0355082 -0.0325091 0.0272685), wk = 0.0017391 k( 354) = ( 0.0426099 -0.0390109 0.0327222), wk = 0.0017391 k( 355) = ( 0.0497116 -0.0455127 0.0381759), wk = 0.0017391 k( 356) = ( 0.0568132 -0.0520145 0.0436296), wk = 0.0017391 k( 357) = ( 0.0639148 -0.0585163 0.0490833), wk = 0.0017391 k( 358) = ( 0.0710165 -0.0650181 0.0545370), wk = 0.0017391 k( 359) = ( 0.0781181 -0.0715199 0.0599907), wk = 0.0017391 k( 360) = ( 0.0852198 -0.0780217 0.0654444), wk = 0.0017391 k( 361) = ( 0.0923214 -0.0845235 0.0708980), wk = 0.0017391 k( 362) = ( 0.0994231 -0.0910254 0.0763517), wk = 0.0017391 k( 363) = ( 0.1065248 -0.0975272 0.0818054), wk = 0.0017391 k( 364) = ( 0.1136264 -0.1040290 0.0872591), wk = 0.0017391 k( 365) = ( 0.1207281 -0.1105308 0.0927128), wk = 0.0017391 k( 366) = ( 0.1278297 -0.1170326 0.0981665), wk = 0.0017391 k( 367) = ( 0.1349314 -0.1235344 0.1036202), wk = 0.0017391 k( 368) = ( 0.1420330 -0.1300362 0.1090739), wk = 0.0017391 k( 369) = ( 0.1491347 -0.1365380 0.1145276), wk = 0.0017391 k( 370) = ( 0.1562363 -0.1430399 0.1199813), wk = 0.0017391 k( 371) = ( 0.1633380 -0.1495417 0.1254350), wk = 0.0017391 k( 372) = ( 0.1704396 -0.1560435 0.1308887), wk = 0.0017391 k( 373) = ( 0.1775413 -0.1625453 0.1363424), wk = 0.0017391 k( 374) = ( 0.1846429 -0.1690471 0.1417961), wk = 0.0017391 k( 375) = ( 0.1917446 -0.1755489 0.1472498), wk = 0.0017391 k( 376) = ( 0.1988462 -0.1820507 0.1527035), wk = 0.0017391 k( 377) = ( 0.2059478 -0.1885525 0.1581572), wk = 0.0017391 k( 378) = ( 0.2130495 -0.1950543 0.1636109), wk = 0.0017391 k( 379) = ( 0.2201511 -0.2015562 0.1690646), wk = 0.0017391 k( 380) = ( 0.2272528 -0.2080580 0.1745183), wk = 0.0017391 k( 381) = ( 0.2343544 -0.2145598 0.1799720), wk = 0.0017391 k( 382) = ( 0.2414561 -0.2210616 0.1854257), wk = 0.0017391 k( 383) = ( 0.2485577 -0.2275634 0.1908794), wk = 0.0017391 k( 384) = ( 0.2556594 -0.2340652 0.1963331), wk = 0.0017391 k( 385) = ( 0.2627610 -0.2405670 0.2017867), wk = 0.0017391 k( 386) = ( 0.2698627 -0.2470688 0.2072404), wk = 0.0017391 k( 387) = ( 0.2769644 -0.2535706 0.2126941), wk = 0.0017391 k( 388) = ( 0.2840660 -0.2600725 0.2181478), wk = 0.0017391 k( 389) = ( 0.2911677 -0.2665743 0.2236015), wk = 0.0017391 k( 390) = ( 0.2982693 -0.2730761 0.2290552), wk = 0.0017391 k( 391) = ( 0.3053709 -0.2795779 0.2345089), wk = 0.0017391 k( 392) = ( 0.3124726 -0.2860797 0.2399626), wk = 0.0017391 k( 393) = ( 0.3195743 -0.2925815 0.2454163), wk = 0.0017391 k( 394) = ( 0.3266759 -0.2990833 0.2508700), wk = 0.0017391 k( 395) = ( 0.3337775 -0.3055851 0.2563237), wk = 0.0017391 k( 396) = ( 0.3408792 -0.3120870 0.2617774), wk = 0.0017391 k( 397) = ( 0.3479809 -0.3185888 0.2672311), wk = 0.0017391 k( 398) = ( 0.3550825 -0.3250906 0.2726848), wk = 0.0017391 k( 399) = ( 0.3621841 -0.3315924 0.2781385), wk = 0.0017391 k( 400) = ( 0.3692858 -0.3380942 0.2835922), wk = 0.0017391 k( 401) = ( 0.3763875 -0.3445960 0.2890459), wk = 0.0017391 k( 402) = ( 0.3834891 -0.3510978 0.2944996), wk = 0.0017391 k( 403) = ( 0.3905907 -0.3575996 0.2999533), wk = 0.0017391 k( 404) = ( 0.3976924 -0.3641014 0.3054070), wk = 0.0017391 k( 405) = ( 0.4047941 -0.3706033 0.3108607), wk = 0.0017391 k( 406) = ( 0.4118957 -0.3771051 0.3163144), wk = 0.0017391 k( 407) = ( 0.4189973 -0.3836069 0.3217681), wk = 0.0017391 k( 408) = ( 0.4260990 -0.3901087 0.3272218), wk = 0.0017391 k( 409) = ( 0.4332007 -0.3966105 0.3326755), wk = 0.0017391 k( 410) = ( 0.4403023 -0.4031123 0.3381291), wk = 0.0017391 k( 411) = ( 0.4474039 -0.4096141 0.3435828), wk = 0.0017391 k( 412) = ( 0.4545056 -0.4161159 0.3490365), wk = 0.0017391 k( 413) = ( 0.4616073 -0.4226177 0.3544902), wk = 0.0017391 k( 414) = ( 0.4687089 -0.4291196 0.3599439), wk = 0.0017391 k( 415) = ( 0.4758105 -0.4356214 0.3653976), wk = 0.0017391 k( 416) = ( 0.4758105 -0.4356214 0.3653976), wk = 0.0017391 k( 417) = ( 0.4763364 -0.4251909 0.3616278), wk = 0.0017391 k( 418) = ( 0.4768623 -0.4147604 0.3578580), wk = 0.0017391 k( 419) = ( 0.4773881 -0.4043299 0.3540882), wk = 0.0017391 k( 420) = ( 0.4779140 -0.3938995 0.3503184), wk = 0.0017391 k( 421) = ( 0.4784398 -0.3834690 0.3465486), wk = 0.0017391 k( 422) = ( 0.4789657 -0.3730385 0.3427788), wk = 0.0017391 k( 423) = ( 0.4794915 -0.3626080 0.3390090), wk = 0.0017391 k( 424) = ( 0.4800174 -0.3521776 0.3352392), wk = 0.0017391 k( 425) = ( 0.4805433 -0.3417471 0.3314694), wk = 0.0017391 k( 426) = ( 0.4810691 -0.3313166 0.3276996), wk = 0.0017391 k( 427) = ( 0.4815950 -0.3208861 0.3239298), wk = 0.0017391 k( 428) = ( 0.4821208 -0.3104557 0.3201601), wk = 0.0017391 k( 429) = ( 0.4826467 -0.3000252 0.3163903), wk = 0.0017391 k( 430) = ( 0.4831725 -0.2895947 0.3126205), wk = 0.0017391 k( 431) = ( 0.4836984 -0.2791643 0.3088507), wk = 0.0017391 k( 432) = ( 0.4842243 -0.2687338 0.3050809), wk = 0.0017391 k( 433) = ( 0.4847501 -0.2583033 0.3013111), wk = 0.0017391 k( 434) = ( 0.4852760 -0.2478728 0.2975413), wk = 0.0017391 k( 435) = ( 0.4858018 -0.2374424 0.2937715), wk = 0.0017391 k( 436) = ( 0.4863277 -0.2270119 0.2900017), wk = 0.0017391 k( 437) = ( 0.4868536 -0.2165814 0.2862319), wk = 0.0017391 k( 438) = ( 0.4873794 -0.2061509 0.2824621), wk = 0.0017391 k( 439) = ( 0.4879053 -0.1957205 0.2786923), wk = 0.0017391 k( 440) = ( 0.4884311 -0.1852900 0.2749225), wk = 0.0017391 k( 441) = ( 0.4889570 -0.1748595 0.2711527), wk = 0.0017391 k( 442) = ( 0.4894829 -0.1644290 0.2673829), wk = 0.0017391 k( 443) = ( 0.4900087 -0.1539986 0.2636131), wk = 0.0017391 k( 444) = ( 0.4905346 -0.1435681 0.2598433), wk = 0.0017391 k( 445) = ( 0.4910604 -0.1331376 0.2560735), wk = 0.0017391 k( 446) = ( 0.4915863 -0.1227071 0.2523037), wk = 0.0017391 k( 447) = ( 0.4921121 -0.1122767 0.2485339), wk = 0.0017391 k( 448) = ( 0.4926380 -0.1018462 0.2447641), wk = 0.0017391 k( 449) = ( 0.4931639 -0.0914157 0.2409943), wk = 0.0017391 k( 450) = ( 0.4936897 -0.0809852 0.2372245), wk = 0.0017391 k( 451) = ( 0.4942156 -0.0705548 0.2334547), wk = 0.0017391 k( 452) = ( 0.4947414 -0.0601243 0.2296849), wk = 0.0017391 k( 453) = ( 0.4952673 -0.0496938 0.2259151), wk = 0.0017391 k( 454) = ( 0.4957931 -0.0392633 0.2221453), wk = 0.0017391 k( 455) = ( 0.4963190 -0.0288329 0.2183755), wk = 0.0017391 k( 456) = ( 0.4968449 -0.0184024 0.2146057), wk = 0.0017391 k( 457) = ( 0.4973707 -0.0079719 0.2108359), wk = 0.0017391 k( 458) = ( 0.4978966 0.0024586 0.2070661), wk = 0.0017391 k( 459) = ( 0.4984224 0.0128890 0.2032963), wk = 0.0017391 k( 460) = ( 0.4989483 0.0233195 0.1995265), wk = 0.0017391 k( 461) = ( 0.4994741 0.0337500 0.1957567), wk = 0.0017391 k( 462) = ( 0.5000000 0.0441804 0.1919869), wk = 0.0017391 k( 463) = ( 0.5000000 0.0441804 0.1919869), wk = 0.0017391 k( 464) = ( 0.4959677 0.0478721 0.2016388), wk = 0.0017391 k( 465) = ( 0.4919355 0.0515638 0.2112906), wk = 0.0017391 k( 466) = ( 0.4879032 0.0552555 0.2209425), wk = 0.0017391 k( 467) = ( 0.4838710 0.0589471 0.2305943), wk = 0.0017391 k( 468) = ( 0.4798387 0.0626388 0.2402462), wk = 0.0017391 k( 469) = ( 0.4758064 0.0663305 0.2498980), wk = 0.0017391 k( 470) = ( 0.4717742 0.0700222 0.2595499), wk = 0.0017391 k( 471) = ( 0.4677419 0.0737138 0.2692017), wk = 0.0017391 k( 472) = ( 0.4637097 0.0774055 0.2788536), wk = 0.0017391 k( 473) = ( 0.4596774 0.0810972 0.2885054), wk = 0.0017391 k( 474) = ( 0.4556452 0.0847889 0.2981573), wk = 0.0017391 k( 475) = ( 0.4516129 0.0884805 0.3078091), wk = 0.0017391 k( 476) = ( 0.4475807 0.0921722 0.3174610), wk = 0.0017391 k( 477) = ( 0.4435484 0.0958639 0.3271128), wk = 0.0017391 k( 478) = ( 0.4395161 0.0995556 0.3367647), wk = 0.0017391 k( 479) = ( 0.4354839 0.1032472 0.3464165), wk = 0.0017391 k( 480) = ( 0.4314516 0.1069389 0.3560684), wk = 0.0017391 k( 481) = ( 0.4274193 0.1106306 0.3657203), wk = 0.0017391 k( 482) = ( 0.4233871 0.1143223 0.3753721), wk = 0.0017391 k( 483) = ( 0.4193548 0.1180139 0.3850239), wk = 0.0017391 k( 484) = ( 0.4153226 0.1217056 0.3946758), wk = 0.0017391 k( 485) = ( 0.4112903 0.1253973 0.4043277), wk = 0.0017391 k( 486) = ( 0.4072581 0.1290890 0.4139795), wk = 0.0017391 k( 487) = ( 0.4032258 0.1327806 0.4236313), wk = 0.0017391 k( 488) = ( 0.3991936 0.1364723 0.4332832), wk = 0.0017391 k( 489) = ( 0.3951613 0.1401640 0.4429350), wk = 0.0017391 k( 490) = ( 0.3911290 0.1438557 0.4525869), wk = 0.0017391 k( 491) = ( 0.3870968 0.1475473 0.4622388), wk = 0.0017391 k( 492) = ( 0.3830645 0.1512390 0.4718906), wk = 0.0017391 k( 493) = ( 0.3790323 0.1549307 0.4815424), wk = 0.0017391 k( 494) = ( 0.3750000 0.1586224 0.4911943), wk = 0.0017391 k( 495) = ( 0.3709677 0.1623140 0.5008462), wk = 0.0017391 k( 496) = ( 0.3669355 0.1660057 0.5104980), wk = 0.0017391 k( 497) = ( 0.3629032 0.1696974 0.5201498), wk = 0.0017391 k( 498) = ( 0.3588710 0.1733891 0.5298017), wk = 0.0017391 k( 499) = ( 0.3548387 0.1770807 0.5394536), wk = 0.0017391 k( 500) = ( 0.3508064 0.1807724 0.5491054), wk = 0.0017391 k( 501) = ( 0.3467742 0.1844641 0.5587573), wk = 0.0017391 k( 502) = ( 0.3427419 0.1881558 0.5684091), wk = 0.0017391 k( 503) = ( 0.3387097 0.1918474 0.5780610), wk = 0.0017391 k( 504) = ( 0.3346774 0.1955391 0.5877128), wk = 0.0017391 k( 505) = ( 0.3306452 0.1992308 0.5973647), wk = 0.0017391 k( 506) = ( 0.3266129 0.2029225 0.6070165), wk = 0.0017391 k( 507) = ( 0.3225807 0.2066141 0.6166683), wk = 0.0017391 k( 508) = ( 0.3185484 0.2103058 0.6263202), wk = 0.0017391 k( 509) = ( 0.3145161 0.2139975 0.6359721), wk = 0.0017391 k( 510) = ( 0.3104839 0.2176892 0.6456239), wk = 0.0017391 k( 511) = ( 0.3064516 0.2213808 0.6552758), wk = 0.0017391 k( 512) = ( 0.3024193 0.2250725 0.6649276), wk = 0.0017391 k( 513) = ( 0.2983871 0.2287642 0.6745795), wk = 0.0017391 k( 514) = ( 0.2943548 0.2324559 0.6842313), wk = 0.0017391 k( 515) = ( 0.2903226 0.2361475 0.6938832), wk = 0.0017391 k( 516) = ( 0.2862903 0.2398392 0.7035350), wk = 0.0017391 k( 517) = ( 0.2822581 0.2435309 0.7131869), wk = 0.0017391 k( 518) = ( 0.2782258 0.2472226 0.7228387), wk = 0.0017391 k( 519) = ( 0.2741936 0.2509142 0.7324906), wk = 0.0017391 k( 520) = ( 0.2701613 0.2546059 0.7421424), wk = 0.0017391 k( 521) = ( 0.2661290 0.2582976 0.7517943), wk = 0.0017391 k( 522) = ( 0.2620968 0.2619893 0.7614461), wk = 0.0017391 k( 523) = ( 0.2580645 0.2656809 0.7710980), wk = 0.0017391 k( 524) = ( 0.2540323 0.2693726 0.7807498), wk = 0.0017391 k( 525) = ( 0.2500000 0.2730643 0.7904017), wk = 0.0017391 k( 526) = ( 0.2982564 -0.2730643 0.7904017), wk = 0.0017391 k( 527) = ( 0.3022917 -0.2767588 0.7807425), wk = 0.0017391 k( 528) = ( 0.3063270 -0.2804532 0.7710833), wk = 0.0017391 k( 529) = ( 0.3103624 -0.2841477 0.7614241), wk = 0.0017391 k( 530) = ( 0.3143977 -0.2878422 0.7517649), wk = 0.0017391 k( 531) = ( 0.3184330 -0.2915367 0.7421057), wk = 0.0017391 k( 532) = ( 0.3224683 -0.2952312 0.7324466), wk = 0.0017391 k( 533) = ( 0.3265037 -0.2989256 0.7227874), wk = 0.0017391 k( 534) = ( 0.3305390 -0.3026201 0.7131282), wk = 0.0017391 k( 535) = ( 0.3345743 -0.3063146 0.7034690), wk = 0.0017391 k( 536) = ( 0.3386096 -0.3100091 0.6938098), wk = 0.0017391 k( 537) = ( 0.3426449 -0.3137036 0.6841507), wk = 0.0017391 k( 538) = ( 0.3466803 -0.3173980 0.6744915), wk = 0.0017391 k( 539) = ( 0.3507156 -0.3210925 0.6648323), wk = 0.0017391 k( 540) = ( 0.3547509 -0.3247870 0.6551731), wk = 0.0017391 k( 541) = ( 0.3587862 -0.3284815 0.6455139), wk = 0.0017391 k( 542) = ( 0.3628215 -0.3321759 0.6358547), wk = 0.0017391 k( 543) = ( 0.3668569 -0.3358704 0.6261956), wk = 0.0017391 k( 544) = ( 0.3708922 -0.3395649 0.6165364), wk = 0.0017391 k( 545) = ( 0.3749275 -0.3432594 0.6068772), wk = 0.0017391 k( 546) = ( 0.3789628 -0.3469539 0.5972180), wk = 0.0017391 k( 547) = ( 0.3829982 -0.3506483 0.5875588), wk = 0.0017391 k( 548) = ( 0.3870335 -0.3543428 0.5778996), wk = 0.0017391 k( 549) = ( 0.3910688 -0.3580373 0.5682405), wk = 0.0017391 k( 550) = ( 0.3951041 -0.3617318 0.5585813), wk = 0.0017391 k( 551) = ( 0.3991394 -0.3654263 0.5489221), wk = 0.0017391 k( 552) = ( 0.4031748 -0.3691207 0.5392629), wk = 0.0017391 k( 553) = ( 0.4072101 -0.3728152 0.5296037), wk = 0.0017391 k( 554) = ( 0.4112454 -0.3765097 0.5199446), wk = 0.0017391 k( 555) = ( 0.4152807 -0.3802042 0.5102854), wk = 0.0017391 k( 556) = ( 0.4193160 -0.3838987 0.5006262), wk = 0.0017391 k( 557) = ( 0.4233514 -0.3875931 0.4909670), wk = 0.0017391 k( 558) = ( 0.4273867 -0.3912876 0.4813078), wk = 0.0017391 k( 559) = ( 0.4314220 -0.3949821 0.4716486), wk = 0.0017391 k( 560) = ( 0.4354573 -0.3986766 0.4619895), wk = 0.0017391 k( 561) = ( 0.4394926 -0.4023711 0.4523303), wk = 0.0017391 k( 562) = ( 0.4435280 -0.4060655 0.4426711), wk = 0.0017391 k( 563) = ( 0.4475633 -0.4097600 0.4330119), wk = 0.0017391 k( 564) = ( 0.4515986 -0.4134545 0.4233527), wk = 0.0017391 k( 565) = ( 0.4556339 -0.4171490 0.4136935), wk = 0.0017391 k( 566) = ( 0.4596693 -0.4208435 0.4040344), wk = 0.0017391 k( 567) = ( 0.4637046 -0.4245379 0.3943752), wk = 0.0017391 k( 568) = ( 0.4677399 -0.4282324 0.3847160), wk = 0.0017391 k( 569) = ( 0.4717752 -0.4319269 0.3750568), wk = 0.0017391 k( 570) = ( 0.4758105 -0.4356214 0.3653976), wk = 0.0017391 k( 571) = ( 0.5241894 0.5239823 0.0185762), wk = 0.0017391 k( 572) = ( 0.5181421 0.5295188 0.0139322), wk = 0.0017391 k( 573) = ( 0.5120947 0.5350554 0.0092881), wk = 0.0017391 k( 574) = ( 0.5060474 0.5405920 0.0046441), wk = 0.0017391 k( 575) = ( 0.5000000 0.5461286 -0.0000000), wk = 0.0017391 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017391 k( 2) = ( -0.0040306 0.0040306 0.0040306), wk = 0.0017391 k( 3) = ( -0.0080611 0.0080611 0.0080612), wk = 0.0017391 k( 4) = ( -0.0120917 0.0120917 0.0120917), wk = 0.0017391 k( 5) = ( -0.0161223 0.0161223 0.0161223), wk = 0.0017391 k( 6) = ( -0.0201529 0.0201529 0.0201529), wk = 0.0017391 k( 7) = ( -0.0241834 0.0241834 0.0241834), wk = 0.0017391 k( 8) = ( -0.0282140 0.0282140 0.0282140), wk = 0.0017391 k( 9) = ( -0.0322446 0.0322446 0.0322446), wk = 0.0017391 k( 10) = ( -0.0362752 0.0362752 0.0362752), wk = 0.0017391 k( 11) = ( -0.0403057 0.0403057 0.0403057), wk = 0.0017391 k( 12) = ( -0.0443363 0.0443363 0.0443363), wk = 0.0017391 k( 13) = ( -0.0483669 0.0483669 0.0483669), wk = 0.0017391 k( 14) = ( -0.0523974 0.0523974 0.0523975), wk = 0.0017391 k( 15) = ( -0.0564280 0.0564280 0.0564280), wk = 0.0017391 k( 16) = ( -0.0604586 0.0604586 0.0604586), wk = 0.0017391 k( 17) = ( -0.0644892 0.0644892 0.0644892), wk = 0.0017391 k( 18) = ( -0.0685198 0.0685198 0.0685198), wk = 0.0017391 k( 19) = ( -0.0725503 0.0725503 0.0725503), wk = 0.0017391 k( 20) = ( -0.0765809 0.0765809 0.0765809), wk = 0.0017391 k( 21) = ( -0.0806115 0.0806115 0.0806115), wk = 0.0017391 k( 22) = ( -0.0846420 0.0846420 0.0846420), wk = 0.0017391 k( 23) = ( -0.0886726 0.0886726 0.0886726), wk = 0.0017391 k( 24) = ( -0.0927032 0.0927032 0.0927032), wk = 0.0017391 k( 25) = ( -0.0967338 0.0967338 0.0967338), wk = 0.0017391 k( 26) = ( -0.1007643 0.1007643 0.1007643), wk = 0.0017391 k( 27) = ( -0.1047949 0.1047949 0.1047949), wk = 0.0017391 k( 28) = ( -0.1088255 0.1088255 0.1088255), wk = 0.0017391 k( 29) = ( -0.1128560 0.1128560 0.1128560), wk = 0.0017391 k( 30) = ( -0.1168866 0.1168866 0.1168866), wk = 0.0017391 k( 31) = ( -0.1209172 0.1209172 0.1209172), wk = 0.0017391 k( 32) = ( -0.1249478 0.1249478 0.1249478), wk = 0.0017391 k( 33) = ( -0.1289783 0.1289784 0.1289783), wk = 0.0017391 k( 34) = ( -0.1330089 0.1330089 0.1330089), wk = 0.0017391 k( 35) = ( -0.1370395 0.1370395 0.1370395), wk = 0.0017391 k( 36) = ( -0.1410701 0.1410701 0.1410701), wk = 0.0017391 k( 37) = ( -0.1451006 0.1451006 0.1451006), wk = 0.0017391 k( 38) = ( -0.1491312 0.1491312 0.1491312), wk = 0.0017391 k( 39) = ( -0.1531618 0.1531618 0.1531618), wk = 0.0017391 k( 40) = ( -0.1571924 0.1571924 0.1571924), wk = 0.0017391 k( 41) = ( -0.1612229 0.1612229 0.1612229), wk = 0.0017391 k( 42) = ( -0.1652535 0.1652535 0.1652535), wk = 0.0017391 k( 43) = ( -0.1692841 0.1692841 0.1692841), wk = 0.0017391 k( 44) = ( -0.1733146 0.1733147 0.1733146), wk = 0.0017391 k( 45) = ( -0.1773452 0.1773452 0.1773452), wk = 0.0017391 k( 46) = ( -0.1813758 0.1813758 0.1813758), wk = 0.0017391 k( 47) = ( -0.1854064 0.1854064 0.1854064), wk = 0.0017391 k( 48) = ( -0.1894369 0.1894369 0.1894369), wk = 0.0017391 k( 49) = ( -0.1934675 0.1934675 0.1934675), wk = 0.0017391 k( 50) = ( -0.1974981 0.1974981 0.1974981), wk = 0.0017391 k( 51) = ( -0.2015287 0.2015287 0.2015287), wk = 0.0017391 k( 52) = ( -0.2055592 0.2055592 0.2055592), wk = 0.0017391 k( 53) = ( -0.2095898 0.2095898 0.2095898), wk = 0.0017391 k( 54) = ( -0.2136204 0.2136204 0.2136204), wk = 0.0017391 k( 55) = ( -0.2176510 0.2176510 0.2176510), wk = 0.0017391 k( 56) = ( -0.2216815 0.2216815 0.2216815), wk = 0.0017391 k( 57) = ( -0.2257121 0.2257121 0.2257121), wk = 0.0017391 k( 58) = ( -0.2297427 0.2297427 0.2297427), wk = 0.0017391 k( 59) = ( -0.2337732 0.2337732 0.2337732), wk = 0.0017391 k( 60) = ( -0.2378038 0.2378038 0.2378038), wk = 0.0017391 k( 61) = ( -0.2418344 0.2418344 0.2418344), wk = 0.0017391 k( 62) = ( -0.2458650 0.2458650 0.2458650), wk = 0.0017391 k( 63) = ( -0.2498955 0.2498955 0.2498956), wk = 0.0017391 k( 64) = ( -0.2539261 0.2539261 0.2539261), wk = 0.0017391 k( 65) = ( -0.2579567 0.2579567 0.2579567), wk = 0.0017391 k( 66) = ( -0.2619873 0.2619873 0.2619873), wk = 0.0017391 k( 67) = ( -0.2660178 0.2660178 0.2660178), wk = 0.0017391 k( 68) = ( -0.2700484 0.2700484 0.2700484), wk = 0.0017391 k( 69) = ( -0.2740790 0.2740790 0.2740790), wk = 0.0017391 k( 70) = ( -0.2781096 0.2781096 0.2781096), wk = 0.0017391 k( 71) = ( -0.2821401 0.2821401 0.2821401), wk = 0.0017391 k( 72) = ( -0.2861707 0.2861707 0.2861707), wk = 0.0017391 k( 73) = ( -0.2902013 0.2902013 0.2902013), wk = 0.0017391 k( 74) = ( -0.2942319 0.2942319 0.2942319), wk = 0.0017391 k( 75) = ( -0.2982624 0.2982624 0.2982624), wk = 0.0017391 k( 76) = ( -0.3022930 0.3022930 0.3022930), wk = 0.0017391 k( 77) = ( -0.3063236 0.3063236 0.3063236), wk = 0.0017391 k( 78) = ( -0.3103541 0.3103541 0.3103541), wk = 0.0017391 k( 79) = ( -0.3143847 0.3143847 0.3143847), wk = 0.0017391 k( 80) = ( -0.3184153 0.3184153 0.3184153), wk = 0.0017391 k( 81) = ( -0.3224459 0.3224459 0.3224459), wk = 0.0017391 k( 82) = ( -0.3224459 0.3224459 0.3224459), wk = 0.0017391 k( 83) = ( -0.3163985 0.3163985 0.3284932), wk = 0.0017391 k( 84) = ( -0.3103511 0.3103511 0.3345406), wk = 0.0017391 k( 85) = ( -0.3043038 0.3043038 0.3405880), wk = 0.0017391 k( 86) = ( -0.2982564 0.2982564 0.3466353), wk = 0.0017391 k( 87) = ( -0.2982564 0.2982564 0.3466353), wk = 0.0017391 k( 88) = ( -0.2901954 0.2901954 0.3507803), wk = 0.0017391 k( 89) = ( -0.2821344 0.2821344 0.3549253), wk = 0.0017391 k( 90) = ( -0.2740735 0.2740735 0.3590703), wk = 0.0017391 k( 91) = ( -0.2660125 0.2660125 0.3632153), wk = 0.0017391 k( 92) = ( -0.2579515 0.2579515 0.3673603), wk = 0.0017391 k( 93) = ( -0.2498905 0.2498905 0.3715053), wk = 0.0017391 k( 94) = ( -0.2418295 0.2418295 0.3756503), wk = 0.0017391 k( 95) = ( -0.2337685 0.2337685 0.3797952), wk = 0.0017391 k( 96) = ( -0.2257076 0.2257076 0.3839402), wk = 0.0017391 k( 97) = ( -0.2176466 0.2176466 0.3880852), wk = 0.0017391 k( 98) = ( -0.2095856 0.2095856 0.3922302), wk = 0.0017391 k( 99) = ( -0.2015246 0.2015246 0.3963752), wk = 0.0017391 k( 100) = ( -0.1934636 0.1934636 0.4005202), wk = 0.0017391 k( 101) = ( -0.1854026 0.1854026 0.4046652), wk = 0.0017391 k( 102) = ( -0.1773416 0.1773416 0.4088102), wk = 0.0017391 k( 103) = ( -0.1692807 0.1692807 0.4129552), wk = 0.0017391 k( 104) = ( -0.1612197 0.1612197 0.4171002), wk = 0.0017391 k( 105) = ( -0.1531587 0.1531587 0.4212452), wk = 0.0017391 k( 106) = ( -0.1450977 0.1450977 0.4253902), wk = 0.0017391 k( 107) = ( -0.1370367 0.1370367 0.4295352), wk = 0.0017391 k( 108) = ( -0.1289758 0.1289758 0.4336801), wk = 0.0017391 k( 109) = ( -0.1209148 0.1209148 0.4378251), wk = 0.0017391 k( 110) = ( -0.1128538 0.1128538 0.4419701), wk = 0.0017391 k( 111) = ( -0.1047928 0.1047928 0.4461151), wk = 0.0017391 k( 112) = ( -0.0967318 0.0967318 0.4502601), wk = 0.0017391 k( 113) = ( -0.0886708 0.0886708 0.4544051), wk = 0.0017391 k( 114) = ( -0.0806098 0.0806098 0.4585501), wk = 0.0017391 k( 115) = ( -0.0725489 0.0725489 0.4626951), wk = 0.0017391 k( 116) = ( -0.0644879 0.0644879 0.4668401), wk = 0.0017391 k( 117) = ( -0.0564269 0.0564269 0.4709851), wk = 0.0017391 k( 118) = ( -0.0483659 0.0483659 0.4751301), wk = 0.0017391 k( 119) = ( -0.0403049 0.0403049 0.4792750), wk = 0.0017391 k( 120) = ( -0.0322439 0.0322439 0.4834200), wk = 0.0017391 k( 121) = ( -0.0241830 0.0241830 0.4875650), wk = 0.0017391 k( 122) = ( -0.0161220 0.0161220 0.4917100), wk = 0.0017391 k( 123) = ( -0.0080610 0.0080610 0.4958550), wk = 0.0017391 k( 124) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0017391 k( 125) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0017391 k( 126) = ( 0.0073529 0.0073529 0.4926471), wk = 0.0017391 k( 127) = ( 0.0147059 0.0147059 0.4852941), wk = 0.0017391 k( 128) = ( 0.0220588 0.0220588 0.4779412), wk = 0.0017391 k( 129) = ( 0.0294118 0.0294118 0.4705882), wk = 0.0017391 k( 130) = ( 0.0367647 0.0367647 0.4632353), wk = 0.0017391 k( 131) = ( 0.0441177 0.0441176 0.4558824), wk = 0.0017391 k( 132) = ( 0.0514706 0.0514706 0.4485294), wk = 0.0017391 k( 133) = ( 0.0588235 0.0588235 0.4411765), wk = 0.0017391 k( 134) = ( 0.0661765 0.0661765 0.4338235), wk = 0.0017391 k( 135) = ( 0.0735294 0.0735294 0.4264706), wk = 0.0017391 k( 136) = ( 0.0808824 0.0808824 0.4191177), wk = 0.0017391 k( 137) = ( 0.0882353 0.0882353 0.4117647), wk = 0.0017391 k( 138) = ( 0.0955882 0.0955882 0.4044118), wk = 0.0017391 k( 139) = ( 0.1029412 0.1029412 0.3970588), wk = 0.0017391 k( 140) = ( 0.1102941 0.1102941 0.3897059), wk = 0.0017391 k( 141) = ( 0.1176471 0.1176471 0.3823529), wk = 0.0017391 k( 142) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0017391 k( 143) = ( 0.1323529 0.1323529 0.3676471), wk = 0.0017391 k( 144) = ( 0.1397059 0.1397059 0.3602941), wk = 0.0017391 k( 145) = ( 0.1470588 0.1470588 0.3529412), wk = 0.0017391 k( 146) = ( 0.1544118 0.1544118 0.3455882), wk = 0.0017391 k( 147) = ( 0.1617647 0.1617647 0.3382353), wk = 0.0017391 k( 148) = ( 0.1691177 0.1691177 0.3308823), wk = 0.0017391 k( 149) = ( 0.1764706 0.1764706 0.3235294), wk = 0.0017391 k( 150) = ( 0.1838235 0.1838235 0.3161765), wk = 0.0017391 k( 151) = ( 0.1911765 0.1911765 0.3088235), wk = 0.0017391 k( 152) = ( 0.1985294 0.1985294 0.3014706), wk = 0.0017391 k( 153) = ( 0.2058823 0.2058823 0.2941177), wk = 0.0017391 k( 154) = ( 0.2132353 0.2132353 0.2867647), wk = 0.0017391 k( 155) = ( 0.2205882 0.2205882 0.2794118), wk = 0.0017391 k( 156) = ( 0.2279412 0.2279412 0.2720588), wk = 0.0017391 k( 157) = ( 0.2352941 0.2352941 0.2647059), wk = 0.0017391 k( 158) = ( 0.2426471 0.2426471 0.2573529), wk = 0.0017391 k( 159) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0017391 k( 160) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0017391 k( 161) = ( 0.2428571 0.2571429 0.2428571), wk = 0.0017391 k( 162) = ( 0.2357143 0.2642857 0.2357143), wk = 0.0017391 k( 163) = ( 0.2285714 0.2714286 0.2285714), wk = 0.0017391 k( 164) = ( 0.2214286 0.2785714 0.2214286), wk = 0.0017391 k( 165) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0017391 k( 166) = ( 0.2071429 0.2928571 0.2071429), wk = 0.0017391 k( 167) = ( 0.2000000 0.3000000 0.2000000), wk = 0.0017391 k( 168) = ( 0.1928571 0.3071429 0.1928571), wk = 0.0017391 k( 169) = ( 0.1857143 0.3142857 0.1857143), wk = 0.0017391 k( 170) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0017391 k( 171) = ( 0.1714286 0.3285714 0.1714286), wk = 0.0017391 k( 172) = ( 0.1642857 0.3357143 0.1642857), wk = 0.0017391 k( 173) = ( 0.1571429 0.3428571 0.1571429), wk = 0.0017391 k( 174) = ( 0.1500000 0.3500000 0.1500000), wk = 0.0017391 k( 175) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0017391 k( 176) = ( 0.1357143 0.3642857 0.1357143), wk = 0.0017391 k( 177) = ( 0.1285714 0.3714286 0.1285714), wk = 0.0017391 k( 178) = ( 0.1214286 0.3785714 0.1214286), wk = 0.0017391 k( 179) = ( 0.1142857 0.3857143 0.1142857), wk = 0.0017391 k( 180) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0017391 k( 181) = ( 0.1000000 0.4000000 0.1000000), wk = 0.0017391 k( 182) = ( 0.0928571 0.4071429 0.0928571), wk = 0.0017391 k( 183) = ( 0.0857143 0.4142857 0.0857143), wk = 0.0017391 k( 184) = ( 0.0785714 0.4214286 0.0785714), wk = 0.0017391 k( 185) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0017391 k( 186) = ( 0.0642857 0.4357143 0.0642857), wk = 0.0017391 k( 187) = ( 0.0571429 0.4428571 0.0571429), wk = 0.0017391 k( 188) = ( 0.0500000 0.4500000 0.0500000), wk = 0.0017391 k( 189) = ( 0.0428571 0.4571429 0.0428571), wk = 0.0017391 k( 190) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0017391 k( 191) = ( 0.0285714 0.4714286 0.0285714), wk = 0.0017391 k( 192) = ( 0.0214286 0.4785714 0.0214286), wk = 0.0017391 k( 193) = ( 0.0142857 0.4857143 0.0142857), wk = 0.0017391 k( 194) = ( 0.0071429 0.4928571 0.0071429), wk = 0.0017391 k( 195) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0017391 k( 196) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0017391 k( 197) = ( 0.0084854 0.5046725 -0.0084854), wk = 0.0017391 k( 198) = ( 0.0169708 0.5093450 -0.0169708), wk = 0.0017391 k( 199) = ( 0.0254562 0.5140174 -0.0254563), wk = 0.0017391 k( 200) = ( 0.0339417 0.5186899 -0.0339417), wk = 0.0017391 k( 201) = ( 0.0424271 0.5233624 -0.0424271), wk = 0.0017391 k( 202) = ( 0.0509125 0.5280349 -0.0509125), wk = 0.0017391 k( 203) = ( 0.0593979 0.5327073 -0.0593979), wk = 0.0017391 k( 204) = ( 0.0678833 0.5373798 -0.0678833), wk = 0.0017391 k( 205) = ( 0.0763688 0.5420523 -0.0763688), wk = 0.0017391 k( 206) = ( 0.0848542 0.5467248 -0.0848542), wk = 0.0017391 k( 207) = ( 0.0933396 0.5513973 -0.0933396), wk = 0.0017391 k( 208) = ( 0.1018250 0.5560697 -0.1018250), wk = 0.0017391 k( 209) = ( 0.1103104 0.5607422 -0.1103104), wk = 0.0017391 k( 210) = ( 0.1187958 0.5654147 -0.1187958), wk = 0.0017391 k( 211) = ( 0.1272813 0.5700872 -0.1272813), wk = 0.0017391 k( 212) = ( 0.1357667 0.5747596 -0.1357667), wk = 0.0017391 k( 213) = ( 0.1442521 0.5794321 -0.1442521), wk = 0.0017391 k( 214) = ( 0.1527375 0.5841046 -0.1527375), wk = 0.0017391 k( 215) = ( 0.1612229 0.5887771 -0.1612229), wk = 0.0017391 k( 216) = ( 0.1697084 0.5934495 -0.1697083), wk = 0.0017391 k( 217) = ( 0.1781938 0.5981220 -0.1781938), wk = 0.0017391 k( 218) = ( 0.1866792 0.6027945 -0.1866792), wk = 0.0017391 k( 219) = ( 0.1951646 0.6074670 -0.1951646), wk = 0.0017391 k( 220) = ( 0.2036500 0.6121395 -0.2036500), wk = 0.0017391 k( 221) = ( 0.2121354 0.6168119 -0.2121354), wk = 0.0017391 k( 222) = ( 0.2206209 0.6214844 -0.2206209), wk = 0.0017391 k( 223) = ( 0.2291063 0.6261569 -0.2291063), wk = 0.0017391 k( 224) = ( 0.2375917 0.6308294 -0.2375917), wk = 0.0017391 k( 225) = ( 0.2460771 0.6355018 -0.2460771), wk = 0.0017391 k( 226) = ( 0.2545625 0.6401743 -0.2545625), wk = 0.0017391 k( 227) = ( 0.2630479 0.6448468 -0.2630479), wk = 0.0017391 k( 228) = ( 0.2715334 0.6495193 -0.2715334), wk = 0.0017391 k( 229) = ( 0.2800188 0.6541917 -0.2800188), wk = 0.0017391 k( 230) = ( 0.2885042 0.6588642 -0.2885042), wk = 0.0017391 k( 231) = ( 0.2969896 0.6635367 -0.2969896), wk = 0.0017391 k( 232) = ( 0.3054750 0.6682092 -0.3054750), wk = 0.0017391 k( 233) = ( 0.3139605 0.6728817 -0.3139605), wk = 0.0017391 k( 234) = ( 0.3224459 0.6775541 -0.3224459), wk = 0.0017391 k( 235) = ( 0.3224459 0.6775541 -0.3224459), wk = 0.0017391 k( 236) = ( 0.3264812 0.6735188 -0.3264812), wk = 0.0017391 k( 237) = ( 0.3305165 0.6694835 -0.3305165), wk = 0.0017391 k( 238) = ( 0.3345518 0.6654482 -0.3345518), wk = 0.0017391 k( 239) = ( 0.3385872 0.6614129 -0.3385872), wk = 0.0017391 k( 240) = ( 0.3426225 0.6573775 -0.3426225), wk = 0.0017391 k( 241) = ( 0.3466578 0.6533422 -0.3466578), wk = 0.0017391 k( 242) = ( 0.3506931 0.6493069 -0.3506931), wk = 0.0017391 k( 243) = ( 0.3547284 0.6452716 -0.3547284), wk = 0.0017391 k( 244) = ( 0.3587638 0.6412362 -0.3587638), wk = 0.0017391 k( 245) = ( 0.3627991 0.6372009 -0.3627991), wk = 0.0017391 k( 246) = ( 0.3668344 0.6331656 -0.3668344), wk = 0.0017391 k( 247) = ( 0.3708697 0.6291303 -0.3708697), wk = 0.0017391 k( 248) = ( 0.3749050 0.6250950 -0.3749050), wk = 0.0017391 k( 249) = ( 0.3789404 0.6210596 -0.3789404), wk = 0.0017391 k( 250) = ( 0.3829757 0.6170243 -0.3829757), wk = 0.0017391 k( 251) = ( 0.3870110 0.6129890 -0.3870110), wk = 0.0017391 k( 252) = ( 0.3910463 0.6089537 -0.3910463), wk = 0.0017391 k( 253) = ( 0.3950817 0.6049184 -0.3950816), wk = 0.0017391 k( 254) = ( 0.3991170 0.6008830 -0.3991170), wk = 0.0017391 k( 255) = ( 0.4031523 0.5968477 -0.4031523), wk = 0.0017391 k( 256) = ( 0.4071876 0.5928124 -0.4071876), wk = 0.0017391 k( 257) = ( 0.4112229 0.5887771 -0.4112229), wk = 0.0017391 k( 258) = ( 0.4152582 0.5847418 -0.4152583), wk = 0.0017391 k( 259) = ( 0.4192936 0.5807064 -0.4192936), wk = 0.0017391 k( 260) = ( 0.4233289 0.5766711 -0.4233289), wk = 0.0017391 k( 261) = ( 0.4273642 0.5726358 -0.4273642), wk = 0.0017391 k( 262) = ( 0.4313995 0.5686005 -0.4313995), wk = 0.0017391 k( 263) = ( 0.4354349 0.5645651 -0.4354349), wk = 0.0017391 k( 264) = ( 0.4394702 0.5605298 -0.4394702), wk = 0.0017391 k( 265) = ( 0.4435055 0.5564945 -0.4435055), wk = 0.0017391 k( 266) = ( 0.4475408 0.5524592 -0.4475408), wk = 0.0017391 k( 267) = ( 0.4515761 0.5484239 -0.4515761), wk = 0.0017391 k( 268) = ( 0.4556115 0.5443885 -0.4556115), wk = 0.0017391 k( 269) = ( 0.4596468 0.5403532 -0.4596468), wk = 0.0017391 k( 270) = ( 0.4636821 0.5363179 -0.4636821), wk = 0.0017391 k( 271) = ( 0.4677174 0.5322826 -0.4677174), wk = 0.0017391 k( 272) = ( 0.4717527 0.5282472 -0.4717527), wk = 0.0017391 k( 273) = ( 0.4757881 0.5242119 -0.4757881), wk = 0.0017391 k( 274) = ( 0.4798234 0.5201766 -0.4798234), wk = 0.0017391 k( 275) = ( 0.4838587 0.5161413 -0.4838587), wk = 0.0017391 k( 276) = ( 0.4878940 0.5121060 -0.4878940), wk = 0.0017391 k( 277) = ( 0.4919294 0.5080706 -0.4919294), wk = 0.0017391 k( 278) = ( 0.4959647 0.5040353 -0.4959647), wk = 0.0017391 k( 279) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0017391 k( 280) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0017391 k( 281) = ( 0.4925373 0.4925373 -0.4925373), wk = 0.0017391 k( 282) = ( 0.4850746 0.4850746 -0.4850746), wk = 0.0017391 k( 283) = ( 0.4776119 0.4776119 -0.4776119), wk = 0.0017391 k( 284) = ( 0.4701493 0.4701493 -0.4701493), wk = 0.0017391 k( 285) = ( 0.4626866 0.4626866 -0.4626866), wk = 0.0017391 k( 286) = ( 0.4552239 0.4552239 -0.4552239), wk = 0.0017391 k( 287) = ( 0.4477612 0.4477612 -0.4477612), wk = 0.0017391 k( 288) = ( 0.4402985 0.4402985 -0.4402985), wk = 0.0017391 k( 289) = ( 0.4328358 0.4328358 -0.4328358), wk = 0.0017391 k( 290) = ( 0.4253731 0.4253731 -0.4253731), wk = 0.0017391 k( 291) = ( 0.4179104 0.4179104 -0.4179104), wk = 0.0017391 k( 292) = ( 0.4104478 0.4104478 -0.4104478), wk = 0.0017391 k( 293) = ( 0.4029851 0.4029851 -0.4029851), wk = 0.0017391 k( 294) = ( 0.3955224 0.3955224 -0.3955224), wk = 0.0017391 k( 295) = ( 0.3880597 0.3880597 -0.3880597), wk = 0.0017391 k( 296) = ( 0.3805970 0.3805970 -0.3805970), wk = 0.0017391 k( 297) = ( 0.3731343 0.3731343 -0.3731343), wk = 0.0017391 k( 298) = ( 0.3656716 0.3656716 -0.3656716), wk = 0.0017391 k( 299) = ( 0.3582090 0.3582090 -0.3582090), wk = 0.0017391 k( 300) = ( 0.3507463 0.3507463 -0.3507463), wk = 0.0017391 k( 301) = ( 0.3432836 0.3432836 -0.3432836), wk = 0.0017391 k( 302) = ( 0.3358209 0.3358209 -0.3358209), wk = 0.0017391 k( 303) = ( 0.3283582 0.3283582 -0.3283582), wk = 0.0017391 k( 304) = ( 0.3208955 0.3208955 -0.3208955), wk = 0.0017391 k( 305) = ( 0.3134328 0.3134328 -0.3134328), wk = 0.0017391 k( 306) = ( 0.3059701 0.3059701 -0.3059701), wk = 0.0017391 k( 307) = ( 0.2985075 0.2985075 -0.2985075), wk = 0.0017391 k( 308) = ( 0.2910448 0.2910448 -0.2910448), wk = 0.0017391 k( 309) = ( 0.2835821 0.2835821 -0.2835821), wk = 0.0017391 k( 310) = ( 0.2761194 0.2761194 -0.2761194), wk = 0.0017391 k( 311) = ( 0.2686567 0.2686567 -0.2686567), wk = 0.0017391 k( 312) = ( 0.2611940 0.2611940 -0.2611940), wk = 0.0017391 k( 313) = ( 0.2537313 0.2537313 -0.2537313), wk = 0.0017391 k( 314) = ( 0.2462687 0.2462687 -0.2462687), wk = 0.0017391 k( 315) = ( 0.2388060 0.2388060 -0.2388060), wk = 0.0017391 k( 316) = ( 0.2313433 0.2313433 -0.2313433), wk = 0.0017391 k( 317) = ( 0.2238806 0.2238806 -0.2238806), wk = 0.0017391 k( 318) = ( 0.2164179 0.2164179 -0.2164179), wk = 0.0017391 k( 319) = ( 0.2089552 0.2089552 -0.2089552), wk = 0.0017391 k( 320) = ( 0.2014925 0.2014925 -0.2014925), wk = 0.0017391 k( 321) = ( 0.1940299 0.1940299 -0.1940299), wk = 0.0017391 k( 322) = ( 0.1865672 0.1865672 -0.1865672), wk = 0.0017391 k( 323) = ( 0.1791045 0.1791045 -0.1791045), wk = 0.0017391 k( 324) = ( 0.1716418 0.1716418 -0.1716418), wk = 0.0017391 k( 325) = ( 0.1641791 0.1641791 -0.1641791), wk = 0.0017391 k( 326) = ( 0.1567164 0.1567164 -0.1567164), wk = 0.0017391 k( 327) = ( 0.1492537 0.1492537 -0.1492537), wk = 0.0017391 k( 328) = ( 0.1417910 0.1417910 -0.1417910), wk = 0.0017391 k( 329) = ( 0.1343284 0.1343284 -0.1343284), wk = 0.0017391 k( 330) = ( 0.1268657 0.1268657 -0.1268657), wk = 0.0017391 k( 331) = ( 0.1194030 0.1194030 -0.1194030), wk = 0.0017391 k( 332) = ( 0.1119403 0.1119403 -0.1119403), wk = 0.0017391 k( 333) = ( 0.1044776 0.1044776 -0.1044776), wk = 0.0017391 k( 334) = ( 0.0970149 0.0970149 -0.0970149), wk = 0.0017391 k( 335) = ( 0.0895522 0.0895522 -0.0895522), wk = 0.0017391 k( 336) = ( 0.0820895 0.0820895 -0.0820896), wk = 0.0017391 k( 337) = ( 0.0746269 0.0746269 -0.0746269), wk = 0.0017391 k( 338) = ( 0.0671642 0.0671642 -0.0671642), wk = 0.0017391 k( 339) = ( 0.0597015 0.0597015 -0.0597015), wk = 0.0017391 k( 340) = ( 0.0522388 0.0522388 -0.0522388), wk = 0.0017391 k( 341) = ( 0.0447761 0.0447761 -0.0447761), wk = 0.0017391 k( 342) = ( 0.0373134 0.0373134 -0.0373134), wk = 0.0017391 k( 343) = ( 0.0298507 0.0298508 -0.0298507), wk = 0.0017391 k( 344) = ( 0.0223881 0.0223881 -0.0223881), wk = 0.0017391 k( 345) = ( 0.0149254 0.0149254 -0.0149254), wk = 0.0017391 k( 346) = ( 0.0074627 0.0074627 -0.0074627), wk = 0.0017391 k( 347) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017391 k( 348) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017391 k( 349) = ( 0.0071017 -0.0071017 0.0071016), wk = 0.0017391 k( 350) = ( 0.0142033 -0.0142033 0.0142033), wk = 0.0017391 k( 351) = ( 0.0213049 -0.0213050 0.0213050), wk = 0.0017391 k( 352) = ( 0.0284066 -0.0284066 0.0284066), wk = 0.0017391 k( 353) = ( 0.0355082 -0.0355082 0.0355082), wk = 0.0017391 k( 354) = ( 0.0426099 -0.0426099 0.0426099), wk = 0.0017391 k( 355) = ( 0.0497116 -0.0497116 0.0497116), wk = 0.0017391 k( 356) = ( 0.0568132 -0.0568132 0.0568132), wk = 0.0017391 k( 357) = ( 0.0639148 -0.0639149 0.0639148), wk = 0.0017391 k( 358) = ( 0.0710165 -0.0710165 0.0710165), wk = 0.0017391 k( 359) = ( 0.0781181 -0.0781181 0.0781181), wk = 0.0017391 k( 360) = ( 0.0852198 -0.0852198 0.0852198), wk = 0.0017391 k( 361) = ( 0.0923214 -0.0923215 0.0923215), wk = 0.0017391 k( 362) = ( 0.0994231 -0.0994231 0.0994231), wk = 0.0017391 k( 363) = ( 0.1065248 -0.1065248 0.1065248), wk = 0.0017391 k( 364) = ( 0.1136264 -0.1136264 0.1136264), wk = 0.0017391 k( 365) = ( 0.1207281 -0.1207281 0.1207281), wk = 0.0017391 k( 366) = ( 0.1278297 -0.1278297 0.1278297), wk = 0.0017391 k( 367) = ( 0.1349314 -0.1349314 0.1349314), wk = 0.0017391 k( 368) = ( 0.1420330 -0.1420330 0.1420330), wk = 0.0017391 k( 369) = ( 0.1491347 -0.1491347 0.1491346), wk = 0.0017391 k( 370) = ( 0.1562363 -0.1562363 0.1562363), wk = 0.0017391 k( 371) = ( 0.1633380 -0.1633380 0.1633380), wk = 0.0017391 k( 372) = ( 0.1704396 -0.1704396 0.1704396), wk = 0.0017391 k( 373) = ( 0.1775413 -0.1775413 0.1775413), wk = 0.0017391 k( 374) = ( 0.1846429 -0.1846429 0.1846429), wk = 0.0017391 k( 375) = ( 0.1917446 -0.1917446 0.1917446), wk = 0.0017391 k( 376) = ( 0.1988462 -0.1988462 0.1988462), wk = 0.0017391 k( 377) = ( 0.2059478 -0.2059479 0.2059478), wk = 0.0017391 k( 378) = ( 0.2130495 -0.2130495 0.2130495), wk = 0.0017391 k( 379) = ( 0.2201511 -0.2201512 0.2201512), wk = 0.0017391 k( 380) = ( 0.2272528 -0.2272528 0.2272528), wk = 0.0017391 k( 381) = ( 0.2343544 -0.2343544 0.2343544), wk = 0.0017391 k( 382) = ( 0.2414561 -0.2414561 0.2414561), wk = 0.0017391 k( 383) = ( 0.2485577 -0.2485577 0.2485578), wk = 0.0017391 k( 384) = ( 0.2556594 -0.2556594 0.2556594), wk = 0.0017391 k( 385) = ( 0.2627610 -0.2627611 0.2627610), wk = 0.0017391 k( 386) = ( 0.2698627 -0.2698627 0.2698627), wk = 0.0017391 k( 387) = ( 0.2769644 -0.2769644 0.2769644), wk = 0.0017391 k( 388) = ( 0.2840660 -0.2840660 0.2840660), wk = 0.0017391 k( 389) = ( 0.2911677 -0.2911677 0.2911677), wk = 0.0017391 k( 390) = ( 0.2982693 -0.2982693 0.2982693), wk = 0.0017391 k( 391) = ( 0.3053709 -0.3053709 0.3053709), wk = 0.0017391 k( 392) = ( 0.3124726 -0.3124726 0.3124726), wk = 0.0017391 k( 393) = ( 0.3195743 -0.3195743 0.3195743), wk = 0.0017391 k( 394) = ( 0.3266759 -0.3266759 0.3266759), wk = 0.0017391 k( 395) = ( 0.3337775 -0.3337776 0.3337776), wk = 0.0017391 k( 396) = ( 0.3408792 -0.3408792 0.3408792), wk = 0.0017391 k( 397) = ( 0.3479809 -0.3479809 0.3479809), wk = 0.0017391 k( 398) = ( 0.3550825 -0.3550825 0.3550825), wk = 0.0017391 k( 399) = ( 0.3621841 -0.3621842 0.3621842), wk = 0.0017391 k( 400) = ( 0.3692858 -0.3692858 0.3692858), wk = 0.0017391 k( 401) = ( 0.3763875 -0.3763875 0.3763875), wk = 0.0017391 k( 402) = ( 0.3834891 -0.3834891 0.3834891), wk = 0.0017391 k( 403) = ( 0.3905907 -0.3905907 0.3905907), wk = 0.0017391 k( 404) = ( 0.3976924 -0.3976924 0.3976924), wk = 0.0017391 k( 405) = ( 0.4047941 -0.4047941 0.4047941), wk = 0.0017391 k( 406) = ( 0.4118957 -0.4118957 0.4118957), wk = 0.0017391 k( 407) = ( 0.4189973 -0.4189974 0.4189974), wk = 0.0017391 k( 408) = ( 0.4260990 -0.4260990 0.4260990), wk = 0.0017391 k( 409) = ( 0.4332007 -0.4332007 0.4332007), wk = 0.0017391 k( 410) = ( 0.4403023 -0.4403023 0.4403023), wk = 0.0017391 k( 411) = ( 0.4474039 -0.4474040 0.4474039), wk = 0.0017391 k( 412) = ( 0.4545056 -0.4545056 0.4545056), wk = 0.0017391 k( 413) = ( 0.4616073 -0.4616073 0.4616073), wk = 0.0017391 k( 414) = ( 0.4687089 -0.4687089 0.4687089), wk = 0.0017391 k( 415) = ( 0.4758105 -0.4758106 0.4758106), wk = 0.0017391 k( 416) = ( 0.4758105 -0.4758106 0.4758106), wk = 0.0017391 k( 417) = ( 0.4763364 -0.4654668 0.4654668), wk = 0.0017391 k( 418) = ( 0.4768623 -0.4551231 0.4551231), wk = 0.0017391 k( 419) = ( 0.4773881 -0.4447794 0.4447794), wk = 0.0017391 k( 420) = ( 0.4779140 -0.4344357 0.4344357), wk = 0.0017391 k( 421) = ( 0.4784398 -0.4240920 0.4240920), wk = 0.0017391 k( 422) = ( 0.4789657 -0.4137483 0.4137483), wk = 0.0017391 k( 423) = ( 0.4794915 -0.4034046 0.4034046), wk = 0.0017391 k( 424) = ( 0.4800174 -0.3930609 0.3930609), wk = 0.0017391 k( 425) = ( 0.4805433 -0.3827172 0.3827172), wk = 0.0017391 k( 426) = ( 0.4810691 -0.3723735 0.3723735), wk = 0.0017391 k( 427) = ( 0.4815950 -0.3620298 0.3620298), wk = 0.0017391 k( 428) = ( 0.4821208 -0.3516861 0.3516861), wk = 0.0017391 k( 429) = ( 0.4826467 -0.3413424 0.3413424), wk = 0.0017391 k( 430) = ( 0.4831725 -0.3309986 0.3309986), wk = 0.0017391 k( 431) = ( 0.4836984 -0.3206549 0.3206549), wk = 0.0017391 k( 432) = ( 0.4842243 -0.3103112 0.3103112), wk = 0.0017391 k( 433) = ( 0.4847501 -0.2999675 0.2999675), wk = 0.0017391 k( 434) = ( 0.4852760 -0.2896238 0.2896238), wk = 0.0017391 k( 435) = ( 0.4858018 -0.2792801 0.2792801), wk = 0.0017391 k( 436) = ( 0.4863277 -0.2689364 0.2689364), wk = 0.0017391 k( 437) = ( 0.4868536 -0.2585927 0.2585927), wk = 0.0017391 k( 438) = ( 0.4873794 -0.2482490 0.2482490), wk = 0.0017391 k( 439) = ( 0.4879053 -0.2379053 0.2379053), wk = 0.0017391 k( 440) = ( 0.4884311 -0.2275616 0.2275616), wk = 0.0017391 k( 441) = ( 0.4889570 -0.2172179 0.2172179), wk = 0.0017391 k( 442) = ( 0.4894829 -0.2068742 0.2068742), wk = 0.0017391 k( 443) = ( 0.4900087 -0.1965304 0.1965304), wk = 0.0017391 k( 444) = ( 0.4905346 -0.1861867 0.1861867), wk = 0.0017391 k( 445) = ( 0.4910604 -0.1758430 0.1758430), wk = 0.0017391 k( 446) = ( 0.4915863 -0.1654993 0.1654993), wk = 0.0017391 k( 447) = ( 0.4921121 -0.1551556 0.1551556), wk = 0.0017391 k( 448) = ( 0.4926380 -0.1448119 0.1448119), wk = 0.0017391 k( 449) = ( 0.4931639 -0.1344682 0.1344682), wk = 0.0017391 k( 450) = ( 0.4936897 -0.1241245 0.1241245), wk = 0.0017391 k( 451) = ( 0.4942156 -0.1137808 0.1137808), wk = 0.0017391 k( 452) = ( 0.4947414 -0.1034371 0.1034371), wk = 0.0017391 k( 453) = ( 0.4952673 -0.0930934 0.0930934), wk = 0.0017391 k( 454) = ( 0.4957931 -0.0827497 0.0827497), wk = 0.0017391 k( 455) = ( 0.4963190 -0.0724060 0.0724059), wk = 0.0017391 k( 456) = ( 0.4968449 -0.0620623 0.0620623), wk = 0.0017391 k( 457) = ( 0.4973707 -0.0517185 0.0517185), wk = 0.0017391 k( 458) = ( 0.4978966 -0.0413748 0.0413748), wk = 0.0017391 k( 459) = ( 0.4984224 -0.0310311 0.0310311), wk = 0.0017391 k( 460) = ( 0.4989483 -0.0206874 0.0206874), wk = 0.0017391 k( 461) = ( 0.4994741 -0.0103437 0.0103437), wk = 0.0017391 k( 462) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0017391 k( 463) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0017391 k( 464) = ( 0.4959677 0.0040323 0.0040323), wk = 0.0017391 k( 465) = ( 0.4919355 0.0080645 0.0080645), wk = 0.0017391 k( 466) = ( 0.4879032 0.0120968 0.0120968), wk = 0.0017391 k( 467) = ( 0.4838710 0.0161290 0.0161290), wk = 0.0017391 k( 468) = ( 0.4798387 0.0201613 0.0201613), wk = 0.0017391 k( 469) = ( 0.4758064 0.0241936 0.0241936), wk = 0.0017391 k( 470) = ( 0.4717742 0.0282258 0.0282258), wk = 0.0017391 k( 471) = ( 0.4677419 0.0322581 0.0322581), wk = 0.0017391 k( 472) = ( 0.4637097 0.0362903 0.0362903), wk = 0.0017391 k( 473) = ( 0.4596774 0.0403226 0.0403226), wk = 0.0017391 k( 474) = ( 0.4556452 0.0443548 0.0443548), wk = 0.0017391 k( 475) = ( 0.4516129 0.0483871 0.0483871), wk = 0.0017391 k( 476) = ( 0.4475807 0.0524194 0.0524194), wk = 0.0017391 k( 477) = ( 0.4435484 0.0564516 0.0564516), wk = 0.0017391 k( 478) = ( 0.4395161 0.0604839 0.0604839), wk = 0.0017391 k( 479) = ( 0.4354839 0.0645161 0.0645161), wk = 0.0017391 k( 480) = ( 0.4314516 0.0685484 0.0685484), wk = 0.0017391 k( 481) = ( 0.4274193 0.0725806 0.0725806), wk = 0.0017391 k( 482) = ( 0.4233871 0.0766129 0.0766129), wk = 0.0017391 k( 483) = ( 0.4193548 0.0806452 0.0806452), wk = 0.0017391 k( 484) = ( 0.4153226 0.0846774 0.0846774), wk = 0.0017391 k( 485) = ( 0.4112903 0.0887097 0.0887097), wk = 0.0017391 k( 486) = ( 0.4072581 0.0927419 0.0927419), wk = 0.0017391 k( 487) = ( 0.4032258 0.0967742 0.0967742), wk = 0.0017391 k( 488) = ( 0.3991936 0.1008065 0.1008065), wk = 0.0017391 k( 489) = ( 0.3951613 0.1048387 0.1048387), wk = 0.0017391 k( 490) = ( 0.3911290 0.1088710 0.1088710), wk = 0.0017391 k( 491) = ( 0.3870968 0.1129032 0.1129032), wk = 0.0017391 k( 492) = ( 0.3830645 0.1169355 0.1169355), wk = 0.0017391 k( 493) = ( 0.3790323 0.1209677 0.1209677), wk = 0.0017391 k( 494) = ( 0.3750000 0.1250000 0.1250000), wk = 0.0017391 k( 495) = ( 0.3709677 0.1290323 0.1290323), wk = 0.0017391 k( 496) = ( 0.3669355 0.1330645 0.1330645), wk = 0.0017391 k( 497) = ( 0.3629032 0.1370968 0.1370968), wk = 0.0017391 k( 498) = ( 0.3588710 0.1411290 0.1411290), wk = 0.0017391 k( 499) = ( 0.3548387 0.1451613 0.1451613), wk = 0.0017391 k( 500) = ( 0.3508064 0.1491936 0.1491936), wk = 0.0017391 k( 501) = ( 0.3467742 0.1532258 0.1532258), wk = 0.0017391 k( 502) = ( 0.3427419 0.1572581 0.1572581), wk = 0.0017391 k( 503) = ( 0.3387097 0.1612903 0.1612903), wk = 0.0017391 k( 504) = ( 0.3346774 0.1653226 0.1653226), wk = 0.0017391 k( 505) = ( 0.3306452 0.1693548 0.1693548), wk = 0.0017391 k( 506) = ( 0.3266129 0.1733871 0.1733871), wk = 0.0017391 k( 507) = ( 0.3225807 0.1774194 0.1774193), wk = 0.0017391 k( 508) = ( 0.3185484 0.1814516 0.1814516), wk = 0.0017391 k( 509) = ( 0.3145161 0.1854839 0.1854839), wk = 0.0017391 k( 510) = ( 0.3104839 0.1895161 0.1895161), wk = 0.0017391 k( 511) = ( 0.3064516 0.1935484 0.1935484), wk = 0.0017391 k( 512) = ( 0.3024193 0.1975806 0.1975807), wk = 0.0017391 k( 513) = ( 0.2983871 0.2016129 0.2016129), wk = 0.0017391 k( 514) = ( 0.2943548 0.2056452 0.2056452), wk = 0.0017391 k( 515) = ( 0.2903226 0.2096774 0.2096774), wk = 0.0017391 k( 516) = ( 0.2862903 0.2137097 0.2137097), wk = 0.0017391 k( 517) = ( 0.2822581 0.2177419 0.2177419), wk = 0.0017391 k( 518) = ( 0.2782258 0.2217742 0.2217742), wk = 0.0017391 k( 519) = ( 0.2741936 0.2258064 0.2258065), wk = 0.0017391 k( 520) = ( 0.2701613 0.2298387 0.2298387), wk = 0.0017391 k( 521) = ( 0.2661290 0.2338710 0.2338710), wk = 0.0017391 k( 522) = ( 0.2620968 0.2379032 0.2379032), wk = 0.0017391 k( 523) = ( 0.2580645 0.2419355 0.2419355), wk = 0.0017391 k( 524) = ( 0.2540323 0.2459677 0.2459677), wk = 0.0017391 k( 525) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0017391 k( 526) = ( 0.2982564 -0.2982564 0.6533647), wk = 0.0017391 k( 527) = ( 0.3022917 -0.3022917 0.6493294), wk = 0.0017391 k( 528) = ( 0.3063270 -0.3063270 0.6452940), wk = 0.0017391 k( 529) = ( 0.3103624 -0.3103624 0.6412587), wk = 0.0017391 k( 530) = ( 0.3143977 -0.3143977 0.6372234), wk = 0.0017391 k( 531) = ( 0.3184330 -0.3184330 0.6331881), wk = 0.0017391 k( 532) = ( 0.3224683 -0.3224683 0.6291527), wk = 0.0017391 k( 533) = ( 0.3265037 -0.3265037 0.6251174), wk = 0.0017391 k( 534) = ( 0.3305390 -0.3305390 0.6210821), wk = 0.0017391 k( 535) = ( 0.3345743 -0.3345743 0.6170468), wk = 0.0017391 k( 536) = ( 0.3386096 -0.3386096 0.6130115), wk = 0.0017391 k( 537) = ( 0.3426449 -0.3426449 0.6089762), wk = 0.0017391 k( 538) = ( 0.3466803 -0.3466803 0.6049408), wk = 0.0017391 k( 539) = ( 0.3507156 -0.3507156 0.6009055), wk = 0.0017391 k( 540) = ( 0.3547509 -0.3547509 0.5968702), wk = 0.0017391 k( 541) = ( 0.3587862 -0.3587862 0.5928349), wk = 0.0017391 k( 542) = ( 0.3628215 -0.3628216 0.5887995), wk = 0.0017391 k( 543) = ( 0.3668569 -0.3668569 0.5847642), wk = 0.0017391 k( 544) = ( 0.3708922 -0.3708922 0.5807289), wk = 0.0017391 k( 545) = ( 0.3749275 -0.3749275 0.5766936), wk = 0.0017391 k( 546) = ( 0.3789628 -0.3789628 0.5726583), wk = 0.0017391 k( 547) = ( 0.3829982 -0.3829982 0.5686229), wk = 0.0017391 k( 548) = ( 0.3870335 -0.3870335 0.5645876), wk = 0.0017391 k( 549) = ( 0.3910688 -0.3910688 0.5605523), wk = 0.0017391 k( 550) = ( 0.3951041 -0.3951041 0.5565170), wk = 0.0017391 k( 551) = ( 0.3991394 -0.3991394 0.5524817), wk = 0.0017391 k( 552) = ( 0.4031748 -0.4031748 0.5484463), wk = 0.0017391 k( 553) = ( 0.4072101 -0.4072101 0.5444110), wk = 0.0017391 k( 554) = ( 0.4112454 -0.4112454 0.5403757), wk = 0.0017391 k( 555) = ( 0.4152807 -0.4152807 0.5363404), wk = 0.0017391 k( 556) = ( 0.4193160 -0.4193160 0.5323050), wk = 0.0017391 k( 557) = ( 0.4233514 -0.4233514 0.5282697), wk = 0.0017391 k( 558) = ( 0.4273867 -0.4273867 0.5242344), wk = 0.0017391 k( 559) = ( 0.4314220 -0.4314220 0.5201991), wk = 0.0017391 k( 560) = ( 0.4354573 -0.4354573 0.5161638), wk = 0.0017391 k( 561) = ( 0.4394926 -0.4394926 0.5121284), wk = 0.0017391 k( 562) = ( 0.4435280 -0.4435280 0.5080931), wk = 0.0017391 k( 563) = ( 0.4475633 -0.4475633 0.5040578), wk = 0.0017391 k( 564) = ( 0.4515986 -0.4515986 0.5000225), wk = 0.0017391 k( 565) = ( 0.4556339 -0.4556339 0.4959872), wk = 0.0017391 k( 566) = ( 0.4596693 -0.4596693 0.4919518), wk = 0.0017391 k( 567) = ( 0.4637046 -0.4637046 0.4879165), wk = 0.0017391 k( 568) = ( 0.4677399 -0.4677399 0.4838812), wk = 0.0017391 k( 569) = ( 0.4717752 -0.4717752 0.4798459), wk = 0.0017391 k( 570) = ( 0.4758105 -0.4758106 0.4758106), wk = 0.0017391 k( 571) = ( 0.5241894 0.4758105 -0.4758105), wk = 0.0017391 k( 572) = ( 0.5181421 0.4818579 -0.4818579), wk = 0.0017391 k( 573) = ( 0.5120947 0.4879053 -0.4879053), wk = 0.0017391 k( 574) = ( 0.5060474 0.4939526 -0.4939526), wk = 0.0017391 k( 575) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0017391 Dense grid: 7205 G-vectors FFT dimensions: ( 27, 27, 27) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.01 Mb ( 54, 16) NL pseudopotentials 0.03 Mb ( 27, 68) Each V/rho on FFT grid 0.01 Mb ( 729) Each G-vector array 0.00 Mb ( 201) G-vector shells 0.00 Mb ( 180) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.05 Mb ( 54, 64) Each subspace H/S matrix 0.00 Mb ( 16, 16) Each matrix 0.03 Mb ( 68, 2, 16) The potential is recalculated from file : ./Si.save/charge-density.dat Starting wfc are 16 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.8 secs Computing kpt #: 2 total cpu time spent up to now is 2.9 secs Computing kpt #: 3 total cpu time spent up to now is 3.0 secs Computing kpt #: 4 total cpu time spent up to now is 3.1 secs Computing kpt #: 5 total cpu time spent up to now is 3.1 secs Computing kpt #: 6 total cpu time spent up to now is 3.2 secs Computing kpt #: 7 total cpu time spent up to now is 3.3 secs Computing kpt #: 8 total cpu time spent up to now is 3.3 secs Computing kpt #: 9 total cpu time spent up to now is 3.4 secs Computing kpt #: 10 total cpu time spent up to now is 3.4 secs Computing kpt #: 11 total cpu time spent up to now is 3.5 secs Computing kpt #: 12 total cpu time spent up to now is 3.6 secs Computing kpt #: 13 total cpu time spent up to now is 3.7 secs Computing kpt #: 14 total cpu time spent up to now is 3.8 secs Computing kpt #: 15 total cpu time spent up to now is 3.9 secs Computing kpt #: 16 total cpu time spent up to now is 4.0 secs Computing kpt #: 17 total cpu time spent up to now is 4.1 secs Computing kpt #: 18 total cpu time spent up to now is 4.2 secs Computing kpt #: 19 total cpu time spent up to now is 4.3 secs Computing kpt #: 20 total cpu time spent up to now is 4.3 secs Computing kpt #: 21 total cpu time spent up to now is 4.4 secs Computing kpt #: 22 total cpu time spent up to now is 4.5 secs Computing kpt #: 23 total cpu time spent up to now is 4.6 secs Computing kpt #: 24 total cpu time spent up to now is 4.6 secs Computing kpt #: 25 total cpu time spent up to now is 4.7 secs Computing kpt #: 26 total cpu time spent up to now is 4.8 secs Computing kpt #: 27 total cpu time spent up to now is 4.8 secs Computing kpt #: 28 total cpu time spent up to now is 4.9 secs Computing kpt #: 29 total cpu time spent up to now is 4.9 secs Computing kpt #: 30 total cpu time spent up to now is 5.0 secs Computing kpt #: 31 total cpu time spent up to now is 5.0 secs Computing kpt #: 32 total cpu time spent up to now is 5.1 secs Computing kpt #: 33 total cpu time spent up to now is 5.2 secs Computing kpt #: 34 total cpu time spent up to now is 5.2 secs Computing kpt #: 35 total cpu time spent up to now is 5.3 secs Computing kpt #: 36 total cpu time spent up to now is 5.3 secs Computing kpt #: 37 total cpu time spent up to now is 5.4 secs Computing kpt #: 38 total cpu time spent up to now is 5.4 secs Computing kpt #: 39 total cpu time spent up to now is 5.5 secs Computing kpt #: 40 total cpu time spent up to now is 5.5 secs Computing kpt #: 41 total cpu time spent up to now is 5.6 secs Computing kpt #: 42 total cpu time spent up to now is 5.6 secs Computing kpt #: 43 total cpu time spent up to now is 5.7 secs Computing kpt #: 44 total cpu time spent up to now is 5.7 secs Computing kpt #: 45 total cpu time spent up to now is 5.8 secs Computing kpt #: 46 total cpu time spent up to now is 5.8 secs Computing kpt #: 47 total cpu time spent up to now is 5.9 secs Computing kpt #: 48 total cpu time spent up to now is 5.9 secs Computing kpt #: 49 total cpu time spent up to now is 6.0 secs Computing kpt #: 50 total cpu time spent up to now is 6.0 secs Computing kpt #: 51 total cpu time spent up to now is 6.0 secs Computing kpt #: 52 total cpu time spent up to now is 6.1 secs Computing kpt #: 53 total cpu time spent up to now is 6.1 secs Computing kpt #: 54 total cpu time spent up to now is 6.2 secs Computing kpt #: 55 total cpu time spent up to now is 6.2 secs Computing kpt #: 56 total cpu time spent up to now is 6.2 secs Computing kpt #: 57 total cpu time spent up to now is 6.3 secs Computing kpt #: 58 total cpu time spent up to now is 6.3 secs Computing kpt #: 59 total cpu time spent up to now is 6.4 secs Computing kpt #: 60 total cpu time spent up to now is 6.4 secs Computing kpt #: 61 total cpu time spent up to now is 6.5 secs Computing kpt #: 62 total cpu time spent up to now is 6.5 secs Computing kpt #: 63 total cpu time spent up to now is 6.5 secs Computing kpt #: 64 total cpu time spent up to now is 6.6 secs Computing kpt #: 65 total cpu time spent up to now is 6.6 secs Computing kpt #: 66 total cpu time spent up to now is 6.7 secs Computing kpt #: 67 total cpu time spent up to now is 6.7 secs Computing kpt #: 68 total cpu time spent up to now is 6.8 secs Computing kpt #: 69 total cpu time spent up to now is 6.8 secs Computing kpt #: 70 total cpu time spent up to now is 6.8 secs Computing kpt #: 71 total cpu time spent up to now is 6.9 secs Computing kpt #: 72 total cpu time spent up to now is 6.9 secs Computing kpt #: 73 total cpu time spent up to now is 7.0 secs Computing kpt #: 74 total cpu time spent up to now is 7.0 secs Computing kpt #: 75 total cpu time spent up to now is 7.0 secs Computing kpt #: 76 total cpu time spent up to now is 7.1 secs Computing kpt #: 77 total cpu time spent up to now is 7.1 secs Computing kpt #: 78 total cpu time spent up to now is 7.2 secs Computing kpt #: 79 total cpu time spent up to now is 7.2 secs Computing kpt #: 80 total cpu time spent up to now is 7.3 secs Computing kpt #: 81 total cpu time spent up to now is 7.3 secs Computing kpt #: 82 total cpu time spent up to now is 7.4 secs Computing kpt #: 83 total cpu time spent up to now is 7.4 secs Computing kpt #: 84 total cpu time spent up to now is 7.4 secs Computing kpt #: 85 total cpu time spent up to now is 7.5 secs Computing kpt #: 86 total cpu time spent up to now is 7.5 secs Computing kpt #: 87 total cpu time spent up to now is 7.6 secs Computing kpt #: 88 total cpu time spent up to now is 7.6 secs Computing kpt #: 89 total cpu time spent up to now is 7.7 secs Computing kpt #: 90 total cpu time spent up to now is 7.7 secs Computing kpt #: 91 total cpu time spent up to now is 7.8 secs Computing kpt #: 92 total cpu time spent up to now is 7.8 secs Computing kpt #: 93 total cpu time spent up to now is 7.9 secs Computing kpt #: 94 total cpu time spent up to now is 8.0 secs Computing kpt #: 95 total cpu time spent up to now is 8.1 secs Computing kpt #: 96 total cpu time spent up to now is 8.1 secs Computing kpt #: 97 total cpu time spent up to now is 8.2 secs Computing kpt #: 98 total cpu time spent up to now is 8.2 secs Computing kpt #: 99 total cpu time spent up to now is 8.2 secs Computing kpt #: 100 total cpu time spent up to now is 8.3 secs Computing kpt #: 101 total cpu time spent up to now is 8.3 secs Computing kpt #: 102 total cpu time spent up to now is 8.4 secs Computing kpt #: 103 total cpu time spent up to now is 8.4 secs Computing kpt #: 104 total cpu time spent up to now is 8.5 secs Computing kpt #: 105 total cpu time spent up to now is 8.5 secs Computing kpt #: 106 total cpu time spent up to now is 8.5 secs Computing kpt #: 107 total cpu time spent up to now is 8.6 secs Computing kpt #: 108 total cpu time spent up to now is 8.6 secs Computing kpt #: 109 total cpu time spent up to now is 8.7 secs Computing kpt #: 110 total cpu time spent up to now is 8.7 secs Computing kpt #: 111 total cpu time spent up to now is 8.8 secs Computing kpt #: 112 total cpu time spent up to now is 8.8 secs Computing kpt #: 113 total cpu time spent up to now is 8.9 secs Computing kpt #: 114 total cpu time spent up to now is 8.9 secs Computing kpt #: 115 total cpu time spent up to now is 9.0 secs Computing kpt #: 116 total cpu time spent up to now is 9.1 secs Computing kpt #: 117 total cpu time spent up to now is 9.1 secs Computing kpt #: 118 total cpu time spent up to now is 9.2 secs Computing kpt #: 119 total cpu time spent up to now is 9.2 secs Computing kpt #: 120 total cpu time spent up to now is 9.3 secs Computing kpt #: 121 total cpu time spent up to now is 9.3 secs Computing kpt #: 122 total cpu time spent up to now is 9.3 secs Computing kpt #: 123 total cpu time spent up to now is 9.4 secs Computing kpt #: 124 total cpu time spent up to now is 9.4 secs Computing kpt #: 125 total cpu time spent up to now is 9.5 secs Computing kpt #: 126 total cpu time spent up to now is 9.5 secs Computing kpt #: 127 total cpu time spent up to now is 9.6 secs Computing kpt #: 128 total cpu time spent up to now is 9.6 secs Computing kpt #: 129 total cpu time spent up to now is 9.7 secs Computing kpt #: 130 total cpu time spent up to now is 9.7 secs Computing kpt #: 131 total cpu time spent up to now is 9.8 secs Computing kpt #: 132 total cpu time spent up to now is 9.8 secs Computing kpt #: 133 total cpu time spent up to now is 9.9 secs Computing kpt #: 134 total cpu time spent up to now is 10.0 secs Computing kpt #: 135 total cpu time spent up to now is 10.0 secs Computing kpt #: 136 total cpu time spent up to now is 10.1 secs Computing kpt #: 137 total cpu time spent up to now is 10.1 secs Computing kpt #: 138 total cpu time spent up to now is 10.2 secs Computing kpt #: 139 total cpu time spent up to now is 10.2 secs Computing kpt #: 140 total cpu time spent up to now is 10.3 secs Computing kpt #: 141 total cpu time spent up to now is 10.4 secs Computing kpt #: 142 total cpu time spent up to now is 10.4 secs Computing kpt #: 143 total cpu time spent up to now is 10.5 secs Computing kpt #: 144 total cpu time spent up to now is 10.5 secs Computing kpt #: 145 total cpu time spent up to now is 10.6 secs Computing kpt #: 146 total cpu time spent up to now is 10.7 secs Computing kpt #: 147 total cpu time spent up to now is 10.7 secs Computing kpt #: 148 total cpu time spent up to now is 10.8 secs Computing kpt #: 149 total cpu time spent up to now is 10.8 secs Computing kpt #: 150 total cpu time spent up to now is 10.9 secs Computing kpt #: 151 total cpu time spent up to now is 11.0 secs Computing kpt #: 152 total cpu time spent up to now is 11.0 secs Computing kpt #: 153 total cpu time spent up to now is 11.1 secs Computing kpt #: 154 total cpu time spent up to now is 11.1 secs Computing kpt #: 155 total cpu time spent up to now is 11.2 secs Computing kpt #: 156 total cpu time spent up to now is 11.3 secs Computing kpt #: 157 total cpu time spent up to now is 11.4 secs Computing kpt #: 158 total cpu time spent up to now is 11.4 secs Computing kpt #: 159 total cpu time spent up to now is 11.5 secs Computing kpt #: 160 total cpu time spent up to now is 11.6 secs Computing kpt #: 161 total cpu time spent up to now is 11.6 secs Computing kpt #: 162 total cpu time spent up to now is 11.7 secs Computing kpt #: 163 total cpu time spent up to now is 11.7 secs Computing kpt #: 164 total cpu time spent up to now is 11.8 secs Computing kpt #: 165 total cpu time spent up to now is 11.9 secs Computing kpt #: 166 total cpu time spent up to now is 11.9 secs Computing kpt #: 167 total cpu time spent up to now is 12.0 secs Computing kpt #: 168 total cpu time spent up to now is 12.0 secs Computing kpt #: 169 total cpu time spent up to now is 12.1 secs Computing kpt #: 170 total cpu time spent up to now is 12.2 secs Computing kpt #: 171 total cpu time spent up to now is 12.2 secs Computing kpt #: 172 total cpu time spent up to now is 12.3 secs Computing kpt #: 173 total cpu time spent up to now is 12.3 secs Computing kpt #: 174 total cpu time spent up to now is 12.4 secs Computing kpt #: 175 total cpu time spent up to now is 12.5 secs Computing kpt #: 176 total cpu time spent up to now is 12.5 secs Computing kpt #: 177 total cpu time spent up to now is 12.6 secs Computing kpt #: 178 total cpu time spent up to now is 12.6 secs Computing kpt #: 179 total cpu time spent up to now is 12.7 secs Computing kpt #: 180 total cpu time spent up to now is 12.7 secs Computing kpt #: 181 total cpu time spent up to now is 12.8 secs Computing kpt #: 182 total cpu time spent up to now is 12.8 secs Computing kpt #: 183 total cpu time spent up to now is 12.9 secs Computing kpt #: 184 total cpu time spent up to now is 12.9 secs Computing kpt #: 185 total cpu time spent up to now is 13.0 secs Computing kpt #: 186 total cpu time spent up to now is 13.0 secs Computing kpt #: 187 total cpu time spent up to now is 13.1 secs Computing kpt #: 188 total cpu time spent up to now is 13.1 secs Computing kpt #: 189 total cpu time spent up to now is 13.2 secs Computing kpt #: 190 total cpu time spent up to now is 13.2 secs Computing kpt #: 191 total cpu time spent up to now is 13.3 secs Computing kpt #: 192 total cpu time spent up to now is 13.3 secs Computing kpt #: 193 total cpu time spent up to now is 13.4 secs Computing kpt #: 194 total cpu time spent up to now is 13.4 secs Computing kpt #: 195 total cpu time spent up to now is 13.4 secs Computing kpt #: 196 total cpu time spent up to now is 13.5 secs Computing kpt #: 197 total cpu time spent up to now is 13.5 secs Computing kpt #: 198 total cpu time spent up to now is 13.6 secs Computing kpt #: 199 total cpu time spent up to now is 13.6 secs Computing kpt #: 200 total cpu time spent up to now is 13.7 secs Computing kpt #: 201 total cpu time spent up to now is 13.7 secs Computing kpt #: 202 total cpu time spent up to now is 13.7 secs Computing kpt #: 203 total cpu time spent up to now is 13.8 secs Computing kpt #: 204 total cpu time spent up to now is 13.8 secs Computing kpt #: 205 total cpu time spent up to now is 13.9 secs Computing kpt #: 206 total cpu time spent up to now is 13.9 secs Computing kpt #: 207 total cpu time spent up to now is 14.0 secs Computing kpt #: 208 total cpu time spent up to now is 14.1 secs Computing kpt #: 209 total cpu time spent up to now is 14.1 secs Computing kpt #: 210 total cpu time spent up to now is 14.2 secs Computing kpt #: 211 total cpu time spent up to now is 14.2 secs Computing kpt #: 212 total cpu time spent up to now is 14.3 secs Computing kpt #: 213 total cpu time spent up to now is 14.3 secs Computing kpt #: 214 total cpu time spent up to now is 14.4 secs Computing kpt #: 215 total cpu time spent up to now is 14.4 secs Computing kpt #: 216 total cpu time spent up to now is 14.5 secs Computing kpt #: 217 total cpu time spent up to now is 14.5 secs Computing kpt #: 218 total cpu time spent up to now is 14.6 secs Computing kpt #: 219 total cpu time spent up to now is 14.6 secs Computing kpt #: 220 total cpu time spent up to now is 14.7 secs Computing kpt #: 221 total cpu time spent up to now is 14.7 secs Computing kpt #: 222 total cpu time spent up to now is 14.8 secs Computing kpt #: 223 total cpu time spent up to now is 14.8 secs Computing kpt #: 224 total cpu time spent up to now is 14.9 secs Computing kpt #: 225 total cpu time spent up to now is 14.9 secs Computing kpt #: 226 total cpu time spent up to now is 14.9 secs Computing kpt #: 227 total cpu time spent up to now is 15.0 secs Computing kpt #: 228 total cpu time spent up to now is 15.0 secs Computing kpt #: 229 total cpu time spent up to now is 15.1 secs Computing kpt #: 230 total cpu time spent up to now is 15.1 secs Computing kpt #: 231 total cpu time spent up to now is 15.2 secs Computing kpt #: 232 total cpu time spent up to now is 15.2 secs Computing kpt #: 233 total cpu time spent up to now is 15.2 secs Computing kpt #: 234 total cpu time spent up to now is 15.3 secs Computing kpt #: 235 total cpu time spent up to now is 15.3 secs Computing kpt #: 236 total cpu time spent up to now is 15.4 secs Computing kpt #: 237 total cpu time spent up to now is 15.4 secs Computing kpt #: 238 total cpu time spent up to now is 15.5 secs Computing kpt #: 239 total cpu time spent up to now is 15.5 secs Computing kpt #: 240 total cpu time spent up to now is 15.6 secs Computing kpt #: 241 total cpu time spent up to now is 15.6 secs Computing kpt #: 242 total cpu time spent up to now is 15.7 secs Computing kpt #: 243 total cpu time spent up to now is 15.7 secs Computing kpt #: 244 total cpu time spent up to now is 15.8 secs Computing kpt #: 245 total cpu time spent up to now is 15.8 secs Computing kpt #: 246 total cpu time spent up to now is 15.9 secs Computing kpt #: 247 total cpu time spent up to now is 15.9 secs Computing kpt #: 248 total cpu time spent up to now is 16.0 secs Computing kpt #: 249 total cpu time spent up to now is 16.0 secs Computing kpt #: 250 total cpu time spent up to now is 16.1 secs Computing kpt #: 251 total cpu time spent up to now is 16.1 secs Computing kpt #: 252 total cpu time spent up to now is 16.2 secs Computing kpt #: 253 total cpu time spent up to now is 16.2 secs Computing kpt #: 254 total cpu time spent up to now is 16.3 secs Computing kpt #: 255 total cpu time spent up to now is 16.3 secs Computing kpt #: 256 total cpu time spent up to now is 16.4 secs Computing kpt #: 257 total cpu time spent up to now is 16.5 secs Computing kpt #: 258 total cpu time spent up to now is 16.5 secs Computing kpt #: 259 total cpu time spent up to now is 16.6 secs Computing kpt #: 260 total cpu time spent up to now is 16.7 secs Computing kpt #: 261 total cpu time spent up to now is 16.8 secs Computing kpt #: 262 total cpu time spent up to now is 16.9 secs Computing kpt #: 263 total cpu time spent up to now is 17.0 secs Computing kpt #: 264 total cpu time spent up to now is 17.1 secs Computing kpt #: 265 total cpu time spent up to now is 17.2 secs Computing kpt #: 266 total cpu time spent up to now is 17.2 secs Computing kpt #: 267 total cpu time spent up to now is 17.3 secs Computing kpt #: 268 total cpu time spent up to now is 17.4 secs Computing kpt #: 269 total cpu time spent up to now is 17.4 secs Computing kpt #: 270 total cpu time spent up to now is 17.5 secs Computing kpt #: 271 total cpu time spent up to now is 17.6 secs Computing kpt #: 272 total cpu time spent up to now is 17.7 secs Computing kpt #: 273 total cpu time spent up to now is 17.8 secs Computing kpt #: 274 total cpu time spent up to now is 17.9 secs Computing kpt #: 275 total cpu time spent up to now is 18.0 secs Computing kpt #: 276 total cpu time spent up to now is 18.1 secs Computing kpt #: 277 total cpu time spent up to now is 18.2 secs Computing kpt #: 278 total cpu time spent up to now is 18.3 secs Computing kpt #: 279 total cpu time spent up to now is 18.4 secs Computing kpt #: 280 total cpu time spent up to now is 18.5 secs Computing kpt #: 281 total cpu time spent up to now is 18.6 secs Computing kpt #: 282 total cpu time spent up to now is 18.6 secs Computing kpt #: 283 total cpu time spent up to now is 18.7 secs Computing kpt #: 284 total cpu time spent up to now is 18.8 secs Computing kpt #: 285 total cpu time spent up to now is 18.9 secs Computing kpt #: 286 total cpu time spent up to now is 19.0 secs Computing kpt #: 287 total cpu time spent up to now is 19.0 secs Computing kpt #: 288 total cpu time spent up to now is 19.1 secs Computing kpt #: 289 total cpu time spent up to now is 19.2 secs Computing kpt #: 290 total cpu time spent up to now is 19.3 secs Computing kpt #: 291 total cpu time spent up to now is 19.4 secs Computing kpt #: 292 total cpu time spent up to now is 19.5 secs Computing kpt #: 293 total cpu time spent up to now is 19.6 secs Computing kpt #: 294 total cpu time spent up to now is 19.7 secs Computing kpt #: 295 total cpu time spent up to now is 19.8 secs Computing kpt #: 296 total cpu time spent up to now is 19.9 secs Computing kpt #: 297 total cpu time spent up to now is 19.9 secs Computing kpt #: 298 total cpu time spent up to now is 20.0 secs Computing kpt #: 299 total cpu time spent up to now is 20.1 secs Computing kpt #: 300 total cpu time spent up to now is 20.2 secs Computing kpt #: 301 total cpu time spent up to now is 20.2 secs Computing kpt #: 302 total cpu time spent up to now is 20.3 secs Computing kpt #: 303 total cpu time spent up to now is 20.4 secs Computing kpt #: 304 total cpu time spent up to now is 20.4 secs Computing kpt #: 305 total cpu time spent up to now is 20.5 secs Computing kpt #: 306 total cpu time spent up to now is 20.6 secs Computing kpt #: 307 total cpu time spent up to now is 20.6 secs Computing kpt #: 308 total cpu time spent up to now is 20.7 secs Computing kpt #: 309 total cpu time spent up to now is 20.7 secs Computing kpt #: 310 total cpu time spent up to now is 20.8 secs Computing kpt #: 311 total cpu time spent up to now is 20.9 secs Computing kpt #: 312 total cpu time spent up to now is 20.9 secs Computing kpt #: 313 total cpu time spent up to now is 21.0 secs Computing kpt #: 314 total cpu time spent up to now is 21.0 secs Computing kpt #: 315 total cpu time spent up to now is 21.1 secs Computing kpt #: 316 total cpu time spent up to now is 21.1 secs Computing kpt #: 317 total cpu time spent up to now is 21.2 secs Computing kpt #: 318 total cpu time spent up to now is 21.2 secs Computing kpt #: 319 total cpu time spent up to now is 21.3 secs Computing kpt #: 320 total cpu time spent up to now is 21.4 secs Computing kpt #: 321 total cpu time spent up to now is 21.4 secs Computing kpt #: 322 total cpu time spent up to now is 21.5 secs Computing kpt #: 323 total cpu time spent up to now is 21.5 secs Computing kpt #: 324 total cpu time spent up to now is 21.6 secs Computing kpt #: 325 total cpu time spent up to now is 21.6 secs Computing kpt #: 326 total cpu time spent up to now is 21.7 secs Computing kpt #: 327 total cpu time spent up to now is 21.8 secs Computing kpt #: 328 total cpu time spent up to now is 21.8 secs Computing kpt #: 329 total cpu time spent up to now is 21.9 secs Computing kpt #: 330 total cpu time spent up to now is 22.0 secs Computing kpt #: 331 total cpu time spent up to now is 22.0 secs Computing kpt #: 332 total cpu time spent up to now is 22.1 secs Computing kpt #: 333 total cpu time spent up to now is 22.2 secs Computing kpt #: 334 total cpu time spent up to now is 22.2 secs Computing kpt #: 335 total cpu time spent up to now is 22.3 secs Computing kpt #: 336 total cpu time spent up to now is 22.4 secs Computing kpt #: 337 total cpu time spent up to now is 22.5 secs Computing kpt #: 338 total cpu time spent up to now is 22.5 secs Computing kpt #: 339 total cpu time spent up to now is 22.6 secs Computing kpt #: 340 total cpu time spent up to now is 22.7 secs Computing kpt #: 341 total cpu time spent up to now is 22.8 secs Computing kpt #: 342 total cpu time spent up to now is 22.8 secs Computing kpt #: 343 total cpu time spent up to now is 22.9 secs Computing kpt #: 344 total cpu time spent up to now is 23.3 secs Computing kpt #: 345 total cpu time spent up to now is 23.4 secs Computing kpt #: 346 total cpu time spent up to now is 23.5 secs Computing kpt #: 347 total cpu time spent up to now is 23.6 secs Computing kpt #: 348 total cpu time spent up to now is 23.7 secs Computing kpt #: 349 total cpu time spent up to now is 23.8 secs Computing kpt #: 350 total cpu time spent up to now is 23.9 secs Computing kpt #: 351 total cpu time spent up to now is 24.0 secs Computing kpt #: 352 total cpu time spent up to now is 24.1 secs Computing kpt #: 353 total cpu time spent up to now is 24.2 secs Computing kpt #: 354 total cpu time spent up to now is 24.3 secs Computing kpt #: 355 total cpu time spent up to now is 24.4 secs Computing kpt #: 356 total cpu time spent up to now is 24.5 secs Computing kpt #: 357 total cpu time spent up to now is 24.6 secs Computing kpt #: 358 total cpu time spent up to now is 24.7 secs Computing kpt #: 359 total cpu time spent up to now is 24.8 secs Computing kpt #: 360 total cpu time spent up to now is 24.9 secs Computing kpt #: 361 total cpu time spent up to now is 25.0 secs Computing kpt #: 362 total cpu time spent up to now is 25.1 secs Computing kpt #: 363 total cpu time spent up to now is 25.2 secs Computing kpt #: 364 total cpu time spent up to now is 25.3 secs Computing kpt #: 365 total cpu time spent up to now is 25.3 secs Computing kpt #: 366 total cpu time spent up to now is 25.4 secs Computing kpt #: 367 total cpu time spent up to now is 25.5 secs Computing kpt #: 368 total cpu time spent up to now is 25.6 secs Computing kpt #: 369 total cpu time spent up to now is 25.6 secs Computing kpt #: 370 total cpu time spent up to now is 25.7 secs Computing kpt #: 371 total cpu time spent up to now is 25.8 secs Computing kpt #: 372 total cpu time spent up to now is 25.9 secs Computing kpt #: 373 total cpu time spent up to now is 25.9 secs Computing kpt #: 374 total cpu time spent up to now is 26.0 secs Computing kpt #: 375 total cpu time spent up to now is 26.1 secs Computing kpt #: 376 total cpu time spent up to now is 26.1 secs Computing kpt #: 377 total cpu time spent up to now is 26.2 secs Computing kpt #: 378 total cpu time spent up to now is 26.3 secs Computing kpt #: 379 total cpu time spent up to now is 26.3 secs Computing kpt #: 380 total cpu time spent up to now is 26.4 secs Computing kpt #: 381 total cpu time spent up to now is 26.4 secs Computing kpt #: 382 total cpu time spent up to now is 26.5 secs Computing kpt #: 383 total cpu time spent up to now is 26.6 secs Computing kpt #: 384 total cpu time spent up to now is 26.6 secs Computing kpt #: 385 total cpu time spent up to now is 26.7 secs Computing kpt #: 386 total cpu time spent up to now is 26.8 secs Computing kpt #: 387 total cpu time spent up to now is 26.8 secs Computing kpt #: 388 total cpu time spent up to now is 26.9 secs Computing kpt #: 389 total cpu time spent up to now is 27.0 secs Computing kpt #: 390 total cpu time spent up to now is 27.0 secs Computing kpt #: 391 total cpu time spent up to now is 27.1 secs Computing kpt #: 392 total cpu time spent up to now is 27.2 secs Computing kpt #: 393 total cpu time spent up to now is 27.2 secs Computing kpt #: 394 total cpu time spent up to now is 27.3 secs Computing kpt #: 395 total cpu time spent up to now is 27.4 secs Computing kpt #: 396 total cpu time spent up to now is 27.5 secs Computing kpt #: 397 total cpu time spent up to now is 27.5 secs Computing kpt #: 398 total cpu time spent up to now is 27.6 secs Computing kpt #: 399 total cpu time spent up to now is 27.7 secs Computing kpt #: 400 total cpu time spent up to now is 27.7 secs Computing kpt #: 401 total cpu time spent up to now is 27.8 secs Computing kpt #: 402 total cpu time spent up to now is 27.9 secs Computing kpt #: 403 total cpu time spent up to now is 27.9 secs Computing kpt #: 404 total cpu time spent up to now is 28.0 secs Computing kpt #: 405 total cpu time spent up to now is 28.1 secs Computing kpt #: 406 total cpu time spent up to now is 28.1 secs Computing kpt #: 407 total cpu time spent up to now is 28.2 secs Computing kpt #: 408 total cpu time spent up to now is 28.2 secs Computing kpt #: 409 total cpu time spent up to now is 28.3 secs Computing kpt #: 410 total cpu time spent up to now is 28.4 secs Computing kpt #: 411 total cpu time spent up to now is 28.4 secs Computing kpt #: 412 total cpu time spent up to now is 28.5 secs Computing kpt #: 413 total cpu time spent up to now is 28.6 secs Computing kpt #: 414 total cpu time spent up to now is 28.6 secs Computing kpt #: 415 total cpu time spent up to now is 28.7 secs Computing kpt #: 416 total cpu time spent up to now is 28.8 secs Computing kpt #: 417 total cpu time spent up to now is 28.9 secs Computing kpt #: 418 total cpu time spent up to now is 28.9 secs Computing kpt #: 419 total cpu time spent up to now is 29.0 secs Computing kpt #: 420 total cpu time spent up to now is 29.1 secs Computing kpt #: 421 total cpu time spent up to now is 29.1 secs Computing kpt #: 422 total cpu time spent up to now is 29.2 secs Computing kpt #: 423 total cpu time spent up to now is 29.2 secs Computing kpt #: 424 total cpu time spent up to now is 29.3 secs Computing kpt #: 425 total cpu time spent up to now is 29.4 secs Computing kpt #: 426 total cpu time spent up to now is 29.4 secs Computing kpt #: 427 total cpu time spent up to now is 29.5 secs Computing kpt #: 428 total cpu time spent up to now is 29.6 secs Computing kpt #: 429 total cpu time spent up to now is 29.6 secs Computing kpt #: 430 total cpu time spent up to now is 29.7 secs Computing kpt #: 431 total cpu time spent up to now is 29.7 secs Computing kpt #: 432 total cpu time spent up to now is 29.8 secs Computing kpt #: 433 total cpu time spent up to now is 29.9 secs Computing kpt #: 434 total cpu time spent up to now is 29.9 secs Computing kpt #: 435 total cpu time spent up to now is 30.0 secs Computing kpt #: 436 total cpu time spent up to now is 30.0 secs Computing kpt #: 437 total cpu time spent up to now is 30.1 secs Computing kpt #: 438 total cpu time spent up to now is 30.2 secs Computing kpt #: 439 total cpu time spent up to now is 30.2 secs Computing kpt #: 440 total cpu time spent up to now is 30.3 secs Computing kpt #: 441 total cpu time spent up to now is 30.3 secs Computing kpt #: 442 total cpu time spent up to now is 30.4 secs Computing kpt #: 443 total cpu time spent up to now is 30.5 secs Computing kpt #: 444 total cpu time spent up to now is 30.5 secs Computing kpt #: 445 total cpu time spent up to now is 30.6 secs Computing kpt #: 446 total cpu time spent up to now is 30.7 secs Computing kpt #: 447 total cpu time spent up to now is 30.7 secs Computing kpt #: 448 total cpu time spent up to now is 30.8 secs Computing kpt #: 449 total cpu time spent up to now is 30.9 secs Computing kpt #: 450 total cpu time spent up to now is 30.9 secs Computing kpt #: 451 total cpu time spent up to now is 31.0 secs Computing kpt #: 452 total cpu time spent up to now is 31.1 secs Computing kpt #: 453 total cpu time spent up to now is 31.1 secs Computing kpt #: 454 total cpu time spent up to now is 31.2 secs Computing kpt #: 455 total cpu time spent up to now is 31.3 secs Computing kpt #: 456 total cpu time spent up to now is 31.3 secs Computing kpt #: 457 total cpu time spent up to now is 31.4 secs Computing kpt #: 458 total cpu time spent up to now is 31.4 secs Computing kpt #: 459 total cpu time spent up to now is 31.5 secs Computing kpt #: 460 total cpu time spent up to now is 31.6 secs Computing kpt #: 461 total cpu time spent up to now is 31.6 secs Computing kpt #: 462 total cpu time spent up to now is 31.7 secs Computing kpt #: 463 total cpu time spent up to now is 31.7 secs Computing kpt #: 464 total cpu time spent up to now is 31.8 secs Computing kpt #: 465 total cpu time spent up to now is 31.8 secs Computing kpt #: 466 total cpu time spent up to now is 31.9 secs Computing kpt #: 467 total cpu time spent up to now is 32.0 secs Computing kpt #: 468 total cpu time spent up to now is 32.0 secs Computing kpt #: 469 total cpu time spent up to now is 32.1 secs Computing kpt #: 470 total cpu time spent up to now is 32.1 secs Computing kpt #: 471 total cpu time spent up to now is 32.2 secs Computing kpt #: 472 total cpu time spent up to now is 32.2 secs Computing kpt #: 473 total cpu time spent up to now is 32.3 secs Computing kpt #: 474 total cpu time spent up to now is 32.3 secs Computing kpt #: 475 total cpu time spent up to now is 32.4 secs Computing kpt #: 476 total cpu time spent up to now is 32.4 secs Computing kpt #: 477 total cpu time spent up to now is 32.5 secs Computing kpt #: 478 total cpu time spent up to now is 32.5 secs Computing kpt #: 479 total cpu time spent up to now is 32.6 secs Computing kpt #: 480 total cpu time spent up to now is 32.6 secs Computing kpt #: 481 total cpu time spent up to now is 32.6 secs Computing kpt #: 482 total cpu time spent up to now is 32.7 secs Computing kpt #: 483 total cpu time spent up to now is 32.7 secs Computing kpt #: 484 total cpu time spent up to now is 32.8 secs Computing kpt #: 485 total cpu time spent up to now is 32.8 secs Computing kpt #: 486 total cpu time spent up to now is 32.9 secs Computing kpt #: 487 total cpu time spent up to now is 32.9 secs Computing kpt #: 488 total cpu time spent up to now is 33.0 secs Computing kpt #: 489 total cpu time spent up to now is 33.0 secs Computing kpt #: 490 total cpu time spent up to now is 33.1 secs Computing kpt #: 491 total cpu time spent up to now is 33.1 secs Computing kpt #: 492 total cpu time spent up to now is 33.2 secs Computing kpt #: 493 total cpu time spent up to now is 33.2 secs Computing kpt #: 494 total cpu time spent up to now is 33.2 secs Computing kpt #: 495 total cpu time spent up to now is 33.3 secs Computing kpt #: 496 total cpu time spent up to now is 33.3 secs Computing kpt #: 497 total cpu time spent up to now is 33.4 secs Computing kpt #: 498 total cpu time spent up to now is 33.4 secs Computing kpt #: 499 total cpu time spent up to now is 33.5 secs Computing kpt #: 500 total cpu time spent up to now is 33.5 secs Computing kpt #: 501 total cpu time spent up to now is 33.6 secs Computing kpt #: 502 total cpu time spent up to now is 33.6 secs Computing kpt #: 503 total cpu time spent up to now is 33.7 secs Computing kpt #: 504 total cpu time spent up to now is 33.7 secs Computing kpt #: 505 total cpu time spent up to now is 33.8 secs Computing kpt #: 506 total cpu time spent up to now is 33.8 secs Computing kpt #: 507 total cpu time spent up to now is 33.9 secs Computing kpt #: 508 total cpu time spent up to now is 33.9 secs Computing kpt #: 509 total cpu time spent up to now is 34.0 secs Computing kpt #: 510 total cpu time spent up to now is 34.0 secs Computing kpt #: 511 total cpu time spent up to now is 34.1 secs Computing kpt #: 512 total cpu time spent up to now is 34.2 secs Computing kpt #: 513 total cpu time spent up to now is 34.2 secs Computing kpt #: 514 total cpu time spent up to now is 34.3 secs Computing kpt #: 515 total cpu time spent up to now is 34.3 secs Computing kpt #: 516 total cpu time spent up to now is 34.4 secs Computing kpt #: 517 total cpu time spent up to now is 34.5 secs Computing kpt #: 518 total cpu time spent up to now is 34.5 secs Computing kpt #: 519 total cpu time spent up to now is 34.6 secs Computing kpt #: 520 total cpu time spent up to now is 34.6 secs Computing kpt #: 521 total cpu time spent up to now is 34.7 secs Computing kpt #: 522 total cpu time spent up to now is 34.8 secs Computing kpt #: 523 total cpu time spent up to now is 34.8 secs Computing kpt #: 524 total cpu time spent up to now is 34.9 secs Computing kpt #: 525 total cpu time spent up to now is 35.0 secs Computing kpt #: 526 total cpu time spent up to now is 35.0 secs Computing kpt #: 527 total cpu time spent up to now is 35.1 secs Computing kpt #: 528 total cpu time spent up to now is 35.1 secs Computing kpt #: 529 total cpu time spent up to now is 35.1 secs Computing kpt #: 530 total cpu time spent up to now is 35.2 secs Computing kpt #: 531 total cpu time spent up to now is 35.2 secs Computing kpt #: 532 total cpu time spent up to now is 35.3 secs Computing kpt #: 533 total cpu time spent up to now is 35.3 secs Computing kpt #: 534 total cpu time spent up to now is 35.4 secs Computing kpt #: 535 total cpu time spent up to now is 35.4 secs Computing kpt #: 536 total cpu time spent up to now is 35.5 secs Computing kpt #: 537 total cpu time spent up to now is 35.5 secs Computing kpt #: 538 total cpu time spent up to now is 35.6 secs Computing kpt #: 539 total cpu time spent up to now is 35.7 secs Computing kpt #: 540 total cpu time spent up to now is 35.7 secs Computing kpt #: 541 total cpu time spent up to now is 35.8 secs Computing kpt #: 542 total cpu time spent up to now is 35.8 secs Computing kpt #: 543 total cpu time spent up to now is 35.9 secs Computing kpt #: 544 total cpu time spent up to now is 35.9 secs Computing kpt #: 545 total cpu time spent up to now is 36.0 secs Computing kpt #: 546 total cpu time spent up to now is 36.0 secs Computing kpt #: 547 total cpu time spent up to now is 36.1 secs Computing kpt #: 548 total cpu time spent up to now is 36.2 secs Computing kpt #: 549 total cpu time spent up to now is 36.2 secs Computing kpt #: 550 total cpu time spent up to now is 36.3 secs Computing kpt #: 551 total cpu time spent up to now is 36.4 secs Computing kpt #: 552 total cpu time spent up to now is 36.5 secs Computing kpt #: 553 total cpu time spent up to now is 36.6 secs Computing kpt #: 554 total cpu time spent up to now is 36.7 secs Computing kpt #: 555 total cpu time spent up to now is 36.8 secs Computing kpt #: 556 total cpu time spent up to now is 36.9 secs Computing kpt #: 557 total cpu time spent up to now is 37.0 secs Computing kpt #: 558 total cpu time spent up to now is 37.0 secs Computing kpt #: 559 total cpu time spent up to now is 37.1 secs Computing kpt #: 560 total cpu time spent up to now is 37.2 secs Computing kpt #: 561 total cpu time spent up to now is 37.3 secs Computing kpt #: 562 total cpu time spent up to now is 37.3 secs Computing kpt #: 563 total cpu time spent up to now is 37.4 secs Computing kpt #: 564 total cpu time spent up to now is 37.5 secs Computing kpt #: 565 total cpu time spent up to now is 37.6 secs Computing kpt #: 566 total cpu time spent up to now is 37.7 secs Computing kpt #: 567 total cpu time spent up to now is 37.8 secs Computing kpt #: 568 total cpu time spent up to now is 37.9 secs Computing kpt #: 569 total cpu time spent up to now is 38.0 secs Computing kpt #: 570 total cpu time spent up to now is 38.1 secs Computing kpt #: 571 total cpu time spent up to now is 38.2 secs Computing kpt #: 572 total cpu time spent up to now is 38.3 secs Computing kpt #: 573 total cpu time spent up to now is 38.4 secs Computing kpt #: 574 total cpu time spent up to now is 38.5 secs Computing kpt #: 575 total cpu time spent up to now is 38.6 secs ethr = 1.25E-07, avg # of iterations = 14.9 total cpu time spent up to now is 38.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 885 PWs) bands (ev): -3.5604 -3.5604 8.2788 8.2788 8.7653 8.7653 9.5986 9.5986 12.3449 12.3449 19.0302 19.0302 20.3999 20.3999 21.2824 21.2824 k =-0.0040 0.0037 0.0096 ( 881 PWs) bands (ev): -3.5590 -3.5590 8.2801 8.2801 8.7664 8.7664 9.5999 9.5999 12.3464 12.3464 19.0260 19.0260 20.4002 20.4002 21.2354 21.2354 k =-0.0081 0.0074 0.0193 ( 877 PWs) bands (ev): -3.5546 -3.5546 8.2839 8.2839 8.7698 8.7698 9.6037 9.6037 12.3507 12.3507 19.0133 19.0133 20.4013 20.4013 21.1125 21.1125 k =-0.0121 0.0111 0.0289 ( 877 PWs) bands (ev): -3.5474 -3.5474 8.2904 8.2904 8.7754 8.7754 9.6100 9.6100 12.3580 12.3580 18.9918 18.9918 20.4029 20.4029 20.9433 20.9433 k =-0.0161 0.0148 0.0386 ( 885 PWs) bands (ev): -3.5373 -3.5373 8.2994 8.2994 8.7832 8.7832 9.6188 9.6188 12.3682 12.3682 18.9609 18.9609 20.4048 20.4048 20.7472 20.7472 k =-0.0202 0.0185 0.0482 ( 885 PWs) bands (ev): -3.5243 -3.5243 8.3111 8.3111 8.7933 8.7933 9.6302 9.6302 12.3813 12.3813 18.9199 18.9199 20.4062 20.4062 20.5352 20.5352 k =-0.0242 0.0221 0.0579 ( 881 PWs) bands (ev): -3.5083 -3.5083 8.3253 8.3253 8.8056 8.8056 9.6441 9.6441 12.3972 12.3972 18.8681 18.8681 20.3087 20.3087 20.4108 20.4108 k =-0.0282 0.0258 0.0675 ( 879 PWs) bands (ev): -3.4895 -3.4895 8.3421 8.3421 8.8200 8.8200 9.6604 9.6604 12.4161 12.4161 18.8045 18.8045 20.0787 20.0787 20.4104 20.4104 k =-0.0322 0.0295 0.0772 ( 877 PWs) bands (ev): -3.4678 -3.4678 8.3614 8.3614 8.8367 8.8367 9.6793 9.6793 12.4379 12.4379 18.7283 18.7283 19.8424 19.8424 20.4089 20.4089 k =-0.0363 0.0332 0.0868 ( 883 PWs) bands (ev): -3.4432 -3.4432 8.3834 8.3834 8.8556 8.8556 9.7006 9.7006 12.4626 12.4626 18.6388 18.6388 19.6021 19.6021 20.4042 20.4042 k =-0.0403 0.0369 0.0965 ( 883 PWs) bands (ev): -3.4157 -3.4157 8.4079 8.4079 8.8766 8.8766 9.7243 9.7243 12.4902 12.4902 18.5357 18.5357 19.3590 19.3590 20.3940 20.3940 k =-0.0443 0.0406 0.1061 ( 887 PWs) bands (ev): -3.3854 -3.3854 8.4350 8.4350 8.8997 8.8997 9.7504 9.7504 12.5207 12.5207 18.4188 18.4188 19.1139 19.1139 20.3754 20.3754 k =-0.0484 0.0443 0.1158 ( 891 PWs) bands (ev): -3.3521 -3.3521 8.4646 8.4646 8.9249 8.9249 9.7788 9.7788 12.5541 12.5541 18.2883 18.2883 18.8678 18.8678 20.3435 20.3435 k =-0.0524 0.0480 0.1254 ( 891 PWs) bands (ev): -3.3160 -3.3160 8.4968 8.4968 8.9523 8.9523 9.8096 9.8096 12.5904 12.5904 18.1446 18.1446 18.6212 18.6212 20.2631 20.2631 k =-0.0564 0.0517 0.1351 ( 891 PWs) bands (ev): -3.2770 -3.2770 8.5315 8.5315 8.9816 8.9816 9.8427 9.8427 12.6296 12.6296 17.9884 17.9884 18.3748 18.3748 20.0426 20.0426 k =-0.0605 0.0554 0.1447 ( 891 PWs) bands (ev): -3.2351 -3.2351 8.5688 8.5688 9.0130 9.0130 9.8780 9.8780 12.6717 12.6717 17.8204 17.8204 18.1297 18.1297 19.8088 19.8088 k =-0.0645 0.0590 0.1544 ( 891 PWs) bands (ev): -3.1903 -3.1903 8.6087 8.6087 9.0463 9.0463 9.9155 9.9155 12.7167 12.7167 17.6408 17.6408 17.8869 17.8869 19.5692 19.5692 k =-0.0685 0.0627 0.1640 ( 891 PWs) bands (ev): -3.1426 -3.1426 8.6510 8.6510 9.0815 9.0815 9.9551 9.9551 12.7646 12.7646 17.4496 17.4496 17.6480 17.6480 19.3253 19.3253 k =-0.0726 0.0664 0.1737 ( 891 PWs) bands (ev): -3.0921 -3.0921 8.6959 8.6959 9.1185 9.1185 9.9967 9.9967 12.8154 12.8154 17.2462 17.2462 17.4151 17.4151 19.0783 19.0783 k =-0.0766 0.0701 0.1833 ( 891 PWs) bands (ev): -3.0387 -3.0387 8.7433 8.7433 9.1574 9.1574 10.0402 10.0402 12.8690 12.8690 17.0307 17.0307 17.1895 17.1895 18.8289 18.8289 k =-0.0806 0.0738 0.1930 ( 891 PWs) bands (ev): -2.9824 -2.9824 8.7932 8.7932 9.1979 9.1979 10.0856 10.0856 12.9256 12.9256 16.8049 16.8049 16.9705 16.9705 18.5779 18.5779 k =-0.0846 0.0775 0.2026 ( 891 PWs) bands (ev): -2.9233 -2.9233 8.8456 8.8456 9.2401 9.2401 10.1327 10.1327 12.9850 12.9850 16.5726 16.5726 16.7557 16.7557 18.3260 18.3260 k =-0.0887 0.0812 0.2123 ( 893 PWs) bands (ev): -2.8613 -2.8613 8.9004 8.9004 9.2839 9.2839 10.1813 10.1813 13.0474 13.0474 16.3370 16.3370 16.5427 16.5427 18.0736 18.0736 k =-0.0927 0.0849 0.2219 ( 893 PWs) bands (ev): -2.7964 -2.7964 8.9577 8.9577 9.3291 9.3291 10.2313 10.2313 13.1126 13.1126 16.1003 16.1003 16.3303 16.3303 17.8213 17.8213 k =-0.0967 0.0886 0.2315 ( 887 PWs) bands (ev): -2.7287 -2.7287 9.0174 9.0174 9.3756 9.3756 10.2825 10.2825 13.1806 13.1806 15.8639 15.8639 16.1182 16.1182 17.5693 17.5693 k =-0.1008 0.0923 0.2412 ( 887 PWs) bands (ev): -2.6581 -2.6581 9.0795 9.0795 9.4232 9.4232 10.3346 10.3346 13.2516 13.2516 15.6285 15.6285 15.9062 15.9062 17.3181 17.3181 k =-0.1048 0.0959 0.2508 ( 889 PWs) bands (ev): -2.5847 -2.5847 9.1440 9.1440 9.4720 9.4720 10.3874 10.3874 13.3254 13.3254 15.3948 15.3948 15.6947 15.6947 17.0679 17.0679 k =-0.1088 0.0996 0.2605 ( 891 PWs) bands (ev): -2.5084 -2.5084 9.2107 9.2107 9.5215 9.5215 10.4404 10.4404 13.4021 13.4021 15.1631 15.1631 15.4840 15.4840 16.8190 16.8190 k =-0.1129 0.1033 0.2701 ( 887 PWs) bands (ev): -2.4293 -2.4293 9.2798 9.2798 9.5718 9.5718 10.4932 10.4932 13.4817 13.4817 14.9340 14.9340 15.2746 15.2746 16.5716 16.5716 k =-0.1169 0.1070 0.2798 ( 887 PWs) bands (ev): -2.3473 -2.3473 9.3511 9.3511 9.6224 9.6224 10.5452 10.5452 13.5641 13.5641 14.7076 14.7076 15.0671 15.0671 16.3260 16.3260 k =-0.1209 0.1107 0.2894 ( 891 PWs) bands (ev): -2.2625 -2.2625 9.4246 9.4246 9.6733 9.6733 10.5958 10.5958 13.6494 13.6494 14.4842 14.4842 14.8621 14.8621 16.0823 16.0823 k =-0.1249 0.1144 0.2991 ( 891 PWs) bands (ev): -2.1749 -2.1749 9.5002 9.5002 9.7240 9.7240 10.6442 10.6442 13.7375 13.7375 14.2642 14.2642 14.6606 14.6606 15.8409 15.8409 k =-0.1290 0.1181 0.3087 ( 891 PWs) bands (ev): -2.0845 -2.0845 9.5777 9.5777 9.7742 9.7742 10.6892 10.6892 13.8285 13.8285 14.0476 14.0476 14.4636 14.4636 15.6017 15.6017 k =-0.1330 0.1218 0.3184 ( 891 PWs) bands (ev): -1.9912 -1.9912 9.6571 9.6571 9.8237 9.8237 10.7296 10.7296 13.8347 13.8347 13.9223 13.9223 14.2725 14.2725 15.3652 15.3652 k =-0.1370 0.1255 0.3280 ( 891 PWs) bands (ev): -1.8951 -1.8951 9.7382 9.7382 9.8720 9.8720 10.7638 10.7638 13.6255 13.6255 14.0190 14.0190 14.0891 14.0891 15.1314 15.1314 k =-0.1411 0.1292 0.3377 ( 891 PWs) bands (ev): -1.7962 -1.7962 9.8205 9.8205 9.9187 9.9187 10.7899 10.7899 13.4198 13.4198 13.9155 13.9155 14.1185 14.1185 14.9007 14.9007 k =-0.1451 0.1328 0.3473 ( 891 PWs) bands (ev): -1.6945 -1.6945 9.9030 9.9030 9.9642 9.9642 10.8056 10.8056 13.2172 13.2172 13.7546 13.7546 14.2208 14.2208 14.6732 14.6732 k =-0.1491 0.1365 0.3570 ( 895 PWs) bands (ev): -1.5900 -1.5900 9.9798 9.9798 10.0136 10.0136 10.8085 10.8085 13.0173 13.0173 13.6093 13.6093 14.3260 14.3260 14.4494 14.4494 k =-0.1532 0.1402 0.3666 ( 895 PWs) bands (ev): -1.4827 -1.4827 10.0306 10.0306 10.0857 10.0857 10.7961 10.7961 12.8195 12.8195 13.4831 13.4831 14.2296 14.2296 14.4340 14.4340 k =-0.1572 0.1439 0.3763 ( 897 PWs) bands (ev): -1.3726 -1.3726 10.0652 10.0652 10.1698 10.1698 10.7661 10.7661 12.6230 12.6230 13.3789 13.3789 14.0143 14.0143 14.5448 14.5448 k =-0.1612 0.1476 0.3859 ( 897 PWs) bands (ev): -1.2597 -1.2597 10.0923 10.0923 10.2556 10.2556 10.7168 10.7168 12.4274 12.4274 13.2989 13.2989 13.8040 13.8040 14.6584 14.6584 k =-0.1653 0.1513 0.3956 ( 901 PWs) bands (ev): -1.1441 -1.1441 10.1123 10.1123 10.3408 10.3408 10.6479 10.6479 12.2323 12.2323 13.2443 13.2443 13.5997 13.5997 14.7500 14.7500 k =-0.1693 0.1550 0.4052 ( 905 PWs) bands (ev): -1.0257 -1.0257 10.1244 10.1244 10.4237 10.4237 10.5602 10.5602 12.0376 12.0376 13.2146 13.2146 13.4024 13.4024 14.6210 14.6211 k =-0.1733 0.1587 0.4149 ( 905 PWs) bands (ev): -0.9045 -0.9045 10.1278 10.1278 10.4496 10.4496 10.5086 10.5086 11.8432 11.8432 13.2082 13.2082 13.2138 13.2138 14.5059 14.5059 k =-0.1773 0.1624 0.4245 ( 909 PWs) bands (ev): -0.7805 -0.7805 10.1214 10.1214 10.3308 10.3308 10.5811 10.5811 11.6493 11.6493 13.0353 13.0353 13.2235 13.2235 14.4056 14.4056 k =-0.1814 0.1661 0.4342 ( 909 PWs) bands (ev): -0.6538 -0.6538 10.1035 10.1035 10.1980 10.1980 10.6475 10.6475 11.4561 11.4561 12.8703 12.8703 13.2572 13.2572 14.3209 14.3209 k =-0.1854 0.1697 0.4438 ( 913 PWs) bands (ev): -0.5244 -0.5244 10.0427 10.0427 10.0865 10.0865 10.7022 10.7022 11.2636 11.2636 12.7224 12.7224 13.3068 13.3068 14.2524 14.2524 k =-0.1894 0.1734 0.4534 ( 913 PWs) bands (ev): -0.3922 -0.3922 9.8949 9.8949 10.0424 10.0424 10.7402 10.7402 11.0722 11.0722 12.5964 12.5964 13.3700 13.3700 14.2006 14.2006 k =-0.1935 0.1771 0.4631 ( 913 PWs) bands (ev): -0.2573 -0.2573 9.7361 9.7361 9.9915 9.9915 10.7556 10.7556 10.8822 10.8822 12.4980 12.4980 13.4448 13.4448 14.1656 14.1656 k =-0.1975 0.1808 0.4727 ( 913 PWs) bands (ev): -0.1197 -0.1197 9.5721 9.5721 9.9298 9.9298 10.6909 10.6909 10.7462 10.7462 12.4321 12.4321 13.5294 13.5294 14.1472 14.1472 k =-0.2015 0.1845 0.4824 ( 913 PWs) bands (ev): 0.0206 0.0206 9.4046 9.4046 9.8574 9.8574 10.5044 10.5044 10.7033 10.7033 12.4017 12.4017 13.6225 13.6225 14.1451 14.1451 k =-0.2056 0.1882 0.4920 ( 913 PWs) bands (ev): 0.1636 0.1636 9.2347 9.2347 9.7748 9.7748 10.3183 10.3183 10.6316 10.6316 12.4062 12.4062 13.7229 13.7229 14.1586 14.1586 k =-0.2096 0.1919 0.5017 ( 911 PWs) bands (ev): 0.3094 0.3094 9.0633 9.0633 9.6828 9.6828 10.1338 10.1338 10.5343 10.5343 12.4417 12.4417 13.8298 13.8298 14.1869 14.1869 k =-0.2136 0.1956 0.5113 ( 907 PWs) bands (ev): 0.4578 0.4578 8.8910 8.8910 9.5825 9.5825 9.9510 9.9510 10.4165 10.4165 12.5030 12.5030 13.9423 13.9423 14.2290 14.2290 k =-0.2177 0.1993 0.5210 ( 907 PWs) bands (ev): 0.6088 0.6088 8.7185 8.7185 9.4747 9.4747 9.7700 9.7700 10.2838 10.2838 12.5845 12.5845 14.0599 14.0599 14.2839 14.2839 k =-0.2217 0.2030 0.5306 ( 911 PWs) bands (ev): 0.7626 0.7626 8.5462 8.5462 9.3605 9.3605 9.5909 9.5909 10.1404 10.1404 12.6819 12.6819 14.1821 14.1821 14.3506 14.3506 k =-0.2257 0.2066 0.5403 ( 911 PWs) bands (ev): 0.9189 0.9189 8.3743 8.3743 9.2409 9.2409 9.4136 9.4136 9.9899 9.9899 12.7918 12.7918 14.3085 14.3085 14.4282 14.4282 k =-0.2297 0.2103 0.5499 ( 911 PWs) bands (ev): 1.0779 1.0779 8.2034 8.2034 9.1167 9.1167 9.2384 9.2384 9.8348 9.8348 12.9116 12.9116 14.4386 14.4386 14.5159 14.5159 k =-0.2338 0.2140 0.5596 ( 907 PWs) bands (ev): 1.2395 1.2395 8.0335 8.0335 8.9888 8.9888 9.0653 9.0653 9.6767 9.6767 13.0395 13.0395 14.5722 14.5722 14.6130 14.6130 k =-0.2378 0.2177 0.5692 ( 903 PWs) bands (ev): 1.4037 1.4037 7.8648 7.8648 8.8579 8.8579 8.8942 8.8942 9.5172 9.5172 13.1743 13.1743 14.7070 14.7070 14.7206 14.7206 k =-0.2418 0.2214 0.5789 ( 907 PWs) bands (ev): 1.5705 1.5705 7.6977 7.6977 8.7241 8.7241 8.7260 8.7260 9.3570 9.3570 13.3150 13.3150 14.8284 14.8284 14.8523 14.8523 k =-0.2459 0.2251 0.5885 ( 907 PWs) bands (ev): 1.7398 1.7398 7.5321 7.5321 8.5586 8.5586 8.5899 8.5899 9.1969 9.1969 13.4610 13.4610 14.9491 14.9491 14.9950 14.9950 k =-0.2499 0.2288 0.5982 ( 907 PWs) bands (ev): 1.9116 1.9116 7.3683 7.3683 8.3942 8.3942 8.4539 8.4539 9.0374 9.0374 13.6116 13.6116 15.0758 15.0758 15.1410 15.1410 k =-0.2539 0.2325 0.6078 ( 907 PWs) bands (ev): 2.0859 2.0859 7.2064 7.2064 8.2321 8.2321 8.3171 8.3171 8.8790 8.8790 13.7665 13.7665 15.2085 15.2085 15.2899 15.2899 k =-0.2580 0.2362 0.6175 ( 903 PWs) bands (ev): 2.2627 2.2627 7.0464 7.0464 8.0724 8.0724 8.1800 8.1800 8.7219 8.7219 13.9253 13.9253 15.3469 15.3469 15.4414 15.4414 k =-0.2620 0.2399 0.6271 ( 907 PWs) bands (ev): 2.4418 2.4418 6.8885 6.8885 7.9151 7.9151 8.0429 8.0429 8.5663 8.5663 14.0879 14.0879 15.4907 15.4907 15.5953 15.5953 k =-0.2660 0.2435 0.6368 ( 907 PWs) bands (ev): 2.6233 2.6233 6.7327 6.7327 7.7602 7.7602 7.9061 7.9061 8.4125 8.4125 14.2541 14.2541 15.6395 15.6395 15.7517 15.7517 k =-0.2700 0.2472 0.6464 ( 907 PWs) bands (ev): 2.8071 2.8071 6.5792 6.5792 7.6079 7.6079 7.7699 7.7699 8.2606 8.2606 14.4236 14.4236 15.7932 15.7932 15.9104 15.9104 k =-0.2741 0.2509 0.6561 ( 903 PWs) bands (ev): 2.9930 2.9930 6.4279 6.4279 7.4583 7.4583 7.6346 7.6346 8.1108 8.1108 14.5964 14.5964 15.9515 15.9515 16.0712 16.0712 k =-0.2781 0.2546 0.6657 ( 903 PWs) bands (ev): 3.1810 3.1810 6.2791 6.2791 7.3113 7.3113 7.5002 7.5002 7.9631 7.9631 14.7724 14.7724 16.1141 16.1141 16.2342 16.2342 k =-0.2821 0.2583 0.6753 ( 903 PWs) bands (ev): 3.3708 3.3708 6.1328 6.1328 7.1672 7.1672 7.3671 7.3671 7.8176 7.8176 14.9514 14.9514 16.2809 16.2809 16.3993 16.3993 k =-0.2862 0.2620 0.6850 ( 903 PWs) bands (ev): 3.5622 3.5622 5.9892 5.9892 7.0260 7.0260 7.2353 7.2353 7.6744 7.6744 15.1334 15.1334 16.4517 16.4517 16.5663 16.5663 k =-0.2902 0.2657 0.6946 ( 903 PWs) bands (ev): 3.7549 3.7549 5.8485 5.8485 6.8881 6.8881 7.1051 7.1051 7.5336 7.5336 15.3183 15.3183 16.6264 16.6264 16.7353 16.7353 k =-0.2942 0.2694 0.7043 ( 903 PWs) bands (ev): 3.9482 3.9482 5.7111 5.7111 6.7537 6.7537 6.9764 6.9764 7.3951 7.3951 15.5060 15.5060 16.8048 16.8048 16.9061 16.9061 k =-0.2983 0.2731 0.7139 ( 903 PWs) bands (ev): 4.1412 4.1412 5.5774 5.5774 6.6232 6.6232 6.8495 6.8495 7.2591 7.2591 15.6966 15.6966 16.9868 16.9868 17.0787 17.0787 k =-0.3023 0.2768 0.7236 ( 903 PWs) bands (ev): 4.3318 4.3318 5.4488 5.4488 6.4974 6.4974 6.7243 6.7243 7.1256 7.1256 15.8900 15.8900 17.1723 17.1723 17.2531 17.2531 k =-0.3063 0.2805 0.7332 ( 901 PWs) bands (ev): 4.5160 4.5160 5.3283 5.3283 6.3775 6.3775 6.6011 6.6011 6.9946 6.9946 16.0860 16.0860 17.3611 17.3611 17.4292 17.4292 k =-0.3104 0.2841 0.7429 ( 901 PWs) bands (ev): 4.6826 4.6826 5.2247 5.2247 6.2658 6.2658 6.4799 6.4799 6.8661 6.8661 16.2848 16.2848 17.5531 17.5531 17.6071 17.6071 k =-0.3144 0.2878 0.7525 ( 901 PWs) bands (ev): 4.7960 4.7960 5.1694 5.1694 6.1664 6.1664 6.3607 6.3607 6.7401 6.7401 16.4862 16.4862 17.7479 17.7479 17.7871 17.7871 k =-0.3184 0.2915 0.7622 ( 901 PWs) bands (ev): 4.7969 4.7969 5.2127 5.2127 6.0885 6.0885 6.2437 6.2437 6.6168 6.6168 16.6902 16.6902 17.9443 17.9443 17.9700 17.9700 k =-0.3224 0.2952 0.7718 ( 905 PWs) bands (ev): 4.7185 4.7185 5.3032 5.3032 6.0502 6.0502 6.1288 6.1288 6.4961 6.4961 16.8967 16.8967 18.1381 18.1381 18.1601 18.1601 k =-0.3224 0.2952 0.7718 ( 905 PWs) bands (ev): 4.7185 4.7185 5.3032 5.3032 6.0502 6.0502 6.1288 6.1288 6.4961 6.4961 16.8967 16.8967 18.1381 18.1381 18.1601 18.1601 k =-0.3164 0.2897 0.7765 ( 903 PWs) bands (ev): 4.7194 4.7194 5.2967 5.2967 6.0154 6.0154 6.1297 6.1297 6.5402 6.5402 16.8806 16.8806 18.1398 18.1398 18.1684 18.1684 k =-0.3104 0.2841 0.7811 ( 905 PWs) bands (ev): 4.7220 4.7220 5.2759 5.2759 5.9395 5.9395 6.1324 6.1324 6.6456 6.6456 16.8345 16.8345 18.1217 18.1217 18.2145 18.2145 k =-0.3043 0.2786 0.7858 ( 905 PWs) bands (ev): 4.7263 4.7263 5.2380 5.2380 5.8583 5.8583 6.1370 6.1370 6.7792 6.7792 16.7644 16.7644 18.0871 18.0871 18.2897 18.2897 k =-0.2983 0.2731 0.7904 ( 906 PWs) bands (ev): 4.7320 4.7320 5.1798 5.1798 5.7896 5.7896 6.1435 6.1435 6.9267 6.9267 16.6769 16.6769 18.0395 18.0395 18.3851 18.3851 k =-0.2983 0.2731 0.7904 ( 906 PWs) bands (ev): 4.7320 4.7320 5.1798 5.1798 5.7896 5.7896 6.1435 6.1435 6.9267 6.9267 16.6769 16.6769 18.0395 18.0395 18.3851 18.3851 k =-0.2902 0.2657 0.7904 ( 904 PWs) bands (ev): 4.7793 4.7793 5.1166 5.1166 5.6970 5.6970 6.2073 6.2073 7.1393 7.1393 16.4772 16.4772 17.8812 17.8812 18.4067 18.4067 k =-0.2821 0.2583 0.7904 ( 904 PWs) bands (ev): 4.8089 4.8089 5.0694 5.0694 5.6089 5.6089 6.2735 6.2735 7.3588 7.3588 16.2703 16.2703 17.7135 17.7135 18.4392 18.4392 k =-0.2741 0.2509 0.7904 ( 902 PWs) bands (ev): 4.8024 4.8024 5.0566 5.0566 5.5273 5.5273 6.3420 6.3420 7.5836 7.5836 16.0590 16.0590 17.5377 17.5377 18.4799 18.4799 k =-0.2660 0.2435 0.7904 ( 904 PWs) bands (ev): 4.7584 4.7584 5.0764 5.0764 5.4561 5.4561 6.4128 6.4128 7.8126 7.8126 15.8452 15.8452 17.3555 17.3555 18.5269 18.5269 k =-0.2580 0.2362 0.7904 ( 904 PWs) bands (ev): 4.6953 4.6953 5.1015 5.1015 5.4051 5.4051 6.4858 6.4858 8.0450 8.0450 15.6302 15.6302 17.1679 17.1679 18.5792 18.5792 k =-0.2499 0.2288 0.7904 ( 904 PWs) bands (ev): 4.6252 4.6252 5.1028 5.1028 5.3915 5.3915 6.5611 6.5611 8.2804 8.2804 15.4149 15.4149 16.9764 16.9764 18.6358 18.6358 k =-0.2418 0.2214 0.7904 ( 902 PWs) bands (ev): 4.5529 4.5529 5.0694 5.0694 5.4217 5.4217 6.6385 6.6385 8.5183 8.5183 15.2001 15.2001 16.7817 16.7817 18.6961 18.6961 k =-0.2338 0.2140 0.7904 ( 904 PWs) bands (ev): 4.4806 4.4806 5.0148 5.0148 5.4804 5.4804 6.7180 6.7180 8.7585 8.7585 14.9864 14.9864 16.5849 16.5849 18.7597 18.7597 k =-0.2257 0.2066 0.7904 ( 904 PWs) bands (ev): 4.4093 4.4093 4.9517 4.9517 5.5538 5.5538 6.7996 6.7996 9.0006 9.0006 14.7743 14.7743 16.3868 16.3868 18.8260 18.8260 k =-0.2176 0.1993 0.7904 ( 904 PWs) bands (ev): 4.3394 4.3394 4.8861 4.8861 5.6355 5.6355 6.8833 6.8833 9.2443 9.2443 14.5642 14.5642 16.1880 16.1880 18.8949 18.8949 k =-0.2096 0.1919 0.7904 ( 905 PWs) bands (ev): 4.2714 4.2714 4.8205 4.8205 5.7229 5.7229 6.9689 6.9689 9.4891 9.4891 14.3568 14.3568 15.9890 15.9890 18.9660 18.9660 k =-0.2015 0.1845 0.7904 ( 903 PWs) bands (ev): 4.2054 4.2054 4.7560 4.7560 5.8145 5.8145 7.0563 7.0563 9.7346 9.7346 14.1526 14.1526 15.7905 15.7905 19.0391 19.0391 k =-0.1935 0.1771 0.7904 ( 903 PWs) bands (ev): 4.1417 4.1417 4.6933 4.6933 5.9097 5.9097 7.1456 7.1456 9.9800 9.9800 13.9524 13.9524 15.5929 15.5929 19.1140 19.1140 k =-0.1854 0.1697 0.7904 ( 903 PWs) bands (ev): 4.0802 4.0802 4.6325 4.6325 6.0081 6.0081 7.2366 7.2366 10.2245 10.2245 13.7572 13.7572 15.3965 15.3965 19.1905 19.1905 k =-0.1773 0.1624 0.7904 ( 903 PWs) bands (ev): 4.0210 4.0210 4.5741 4.5741 6.1094 6.1094 7.3292 7.3292 10.4666 10.4666 13.5685 13.5685 15.2019 15.2019 19.2682 19.2682 k =-0.1693 0.1550 0.7904 ( 903 PWs) bands (ev): 3.9643 3.9643 4.5180 4.5180 6.2134 6.2134 7.4232 7.4232 10.7041 10.7041 13.3887 13.3887 15.0093 15.0093 19.3469 19.3469 k =-0.1612 0.1476 0.7904 ( 905 PWs) bands (ev): 3.9101 3.9101 4.4643 4.4643 6.3200 6.3200 7.5186 7.5186 10.9330 10.9330 13.2217 13.2217 14.8191 14.8191 19.4263 19.4263 k =-0.1532 0.1402 0.7904 ( 906 PWs) bands (ev): 3.8583 3.8583 4.4131 4.4131 6.4290 6.4290 7.6151 7.6151 11.1468 11.1468 13.0740 13.0740 14.6316 14.6316 19.5060 19.5060 k =-0.1451 0.1328 0.7904 ( 912 PWs) bands (ev): 3.8091 3.8091 4.3644 4.3644 6.5403 6.5403 7.7126 7.7126 11.3340 11.3340 12.9572 12.9572 14.4472 14.4472 19.5855 19.5855 k =-0.1370 0.1255 0.7904 ( 912 PWs) bands (ev): 3.7625 3.7625 4.3183 4.3183 6.6538 6.6538 7.8108 7.8108 11.4759 11.4759 12.8902 12.8902 14.2662 14.2662 19.6641 19.6641 k =-0.1290 0.1181 0.7904 ( 906 PWs) bands (ev): 3.7184 3.7184 4.2748 4.2748 6.7694 6.7694 7.9095 7.9095 11.5504 11.5504 12.8950 12.8950 14.0891 14.0891 19.7408 19.7408 k =-0.1209 0.1107 0.7904 ( 906 PWs) bands (ev): 3.6770 3.6770 4.2339 4.2339 6.8868 6.8868 8.0084 8.0084 11.5477 11.5477 12.9816 12.9816 13.9161 13.9161 19.8141 19.8141 k =-0.1129 0.1033 0.7904 ( 906 PWs) bands (ev): 3.6382 3.6382 4.1955 4.1955 7.0061 7.0061 8.1070 8.1070 11.4810 11.4810 13.1368 13.1368 13.7479 13.7479 19.8814 19.8814 k =-0.1048 0.0959 0.7904 ( 904 PWs) bands (ev): 3.6020 3.6020 4.1598 4.1598 7.1269 7.1269 8.2051 8.2051 11.3732 11.3732 13.3379 13.3379 13.5848 13.5848 19.9373 19.9373 k =-0.0967 0.0886 0.7904 ( 904 PWs) bands (ev): 3.5684 3.5684 4.1267 4.1267 7.2490 7.2490 8.3020 8.3020 11.2420 11.2420 13.4274 13.4274 13.5671 13.5671 19.9704 19.9704 k =-0.0887 0.0812 0.7904 ( 906 PWs) bands (ev): 3.5375 3.5375 4.0963 4.0963 7.3720 7.3720 8.3971 8.3971 11.0986 11.0986 13.2764 13.2764 13.8136 13.8136 19.9550 19.9550 k =-0.0806 0.0738 0.7904 ( 906 PWs) bands (ev): 3.5093 3.5093 4.0685 4.0685 7.4957 7.4957 8.4899 8.4899 10.9493 10.9493 13.1326 13.1326 14.0712 14.0712 19.8519 19.8519 k =-0.0725 0.0664 0.7904 ( 904 PWs) bands (ev): 3.4838 3.4838 4.0433 4.0433 7.6194 7.6194 8.5794 8.5794 10.7981 10.7981 12.9967 12.9967 14.3362 14.3362 19.6566 19.6566 k =-0.0645 0.0590 0.7904 ( 904 PWs) bands (ev): 3.4609 3.4609 4.0208 4.0208 7.7423 7.7423 8.6647 8.6647 10.6480 10.6480 12.8699 12.8699 14.6061 14.6061 19.4079 19.4079 k =-0.0564 0.0517 0.7904 ( 904 PWs) bands (ev): 3.4407 3.4407 4.0009 4.0009 7.8635 7.8635 8.7447 8.7447 10.5011 10.5011 12.7531 12.7531 14.8790 14.8790 19.1361 19.1361 k =-0.0484 0.0443 0.7904 ( 908 PWs) bands (ev): 3.4231 3.4231 3.9836 3.9836 7.9815 7.9815 8.8183 8.8183 10.3598 10.3598 12.6477 12.6477 15.1534 15.1534 18.8554 18.8554 k =-0.0403 0.0369 0.7904 ( 909 PWs) bands (ev): 3.4083 3.4083 3.9691 3.9691 8.0942 8.0942 8.8839 8.8839 10.2268 10.2268 12.5551 12.5551 15.4271 15.4271 18.5730 18.5730 k =-0.0322 0.0295 0.7904 ( 909 PWs) bands (ev): 3.3962 3.3962 3.9571 3.9571 8.1985 8.1985 8.9404 8.9404 10.1055 10.1055 12.4766 12.4766 15.6973 15.6973 18.2943 18.2943 k =-0.0242 0.0221 0.7904 ( 909 PWs) bands (ev): 3.3867 3.3867 3.9478 3.9478 8.2901 8.2901 8.9861 8.9861 10.0004 10.0004 12.4136 12.4136 15.9584 15.9584 18.0258 18.0258 k =-0.0161 0.0148 0.7904 ( 909 PWs) bands (ev): 3.3800 3.3800 3.9412 3.9412 8.3633 8.3633 9.0199 9.0199 9.9174 9.9174 12.3676 12.3676 16.1987 16.1987 17.7800 17.7800 k =-0.0081 0.0074 0.7904 ( 909 PWs) bands (ev): 3.3759 3.3759 3.9372 3.9372 8.4113 8.4113 9.0407 9.0407 9.8635 9.8635 12.3395 12.3395 16.3891 16.3891 17.5862 17.5862 k = 0.0000 0.0000 0.7904 ( 910 PWs) bands (ev): 3.3746 3.3746 3.9359 3.9359 8.4281 8.4281 9.0477 9.0477 9.8447 9.8447 12.3300 12.3300 16.4682 16.4682 17.5059 17.5059 k = 0.0000 0.0000 0.7904 ( 910 PWs) bands (ev): 3.3746 3.3746 3.9359 3.9359 8.4281 8.4281 9.0477 9.0477 9.8447 9.8447 12.3300 12.3300 16.4682 16.4682 17.5059 17.5059 k = 0.0074 0.0080 0.7904 ( 910 PWs) bands (ev): 3.3759 3.3759 3.9372 3.9372 8.4209 8.4209 9.0143 9.0143 9.8800 9.8800 12.3399 12.3399 16.4695 16.4695 17.5056 17.5056 k = 0.0147 0.0161 0.7904 ( 906 PWs) bands (ev): 3.3800 3.3800 3.9410 3.9410 8.3994 8.3994 8.9274 8.9274 9.9725 9.9725 12.3692 12.3692 16.4732 16.4732 17.5050 17.5050 k = 0.0221 0.0241 0.7904 ( 908 PWs) bands (ev): 3.3868 3.3868 3.9473 3.9473 8.3644 8.3644 8.8099 8.8099 10.0994 10.0994 12.4175 12.4175 16.4793 16.4793 17.5038 17.5038 k = 0.0294 0.0321 0.7904 ( 908 PWs) bands (ev): 3.3963 3.3963 3.9562 3.9562 8.3167 8.3167 8.6768 8.6768 10.2455 10.2455 12.4836 12.4836 16.4879 16.4879 17.5020 17.5020 k = 0.0368 0.0402 0.7904 ( 910 PWs) bands (ev): 3.4085 3.4085 3.9677 3.9677 8.2576 8.2576 8.5361 8.5361 10.4030 10.4030 12.5664 12.5664 16.4990 16.4990 17.4996 17.4996 k = 0.0441 0.0482 0.7904 ( 908 PWs) bands (ev): 3.4234 3.4234 3.9816 3.9816 8.1884 8.1884 8.3918 8.3918 10.5678 10.5678 12.6645 12.6645 16.5125 16.5125 17.4963 17.4963 k = 0.0515 0.0562 0.7904 ( 910 PWs) bands (ev): 3.4410 3.4410 3.9981 3.9981 8.1104 8.1104 8.2461 8.2461 10.7378 10.7378 12.7767 12.7767 16.5285 16.5285 17.4920 17.4920 k = 0.0588 0.0643 0.7904 ( 910 PWs) bands (ev): 3.4614 3.4614 4.0172 4.0172 8.0246 8.0246 8.1006 8.1006 10.9116 10.9116 12.9014 12.9014 16.5470 16.5470 17.4864 17.4864 k = 0.0662 0.0723 0.7904 ( 908 PWs) bands (ev): 3.4844 3.4844 4.0387 4.0387 7.9301 7.9301 7.9582 7.9582 11.0884 11.0884 13.0375 13.0375 16.5679 16.5679 17.4794 17.4794 k = 0.0735 0.0803 0.7904 ( 908 PWs) bands (ev): 3.5102 3.5102 4.0628 4.0628 7.8054 7.8054 7.8420 7.8420 11.2678 11.2678 13.1839 13.1839 16.5913 16.5913 17.4706 17.4706 k = 0.0809 0.0883 0.7904 ( 910 PWs) bands (ev): 3.5386 3.5386 4.0894 4.0894 7.6639 7.6639 7.7400 7.7400 11.4493 11.4493 13.3395 13.3395 16.6171 16.6171 17.4597 17.4597 k = 0.0882 0.0964 0.7904 ( 912 PWs) bands (ev): 3.5697 3.5697 4.1185 4.1185 7.5226 7.5226 7.6362 7.6362 11.6326 11.6326 13.5035 13.5035 16.6455 16.6455 17.4462 17.4462 k = 0.0956 0.1044 0.7904 ( 912 PWs) bands (ev): 3.6035 3.6035 4.1501 4.1501 7.3828 7.3828 7.5303 7.5303 11.8175 11.8175 13.6752 13.6752 16.6763 16.6763 17.4299 17.4299 k = 0.1029 0.1124 0.7904 ( 914 PWs) bands (ev): 3.6400 3.6400 4.1841 4.1841 7.2448 7.2448 7.4227 7.4227 12.0038 12.0038 13.8537 13.8537 16.7096 16.7096 17.4101 17.4101 k = 0.1103 0.1205 0.7904 ( 914 PWs) bands (ev): 3.6792 3.6792 4.2207 4.2207 7.1087 7.1087 7.3141 7.3141 12.1912 12.1912 14.0386 14.0386 16.7453 16.7453 17.3865 17.3865 k = 0.1176 0.1285 0.7904 ( 914 PWs) bands (ev): 3.7210 3.7210 4.2597 4.2597 6.9747 6.9747 7.2049 7.2049 12.3796 12.3796 14.2294 14.2294 16.7836 16.7836 17.3585 17.3585 k = 0.1250 0.1365 0.7904 ( 910 PWs) bands (ev): 3.7655 3.7655 4.3012 4.3012 6.8428 6.8428 7.0955 7.0955 12.5688 12.5688 14.4256 14.4256 16.8243 16.8243 17.3255 17.3255 k = 0.1324 0.1446 0.7904 ( 910 PWs) bands (ev): 3.8127 3.8127 4.3451 4.3451 6.7131 6.7131 6.9862 6.9862 12.7586 12.7586 14.6270 14.6270 16.8676 16.8676 17.2870 17.2870 k = 0.1397 0.1526 0.7904 ( 910 PWs) bands (ev): 3.8624 3.8624 4.3914 4.3914 6.5857 6.5857 6.8773 6.8773 12.9488 12.9488 14.8330 14.8330 16.9133 16.9133 17.2425 17.2425 k = 0.1471 0.1606 0.7904 ( 910 PWs) bands (ev): 3.9149 3.9149 4.4400 4.4400 6.4607 6.4607 6.7691 6.7691 13.1393 13.1393 15.0436 15.0436 16.9614 16.9614 17.1915 17.1915 k = 0.1544 0.1687 0.7904 ( 910 PWs) bands (ev): 3.9699 3.9699 4.4910 4.4910 6.3381 6.3381 6.6618 6.6618 13.3297 13.3297 15.2583 15.2583 17.0118 17.0118 17.1337 17.1337 k = 0.1618 0.1767 0.7904 ( 914 PWs) bands (ev): 4.0275 4.0275 4.5443 4.5443 6.2180 6.2180 6.5557 6.5557 13.5199 13.5199 15.4771 15.4771 17.0569 17.0569 17.0762 17.0762 k = 0.1691 0.1847 0.7904 ( 912 PWs) bands (ev): 4.0877 4.0877 4.5997 4.5997 6.1005 6.1005 6.4509 6.4509 13.7096 13.7096 15.6996 15.6996 16.9932 16.9932 17.1223 17.1223 k = 0.1765 0.1928 0.7904 ( 914 PWs) bands (ev): 4.1505 4.1505 4.6572 4.6572 5.9858 5.9858 6.3476 6.3476 13.8985 13.8985 15.9257 15.9257 16.9121 16.9121 17.1801 17.1801 k = 0.1838 0.2008 0.7904 ( 914 PWs) bands (ev): 4.2157 4.2157 4.7166 4.7166 5.8739 5.8739 6.2460 6.2460 14.0863 14.0863 16.1553 16.1553 16.8226 16.8226 17.2407 17.2407 k = 0.1912 0.2088 0.7904 ( 912 PWs) bands (ev): 4.2835 4.2835 4.7776 4.7776 5.7653 5.7653 6.1461 6.1461 14.2728 14.2728 16.3881 16.3881 16.7248 16.7248 17.3037 17.3037 k = 0.1985 0.2168 0.7904 ( 908 PWs) bands (ev): 4.3537 4.3537 4.8396 4.8396 5.6605 5.6605 6.0481 6.0481 14.4576 14.4576 16.6156 16.6156 16.6271 16.6271 17.3692 17.3692 k = 0.2059 0.2249 0.7904 ( 908 PWs) bands (ev): 4.4263 4.4263 4.9016 4.9016 5.5605 5.5605 5.9522 5.9522 14.6403 14.6403 16.5045 16.5045 16.8627 16.8627 17.4371 17.4371 k = 0.2132 0.2329 0.7904 ( 906 PWs) bands (ev): 4.5011 4.5011 4.9614 4.9614 5.4676 5.4676 5.8586 5.8586 14.8205 14.8205 16.3827 16.3827 17.1039 17.1039 17.5073 17.5073 k = 0.2206 0.2409 0.7904 ( 906 PWs) bands (ev): 4.5779 4.5779 5.0130 5.0130 5.3877 5.3877 5.7674 5.7674 14.9977 14.9977 16.2532 16.2532 17.3470 17.3470 17.5797 17.5797 k = 0.2279 0.2490 0.7904 ( 904 PWs) bands (ev): 4.6567 4.6567 5.0417 5.0417 5.3355 5.3355 5.6790 5.6790 15.1716 15.1716 16.1166 16.1166 17.5902 17.5902 17.6544 17.6544 k = 0.2353 0.2570 0.7904 ( 906 PWs) bands (ev): 4.7368 4.7368 5.0262 5.0262 5.3323 5.3323 5.5939 5.5939 15.3416 15.3416 15.9732 15.9732 17.7294 17.7294 17.8270 17.8270 k = 0.2426 0.2650 0.7904 ( 906 PWs) bands (ev): 4.8173 4.8173 4.9707 4.9707 5.3738 5.3738 5.5130 5.5130 15.5072 15.5072 15.8236 15.8236 17.8065 17.8065 17.9429 17.9429 k = 0.2500 0.2731 0.7904 ( 908 PWs) bands (ev): 4.8945 4.8945 4.8994 4.8994 5.4360 5.4360 5.4402 5.4402 15.6599 15.6599 15.6763 15.6763 17.8748 17.8748 17.8919 17.8919 k = 0.2500 0.2731 0.7904 ( 908 PWs) bands (ev): 4.8945 4.8945 4.8994 4.8994 5.4360 5.4360 5.4402 5.4402 15.6599 15.6599 15.6763 15.6763 17.8748 17.8748 17.8919 17.8919 k = 0.2429 0.2796 0.7849 ( 906 PWs) bands (ev): 4.8368 4.8368 4.9350 4.9350 5.4038 5.4038 5.4998 5.4998 15.5895 15.5895 15.7320 15.7320 17.8115 17.8115 17.9168 17.9168 k = 0.2357 0.2861 0.7794 ( 906 PWs) bands (ev): 4.7653 4.7653 4.9394 4.9394 5.4085 5.4085 5.5779 5.5779 15.4991 15.4991 15.7781 15.7781 17.7184 17.7184 17.9055 17.9055 k = 0.2286 0.2927 0.7739 ( 910 PWs) bands (ev): 4.6891 4.6891 4.9100 4.9100 5.4523 5.4523 5.6660 5.6660 15.3973 15.3973 15.8047 15.8047 17.6166 17.6166 17.8612 17.8612 k = 0.2214 0.2992 0.7685 ( 910 PWs) bands (ev): 4.6113 4.6113 4.8586 4.8586 5.5233 5.5233 5.7610 5.7610 15.2854 15.2854 15.8092 15.8092 17.5149 17.5149 17.7963 17.7963 k = 0.2143 0.3058 0.7630 ( 910 PWs) bands (ev): 4.5335 4.5335 4.7962 4.7962 5.6105 5.6105 5.8611 5.8611 15.1647 15.1647 15.7889 15.7889 17.4191 17.4191 17.7187 17.7187 k = 0.2071 0.3123 0.7575 ( 910 PWs) bands (ev): 4.4568 4.4568 4.7291 4.7291 5.7079 5.7079 5.9654 5.9654 15.0357 15.0357 15.7424 15.7424 17.3323 17.3323 17.6335 17.6335 k = 0.2000 0.3188 0.7520 ( 910 PWs) bands (ev): 4.3816 4.3816 4.6603 4.6603 5.8120 5.8120 6.0733 6.0733 14.8993 14.8993 15.6695 15.6695 17.2561 17.2561 17.5438 17.5438 k = 0.1929 0.3254 0.7465 ( 910 PWs) bands (ev): 4.3084 4.3084 4.5917 4.5917 5.9213 5.9213 6.1845 6.1845 14.7561 14.7561 15.5717 15.5717 17.1902 17.1902 17.4520 17.4520 k = 0.1857 0.3319 0.7410 ( 908 PWs) bands (ev): 4.2373 4.2373 4.5240 4.5240 6.0348 6.0348 6.2987 6.2987 14.6067 14.6067 15.4518 15.4518 17.1333 17.1333 17.3599 17.3599 k = 0.1786 0.3385 0.7355 ( 910 PWs) bands (ev): 4.1684 4.1684 4.4579 4.4579 6.1521 6.1521 6.4157 6.4157 14.4516 14.4516 15.3133 15.3133 17.0833 17.0833 17.2686 17.2686 k = 0.1714 0.3450 0.7301 ( 910 PWs) bands (ev): 4.1020 4.1020 4.3937 4.3937 6.2726 6.2726 6.5355 6.5355 14.2913 14.2913 15.1597 15.1597 17.0382 17.0382 17.1791 17.1791 k = 0.1643 0.3515 0.7246 ( 910 PWs) bands (ev): 4.0380 4.0380 4.3316 4.3316 6.3963 6.3963 6.6578 6.6578 14.1263 14.1263 14.9942 14.9942 16.9966 16.9966 17.0923 17.0923 k = 0.1571 0.3581 0.7191 ( 910 PWs) bands (ev): 3.9766 3.9766 4.2718 4.2718 6.5228 6.5228 6.7826 6.7826 13.9571 13.9571 14.8197 14.8197 16.9571 16.9571 17.0087 17.0087 k = 0.1500 0.3646 0.7136 ( 908 PWs) bands (ev): 3.9177 3.9177 4.2143 4.2143 6.6522 6.6522 6.9098 6.9098 13.7842 13.7842 14.6383 14.6383 16.9185 16.9185 16.9292 16.9292 k = 0.1429 0.3712 0.7081 ( 910 PWs) bands (ev): 3.8614 3.8614 4.1593 4.1593 6.7843 6.7843 7.0393 7.0393 13.6081 13.6081 14.4518 14.4518 16.8514 16.8514 16.8832 16.8832 k = 0.1357 0.3777 0.7026 ( 910 PWs) bands (ev): 3.8078 3.8078 4.1068 4.1068 6.9191 6.9191 7.1710 7.1710 13.4292 13.4292 14.2617 14.2617 16.7789 16.7789 16.8474 16.8474 k = 0.1286 0.3842 0.6972 ( 910 PWs) bands (ev): 3.7568 3.7568 4.0569 4.0569 7.0565 7.0565 7.3047 7.3047 13.2479 13.2479 14.0693 14.0693 16.7104 16.7104 16.8127 16.8127 k = 0.1214 0.3908 0.6917 ( 914 PWs) bands (ev): 3.7086 3.7086 4.0096 4.0096 7.1963 7.1963 7.4404 7.4404 13.0646 13.0646 13.8753 13.8753 16.6458 16.6458 16.7791 16.7791 k = 0.1143 0.3973 0.6862 ( 914 PWs) bands (ev): 3.6630 3.6630 3.9648 3.9648 7.3387 7.3387 7.5778 7.5778 12.8798 12.8798 13.6808 13.6808 16.5852 16.5852 16.7466 16.7466 k = 0.1071 0.4039 0.6807 ( 914 PWs) bands (ev): 3.6201 3.6201 3.9228 3.9228 7.4835 7.4835 7.7169 7.7169 12.6937 12.6937 13.4864 13.4864 16.5287 16.5287 16.7155 16.7155 k = 0.1000 0.4104 0.6752 ( 912 PWs) bands (ev): 3.5800 3.5800 3.8833 3.8833 7.6307 7.6307 7.8574 7.8574 12.5068 12.5068 13.2928 13.2928 16.4761 16.4761 16.6857 16.6857 k = 0.0929 0.4169 0.6697 ( 908 PWs) bands (ev): 3.5425 3.5425 3.8466 3.8466 7.7803 7.7803 7.9990 7.9990 12.3192 12.3192 13.1006 13.1006 16.4275 16.4275 16.6576 16.6576 k = 0.0857 0.4235 0.6642 ( 902 PWs) bands (ev): 3.5079 3.5079 3.8125 3.8125 7.9322 7.9322 8.1414 8.1414 12.1312 12.1312 12.9104 12.9104 16.3827 16.3827 16.6311 16.6311 k = 0.0786 0.4300 0.6588 ( 904 PWs) bands (ev): 3.4760 3.4760 3.7812 3.7812 8.0863 8.0863 8.2843 8.2843 11.9432 11.9432 12.7230 12.7230 16.3417 16.3417 16.6063 16.6063 k = 0.0714 0.4366 0.6533 ( 902 PWs) bands (ev): 3.4468 3.4468 3.7525 3.7525 8.2427 8.2427 8.4269 8.4269 11.7553 11.7553 12.5390 12.5390 16.3045 16.3045 16.5835 16.5835 k = 0.0643 0.4431 0.6478 ( 902 PWs) bands (ev): 3.4204 3.4204 3.7266 3.7266 8.4013 8.4013 8.5688 8.5688 11.5677 11.5677 12.3594 12.3594 16.2710 16.2710 16.5626 16.5626 k = 0.0571 0.4496 0.6423 ( 902 PWs) bands (ev): 3.3968 3.3968 3.7033 3.7033 8.5620 8.5620 8.7087 8.7087 11.3807 11.3807 12.1853 12.1853 16.2411 16.2411 16.5437 16.5437 k = 0.0500 0.4562 0.6368 ( 898 PWs) bands (ev): 3.3759 3.3759 3.6828 3.6828 8.7248 8.7248 8.8456 8.8456 11.1944 11.1944 12.0181 12.0181 16.2149 16.2149 16.5269 16.5269 k = 0.0429 0.4627 0.6313 ( 896 PWs) bands (ev): 3.3578 3.3578 3.6650 3.6650 8.8896 8.8896 8.9776 8.9776 11.0089 11.0089 11.8597 11.8597 16.1922 16.1922 16.5122 16.5122 k = 0.0357 0.4693 0.6258 ( 896 PWs) bands (ev): 3.3425 3.3425 3.6500 3.6500 9.0560 9.0560 9.1025 9.1025 10.8244 10.8244 11.7128 11.7128 16.1731 16.1731 16.4998 16.4998 k = 0.0286 0.4758 0.6204 ( 896 PWs) bands (ev): 3.3300 3.3300 3.6376 3.6376 9.2116 9.2116 9.2294 9.2294 10.6412 10.6412 11.5807 11.5807 16.1575 16.1575 16.4895 16.4895 k = 0.0214 0.4823 0.6149 ( 896 PWs) bands (ev): 3.3202 3.3202 3.6281 3.6281 9.3125 9.3125 9.3972 9.3972 10.4592 10.4592 11.4681 11.4681 16.1454 16.1454 16.4815 16.4815 k = 0.0143 0.4889 0.6094 ( 894 PWs) bands (ev): 3.3133 3.3133 3.6212 3.6212 9.3898 9.3898 9.5693 9.5693 10.2787 10.2787 11.3807 11.3807 16.1368 16.1368 16.4758 16.4758 k = 0.0071 0.4954 0.6039 ( 894 PWs) bands (ev): 3.3091 3.3091 3.6171 3.6171 9.4395 9.4395 9.7427 9.7427 10.1003 10.1003 11.3248 11.3248 16.1316 16.1316 16.4724 16.4724 k = 0.0000 0.5019 0.5984 ( 894 PWs) bands (ev): 3.3077 3.3077 3.6157 3.6157 9.4568 9.4568 9.8948 9.8948 9.9466 9.9466 11.3055 11.3055 16.1298 16.1298 16.4712 16.4712 k = 0.0000 0.5019 0.5984 ( 894 PWs) bands (ev): 3.3077 3.3077 3.6157 3.6157 9.4568 9.4568 9.8948 9.8948 9.9466 9.9466 11.3055 11.3055 16.1298 16.1298 16.4712 16.4712 k = 0.0085 0.5074 0.5939 ( 894 PWs) bands (ev): 3.3090 3.3090 3.6171 3.6171 9.4248 9.4248 9.8793 9.8793 9.9769 9.9769 11.3232 11.3232 15.9831 15.9831 16.6236 16.6236 k = 0.0170 0.5128 0.5893 ( 892 PWs) bands (ev): 3.3130 3.3130 3.6211 3.6211 9.3453 9.3453 9.8350 9.8350 10.0509 10.0509 11.3741 11.3741 15.7447 15.7447 16.8791 16.8791 k = 0.0255 0.5183 0.5847 ( 894 PWs) bands (ev): 3.3197 3.3197 3.6278 3.6278 9.2421 9.2421 9.7674 9.7674 10.1443 10.1443 11.4528 11.4528 15.4995 15.4995 17.1532 17.1532 k = 0.0339 0.5237 0.5802 ( 898 PWs) bands (ev): 3.3290 3.3290 3.6372 3.6372 9.1279 9.1279 9.6823 9.6823 10.2434 10.2434 11.5535 11.5535 15.2597 15.2597 17.4347 17.4347 k = 0.0424 0.5292 0.5756 ( 898 PWs) bands (ev): 3.3410 3.3410 3.6493 3.6493 9.0086 9.0086 9.5850 9.5850 10.3410 10.3410 11.6706 11.6706 15.0293 15.0293 17.7206 17.7206 k = 0.0509 0.5346 0.5710 ( 896 PWs) bands (ev): 3.3556 3.3556 3.6640 3.6640 8.8869 8.8869 9.4797 9.4797 10.4325 10.4325 11.8002 11.8002 14.8117 14.8117 18.0093 18.0093 k = 0.0594 0.5400 0.5665 ( 897 PWs) bands (ev): 3.3729 3.3729 3.6815 3.6815 8.7642 8.7642 9.3693 9.3693 10.5140 10.5140 11.9393 11.9393 14.6099 14.6099 18.2996 18.2996 k = 0.0679 0.5455 0.5619 ( 899 PWs) bands (ev): 3.3928 3.3928 3.7016 3.7016 8.6414 8.6414 9.2556 9.2556 10.5813 10.5813 12.0858 12.0858 14.4275 14.4275 18.5901 18.5901 k = 0.0764 0.5509 0.5573 ( 901 PWs) bands (ev): 3.4154 3.4154 3.7243 3.7243 8.5192 8.5192 9.1403 9.1403 10.6304 10.6304 12.2383 12.2383 14.2683 14.2683 18.8789 18.8789 k = 0.0849 0.5564 0.5528 ( 903 PWs) bands (ev): 3.4405 3.4405 3.7498 3.7498 8.3980 8.3980 9.0242 9.0242 10.6572 10.6572 12.3957 12.3957 14.1365 14.1365 19.1625 19.1625 k = 0.0933 0.5618 0.5482 ( 905 PWs) bands (ev): 3.4683 3.4683 3.7779 3.7779 8.2780 8.2780 8.9082 8.9082 10.6578 10.6578 12.5571 12.5571 14.0357 14.0357 19.4337 19.4337 k = 0.1018 0.5672 0.5437 ( 905 PWs) bands (ev): 3.4987 3.4987 3.8086 3.8086 8.1595 8.1595 8.7927 8.7927 10.6293 10.6293 12.7220 12.7220 13.9688 13.9688 19.6742 19.6742 k = 0.1103 0.5727 0.5391 ( 905 PWs) bands (ev): 3.5317 3.5317 3.8420 3.8420 8.0427 8.0427 8.6781 8.6781 10.5706 10.5706 12.8899 12.8899 13.9369 13.9369 19.8422 19.8422 k = 0.1188 0.5781 0.5345 ( 903 PWs) bands (ev): 3.5672 3.5672 3.8780 3.8780 7.9277 7.9277 8.5649 8.5649 10.4823 10.4823 13.0602 13.0602 13.9394 13.9394 19.8966 19.8966 k = 0.1273 0.5836 0.5300 ( 903 PWs) bands (ev): 3.6052 3.6052 3.9166 3.9166 7.8147 7.8147 8.4532 8.4532 10.3668 10.3668 13.2328 13.2328 13.9739 13.9739 19.8668 19.8668 k = 0.1358 0.5890 0.5254 ( 903 PWs) bands (ev): 3.6458 3.6458 3.9578 3.9578 7.7038 7.7038 8.3431 8.3431 10.2276 10.2276 13.4071 13.4071 14.0369 14.0369 19.8001 19.8001 k = 0.1443 0.5944 0.5208 ( 905 PWs) bands (ev): 3.6888 3.6888 4.0015 4.0015 7.5950 7.5950 8.2349 8.2349 10.0687 10.0687 13.5830 13.5830 14.1245 14.1245 19.7188 19.7188 k = 0.1527 0.5999 0.5163 ( 902 PWs) bands (ev): 3.7343 3.7343 4.0479 4.0479 7.4884 7.4884 8.1287 8.1287 9.8938 9.8938 13.7601 13.7601 14.2329 14.2329 19.6315 19.6315 k = 0.1612 0.6053 0.5117 ( 900 PWs) bands (ev): 3.7822 3.7822 4.0968 4.0968 7.3842 7.3842 8.0245 8.0245 9.7063 9.7063 13.9381 13.9381 14.3588 14.3588 19.5421 19.5421 k = 0.1697 0.6108 0.5071 ( 904 PWs) bands (ev): 3.8324 3.8324 4.1482 4.1482 7.2824 7.2824 7.9225 7.9225 9.5093 9.5093 14.1167 14.1167 14.4992 14.4992 19.4523 19.4523 k = 0.1782 0.6162 0.5026 ( 904 PWs) bands (ev): 3.8849 3.8849 4.2020 4.2020 7.1831 7.1831 7.8226 7.8226 9.3051 9.3051 14.2956 14.2956 14.6518 14.6518 19.3631 19.3631 k = 0.1867 0.6216 0.4980 ( 904 PWs) bands (ev): 3.9396 3.9396 4.2583 4.2583 7.0863 7.0863 7.7250 7.7250 9.0957 9.0957 14.4744 14.4744 14.8147 14.8147 19.2750 19.2750 k = 0.1952 0.6271 0.4935 ( 904 PWs) bands (ev): 3.9964 3.9964 4.3170 4.3170 6.9921 6.9921 7.6298 7.6298 8.8826 8.8826 14.6528 14.6528 14.9864 14.9864 19.1884 19.1885 k = 0.2037 0.6325 0.4889 ( 902 PWs) bands (ev): 4.0552 4.0552 4.3780 4.3780 6.9007 6.9007 7.5369 7.5369 8.6673 8.6673 14.8302 14.8302 15.1657 15.1657 19.1037 19.1037 k = 0.2121 0.6380 0.4843 ( 906 PWs) bands (ev): 4.1159 4.1159 4.4412 4.4412 6.8120 6.8120 7.4463 7.4463 8.4507 8.4507 15.0063 15.0063 15.3516 15.3516 19.0208 19.0208 k = 0.2206 0.6434 0.4798 ( 904 PWs) bands (ev): 4.1782 4.1782 4.5065 4.5065 6.7263 6.7263 7.3582 7.3582 8.2340 8.2340 15.1806 15.1806 15.5434 15.5434 18.9400 18.9400 k = 0.2291 0.6488 0.4752 ( 904 PWs) bands (ev): 4.2419 4.2419 4.5738 4.5738 6.6436 6.6436 7.2725 7.2725 8.0180 8.0180 15.3524 15.3524 15.7404 15.7404 18.8613 18.8613 k = 0.2376 0.6543 0.4706 ( 904 PWs) bands (ev): 4.3067 4.3067 4.6430 4.6430 6.5641 6.5641 7.1893 7.1893 7.8035 7.8035 15.5212 15.5212 15.9421 15.9421 18.7848 18.7848 k = 0.2461 0.6597 0.4661 ( 900 PWs) bands (ev): 4.3721 4.3721 4.7137 4.7137 6.4879 6.4879 7.1086 7.1086 7.5915 7.5915 15.6864 15.6864 16.1481 16.1481 18.7106 18.7106 k = 0.2546 0.6652 0.4615 ( 901 PWs) bands (ev): 4.4376 4.4376 4.7857 4.7857 6.4153 6.4153 7.0303 7.0303 7.3829 7.3829 15.8473 15.8473 16.3580 16.3580 18.6387 18.6387 k = 0.2630 0.6706 0.4569 ( 901 PWs) bands (ev): 4.5023 4.5023 4.8586 4.8586 6.3466 6.3466 6.9546 6.9546 7.1791 7.1791 16.0031 16.0031 16.5715 16.5715 18.5691 18.5691 k = 0.2715 0.6760 0.4524 ( 901 PWs) bands (ev): 4.5650 4.5650 4.9317 4.9317 6.2823 6.2823 6.8814 6.8814 6.9816 6.9816 16.1532 16.1532 16.7884 16.7884 18.5019 18.5019 k = 0.2800 0.6815 0.4478 ( 902 PWs) bands (ev): 4.6238 4.6238 5.0042 5.0042 6.2230 6.2230 6.7925 6.7925 6.8108 6.8108 16.2968 16.2968 17.0084 17.0084 18.4370 18.4370 k = 0.2885 0.6869 0.4433 ( 902 PWs) bands (ev): 4.6762 4.6762 5.0750 5.0750 6.1696 6.1696 6.6152 6.6152 6.7427 6.7427 16.4332 16.4332 17.2314 17.2314 18.3746 18.3746 k = 0.2970 0.6924 0.4387 ( 905 PWs) bands (ev): 4.7181 4.7181 5.1424 5.1424 6.1234 6.1234 6.4538 6.4538 6.6772 6.6772 16.5619 16.5619 17.4571 17.4571 18.3146 18.3146 k = 0.3055 0.6978 0.4341 ( 905 PWs) bands (ev): 4.7439 4.7439 5.2045 5.2045 6.0865 6.0865 6.3142 6.3142 6.6142 6.6142 16.6822 16.6822 17.6853 17.6853 18.2570 18.2570 k = 0.3140 0.7032 0.4296 ( 903 PWs) bands (ev): 4.7465 4.7465 5.2588 5.2588 6.0614 6.0614 6.2033 6.2033 6.5538 6.5538 16.7939 16.7939 17.9158 17.9158 18.2021 18.2021 k = 0.3224 0.7087 0.4250 ( 905 PWs) bands (ev): 4.7185 4.7185 5.3032 5.3032 6.0502 6.0502 6.1288 6.1288 6.4961 6.4961 16.8967 16.8967 18.1381 18.1381 18.1601 18.1601 k = 0.3224 0.7087 0.4250 ( 905 PWs) bands (ev): 4.7185 4.7185 5.3032 5.3032 6.0502 6.0502 6.1288 6.1288 6.4961 6.4961 16.8967 16.8967 18.1381 18.1381 18.1601 18.1601 k = 0.3265 0.7050 0.4153 ( 909 PWs) bands (ev): 4.6161 4.6161 5.3588 5.3588 6.0158 6.0158 6.0786 6.0786 6.3779 6.3779 17.1060 17.1060 18.3259 18.3259 18.3610 18.3610 k = 0.3305 0.7013 0.4057 ( 905 PWs) bands (ev): 4.5074 4.5074 5.3520 5.3520 5.9053 5.9053 6.1822 6.1822 6.2631 6.2631 17.3179 17.3179 18.5121 18.5121 18.5678 18.5678 k = 0.3346 0.6976 0.3960 ( 905 PWs) bands (ev): 4.3974 4.3974 5.2993 5.2993 5.7970 5.7970 6.1483 6.1483 6.3435 6.3435 17.5321 17.5321 18.6986 18.6986 18.7784 18.7784 k = 0.3386 0.6939 0.3864 ( 901 PWs) bands (ev): 4.2882 4.2882 5.2230 5.2230 5.6911 5.6911 6.0382 6.0382 6.5332 6.5332 17.7488 17.7488 18.8859 18.8859 18.9922 18.9922 k = 0.3426 0.6902 0.3767 ( 903 PWs) bands (ev): 4.1805 4.1805 5.1358 5.1358 5.5875 5.5875 5.9305 5.9305 6.7402 6.7402 17.9678 17.9678 19.0742 19.0742 19.2090 19.2090 k = 0.3467 0.6865 0.3670 ( 903 PWs) bands (ev): 4.0747 4.0747 5.0439 5.0439 5.4864 5.4864 5.8255 5.8255 6.9577 6.9577 18.1892 18.1892 19.2633 19.2633 19.4285 19.4285 k = 0.3507 0.6828 0.3574 ( 903 PWs) bands (ev): 3.9711 3.9711 4.9503 4.9503 5.3877 5.3877 5.7231 5.7231 7.1823 7.1823 18.4128 18.4128 19.4534 19.4534 19.6508 19.6508 k = 0.3547 0.6791 0.3477 ( 901 PWs) bands (ev): 3.8699 3.8699 4.8566 4.8566 5.2914 5.2914 5.6234 5.6234 7.4125 7.4125 18.6386 18.6386 19.6442 19.6442 19.8757 19.8757 k = 0.3588 0.6754 0.3381 ( 905 PWs) bands (ev): 3.7711 3.7711 4.7638 4.7638 5.1976 5.1976 5.5264 5.5264 7.6470 7.6470 18.8667 18.8667 19.8358 19.8358 20.1032 20.1032 k = 0.3628 0.6717 0.3284 ( 905 PWs) bands (ev): 3.6749 3.6749 4.6724 4.6724 5.1062 5.1062 5.4321 5.4321 7.8854 7.8854 19.0968 19.0968 20.0280 20.0280 20.3332 20.3332 k = 0.3668 0.6680 0.3188 ( 905 PWs) bands (ev): 3.5812 3.5812 4.5827 4.5827 5.0174 5.0174 5.3405 5.3405 8.1272 8.1272 19.3289 19.3289 20.2208 20.2208 20.5656 20.5656 k = 0.3709 0.6644 0.3091 ( 909 PWs) bands (ev): 3.4902 3.4902 4.4951 4.4951 4.9311 4.9311 5.2515 5.2515 8.3720 8.3720 19.5630 19.5630 20.4140 20.4140 20.8003 20.8003 k = 0.3749 0.6607 0.2994 ( 905 PWs) bands (ev): 3.4017 3.4017 4.4097 4.4097 4.8474 4.8474 5.1653 5.1653 8.6198 8.6198 19.7991 19.7991 20.6076 20.6076 21.0372 21.0372 k = 0.3789 0.6570 0.2898 ( 909 PWs) bands (ev): 3.3160 3.3160 4.3265 4.3265 4.7662 4.7662 5.0818 5.0818 8.8703 8.8703 20.0369 20.0369 20.8014 20.8014 21.2762 21.2762 k = 0.3830 0.6533 0.2801 ( 905 PWs) bands (ev): 3.2329 3.2329 4.2458 4.2458 4.6876 4.6876 5.0010 5.0010 9.1235 9.1235 20.2763 20.2763 20.9952 20.9952 21.5172 21.5172 k = 0.3870 0.6496 0.2705 ( 907 PWs) bands (ev): 3.1526 3.1526 4.1675 4.1675 4.6116 4.6116 4.9229 4.9229 9.3792 9.3792 20.5174 20.5174 21.1889 21.1889 21.7600 21.7600 k = 0.3910 0.6459 0.2608 ( 907 PWs) bands (ev): 3.0750 3.0750 4.0917 4.0917 4.5381 4.5381 4.8476 4.8476 9.6375 9.6375 20.7599 20.7599 21.3823 21.3823 22.0045 22.0045 k = 0.3951 0.6422 0.2511 ( 911 PWs) bands (ev): 3.0001 3.0001 4.0185 4.0185 4.4673 4.4673 4.7750 4.7750 9.8981 9.8981 21.0038 21.0038 21.5751 21.5751 22.2504 22.2504 k = 0.3991 0.6385 0.2415 ( 907 PWs) bands (ev): 2.9279 2.9279 3.9479 3.9479 4.3991 4.3991 4.7051 4.7051 10.1611 10.1611 21.2488 21.2488 21.7669 21.7669 22.4974 22.4974 k = 0.4032 0.6348 0.2318 ( 907 PWs) bands (ev): 2.8585 2.8585 3.8800 3.8800 4.3335 4.3335 4.6379 4.6379 10.4264 10.4264 21.4948 21.4948 21.9573 21.9573 22.7453 22.7453 k = 0.4072 0.6311 0.2222 ( 907 PWs) bands (ev): 2.7919 2.7919 3.8147 3.8147 4.2705 4.2705 4.5734 4.5734 10.6940 10.6940 21.7416 21.7416 22.1453 22.1453 22.9937 22.9937 k = 0.4112 0.6274 0.2125 ( 907 PWs) bands (ev): 2.7281 2.7281 3.7520 3.7520 4.2102 4.2102 4.5117 4.5117 10.9637 10.9637 21.9889 21.9889 22.3292 22.3292 23.2419 23.2419 k = 0.4153 0.6237 0.2028 ( 907 PWs) bands (ev): 2.6670 2.6670 3.6921 3.6921 4.1525 4.1525 4.4528 4.4528 11.2357 11.2357 22.2363 22.2363 22.5058 22.5058 23.4893 23.4893 k = 0.4193 0.6200 0.1932 ( 911 PWs) bands (ev): 2.6088 2.6088 3.6349 3.6349 4.0974 4.0974 4.3965 4.3965 11.5097 11.5097 22.4835 22.4835 22.6664 22.6664 23.7346 23.7346 k = 0.4233 0.6163 0.1835 ( 903 PWs) bands (ev): 2.5533 2.5533 3.5804 3.5804 4.0451 4.0451 4.3430 4.3430 11.7859 11.7859 22.7264 22.7264 22.7876 22.7876 23.5529 23.5529 k = 0.4274 0.6126 0.1739 ( 903 PWs) bands (ev): 2.5007 2.5007 3.5286 3.5286 3.9953 3.9953 4.2923 4.2923 12.0641 12.0641 22.7784 22.7784 22.9810 22.9810 23.4438 23.4438 k = 0.4314 0.6089 0.1642 ( 907 PWs) bands (ev): 2.4508 2.4508 3.4796 3.4796 3.9483 3.9483 4.2442 4.2442 12.3443 12.3443 22.6137 22.6137 23.2250 23.2250 23.4957 23.4957 k = 0.4354 0.6052 0.1545 ( 907 PWs) bands (ev): 2.4038 2.4038 3.4333 3.4333 3.9039 3.9039 4.1989 4.1989 12.6264 12.6264 22.3619 22.3619 23.4679 23.4679 23.6306 23.6306 k = 0.4395 0.6015 0.1449 ( 907 PWs) bands (ev): 2.3596 2.3596 3.3898 3.3898 3.8621 3.8621 4.1564 4.1564 12.9104 12.9104 22.0790 22.0790 23.7075 23.7075 23.7944 23.7944 k = 0.4435 0.5979 0.1352 ( 911 PWs) bands (ev): 2.3183 2.3183 3.3491 3.3491 3.8231 3.8231 4.1166 4.1166 13.1962 13.1962 21.7831 21.7831 23.9367 23.9367 23.9755 23.9755 k = 0.4475 0.5942 0.1256 ( 911 PWs) bands (ev): 2.2797 2.2797 3.3112 3.3112 3.7867 3.7867 4.0795 4.0795 13.4838 13.4838 21.4807 21.4807 24.1308 24.1308 24.1916 24.1916 k = 0.4516 0.5905 0.1159 ( 911 PWs) bands (ev): 2.2440 2.2440 3.2760 3.2760 3.7530 3.7530 4.0452 4.0452 13.7731 13.7731 21.1746 21.1746 24.3102 24.3102 24.4187 24.4187 k = 0.4556 0.5868 0.1063 ( 911 PWs) bands (ev): 2.2112 2.2112 3.2436 3.2436 3.7220 3.7220 4.0136 4.0136 14.0639 14.0639 20.8663 20.8663 24.4874 24.4874 24.6419 24.6419 k = 0.4596 0.5831 0.0966 ( 916 PWs) bands (ev): 2.1812 2.1812 3.2141 3.2141 3.6937 3.6937 3.9848 3.9848 14.3561 14.3561 20.5566 20.5566 24.6629 24.6629 24.8584 24.8584 k = 0.4637 0.5794 0.0869 ( 916 PWs) bands (ev): 2.1540 2.1540 3.1873 3.1873 3.6681 3.6681 3.9587 3.9587 14.6497 14.6497 20.2464 20.2464 24.8365 24.8365 25.0663 25.0663 k = 0.4677 0.5757 0.0773 ( 916 PWs) bands (ev): 2.1297 2.1297 3.1634 3.1634 3.6452 3.6452 3.9354 3.9354 14.9443 14.9443 19.9362 19.9362 25.0081 25.0081 25.2637 25.2637 k = 0.4718 0.5720 0.0676 ( 916 PWs) bands (ev): 2.1083 2.1083 3.1422 3.1422 3.6249 3.6249 3.9148 3.9148 15.2396 15.2396 19.6267 19.6267 25.1772 25.1772 25.4479 25.4480 k = 0.4758 0.5683 0.0580 ( 916 PWs) bands (ev): 2.0897 2.0897 3.1239 3.1239 3.6074 3.6074 3.8969 3.8969 15.5352 15.5352 19.3184 19.3184 25.3434 25.3434 25.4850 25.4850 k = 0.4798 0.5646 0.0483 ( 914 PWs) bands (ev): 2.0739 2.0739 3.1084 3.1084 3.5925 3.5925 3.8818 3.8818 15.8303 15.8303 19.0123 19.0123 25.4860 25.4860 25.5105 25.5105 k = 0.4839 0.5609 0.0386 ( 910 PWs) bands (ev): 2.0611 2.0611 3.0957 3.0957 3.5804 3.5804 3.8694 3.8694 16.1233 16.1233 18.7102 18.7102 25.4912 25.4912 25.6677 25.6677 k = 0.4879 0.5572 0.0290 ( 912 PWs) bands (ev): 2.0511 2.0511 3.0858 3.0858 3.5710 3.5710 3.8598 3.8598 16.4111 16.4111 18.4152 18.4152 25.4926 25.4926 25.8232 25.8232 k = 0.4919 0.5535 0.0193 ( 912 PWs) bands (ev): 2.0439 2.0439 3.0787 3.0787 3.5642 3.5642 3.8530 3.8530 16.6855 16.6855 18.1357 18.1357 25.4932 25.4932 25.9716 25.9716 k = 0.4960 0.5498 0.0097 ( 912 PWs) bands (ev): 2.0396 2.0396 3.0745 3.0745 3.5602 3.5602 3.8488 3.8488 16.9206 16.9206 17.8974 17.8974 25.4934 25.4934 26.0961 26.0961 k = 0.5000 0.5461-0.0000 ( 912 PWs) bands (ev): 2.0382 2.0382 3.0731 3.0731 3.5588 3.5588 3.8475 3.8475 17.0307 17.0307 17.7862 17.7862 25.4934 25.4934 26.1352 26.1352 k = 0.5000 0.5461-0.0000 ( 912 PWs) bands (ev): 2.0382 2.0382 3.0731 3.0731 3.5588 3.5588 3.8475 3.8475 17.0307 17.0307 17.7862 17.7862 25.4934 25.4934 26.1352 26.1352 k = 0.4925 0.5380-0.0000 ( 912 PWs) bands (ev): 2.0172 2.0172 3.0745 3.0745 3.5823 3.5823 3.8488 3.8488 17.0319 17.0319 17.7860 17.7860 25.4622 25.4622 26.1271 26.1271 k = 0.4851 0.5298-0.0000 ( 912 PWs) bands (ev): 1.9579 1.9579 3.0787 3.0787 3.6492 3.6492 3.8527 3.8527 17.0355 17.0355 17.7853 17.7853 25.3760 25.3760 26.0979 26.0979 k = 0.4776 0.5217-0.0000 ( 910 PWs) bands (ev): 1.8683 1.8683 3.0858 3.0858 3.7515 3.7515 3.8593 3.8593 17.0415 17.0415 17.7840 17.7840 25.2498 25.2498 26.0465 26.0465 k = 0.4701 0.5135-0.0000 ( 914 PWs) bands (ev): 1.7575 1.7575 3.0956 3.0956 3.8685 3.8685 3.8801 3.8801 17.0499 17.0499 17.7821 17.7821 25.0964 25.0964 25.9774 25.9774 k = 0.4627 0.5054-0.0000 ( 914 PWs) bands (ev): 1.6324 1.6324 3.1083 3.1083 3.8803 3.8803 4.0279 4.0279 17.0606 17.0606 17.7794 17.7794 24.9247 24.9247 25.8953 25.8953 k = 0.4552 0.4972-0.0000 ( 916 PWs) bands (ev): 1.4983 1.4983 3.1238 3.1238 3.8947 3.8947 4.1899 4.1899 17.0738 17.0738 17.7758 17.7758 24.7405 24.7405 25.8035 25.8035 k = 0.4478 0.4891-0.0000 ( 912 PWs) bands (ev): 1.3585 1.3585 3.1421 3.1421 3.9118 3.9118 4.3626 4.3626 17.0893 17.0893 17.7711 17.7711 24.5477 24.5477 25.7049 25.7049 k = 0.4403 0.4809-0.0000 ( 912 PWs) bands (ev): 1.2155 1.2155 3.1633 3.1633 3.9314 3.9314 4.5436 4.5436 17.1072 17.1072 17.7650 17.7650 24.3495 24.3495 25.6016 25.6016 k = 0.4328 0.4728-0.0000 ( 916 PWs) bands (ev): 1.0707 1.0707 3.1872 3.1872 3.9537 3.9537 4.7314 4.7314 17.1275 17.1275 17.7572 17.7572 24.1482 24.1482 25.4950 25.4951 k = 0.4254 0.4646-0.0000 ( 916 PWs) bands (ev): 0.9253 0.9253 3.2139 3.2139 3.9786 3.9786 4.9248 4.9248 17.1502 17.1502 17.7474 17.7474 23.9456 23.9456 25.1732 25.1732 k = 0.4179 0.4565-0.0000 ( 918 PWs) bands (ev): 0.7800 0.7800 3.2435 3.2435 4.0061 4.0061 5.1231 5.1231 17.1753 17.1753 17.7351 17.7351 23.7433 23.7433 24.8845 24.8845 k = 0.4104 0.4483-0.0000 ( 918 PWs) bands (ev): 0.6355 0.6355 3.2758 3.2758 4.0362 4.0362 5.3258 5.3258 17.2027 17.2027 17.7199 17.7199 23.5428 23.5428 24.5918 24.5918 k = 0.4030 0.4402-0.0000 ( 918 PWs) bands (ev): 0.4920 0.4920 3.3109 3.3109 4.0689 4.0689 5.5324 5.5324 17.2325 17.2325 17.7013 17.7013 23.3452 23.3452 24.2964 24.2964 k = 0.3955 0.4320-0.0000 ( 914 PWs) bands (ev): 0.3500 0.3500 3.3489 3.3489 4.1042 4.1042 5.7426 5.7426 17.2647 17.2647 17.6787 17.6787 23.1518 23.1518 23.9990 23.9990 k = 0.3881 0.4239-0.0000 ( 912 PWs) bands (ev): 0.2096 0.2096 3.3896 3.3896 4.1421 4.1421 5.9561 5.9561 17.2992 17.2992 17.6514 17.6514 22.9638 22.9638 23.7006 23.7006 k = 0.3806 0.4157-0.0000 ( 912 PWs) bands (ev): 0.0711 0.0711 3.4331 3.4331 4.1825 4.1825 6.1728 6.1728 17.3361 17.3361 17.6189 17.6189 22.7822 22.7822 23.4016 23.4016 k = 0.3731 0.4076-0.0000 ( 912 PWs) bands (ev): -0.0654 -0.0654 3.4794 3.4794 4.2256 4.2256 6.3925 6.3925 17.3752 17.3752 17.5803 17.5803 22.6080 22.6080 23.1026 23.1026 k = 0.3657 0.3994-0.0000 ( 914 PWs) bands (ev): -0.1999 -0.1999 3.5285 3.5285 4.2712 4.2712 6.6151 6.6151 17.4165 17.4165 17.5352 17.5352 22.4424 22.4424 22.8041 22.8041 k = 0.3582 0.3913-0.0000 ( 914 PWs) bands (ev): -0.3321 -0.3321 3.5803 3.5803 4.3193 4.3193 6.8404 6.8404 17.4574 17.4574 17.4852 17.4852 22.2862 22.2862 22.5063 22.5063 k = 0.3507 0.3831-0.0000 ( 914 PWs) bands (ev): -0.4621 -0.4621 3.6349 3.6349 4.3701 4.3701 7.0684 7.0684 17.4190 17.4190 17.5086 17.5086 22.1402 22.1402 22.2098 22.2098 k = 0.3433 0.3750-0.0000 ( 916 PWs) bands (ev): -0.5897 -0.5897 3.6923 3.6923 4.4233 4.4233 7.2989 7.2989 17.3494 17.3494 17.5566 17.5566 21.9134 21.9134 22.0066 22.0066 k = 0.3358 0.3668-0.0000 ( 916 PWs) bands (ev): -0.7150 -0.7150 3.7524 3.7524 4.4791 4.4791 7.5320 7.5320 17.2700 17.2700 17.6073 17.6073 21.6196 21.6196 21.8838 21.8838 k = 0.3284 0.3587-0.0000 ( 916 PWs) bands (ev): -0.8378 -0.8378 3.8153 3.8153 4.5374 4.5374 7.7676 7.7676 17.1806 17.1806 17.6605 17.6605 21.3274 21.3274 21.7736 21.7736 k = 0.3209 0.3505-0.0000 ( 916 PWs) bands (ev): -0.9581 -0.9581 3.8809 3.8809 4.5982 4.5982 8.0056 8.0056 17.0810 17.0810 17.7160 17.7160 21.0369 21.0369 21.6762 21.6762 k = 0.3134 0.3423-0.0000 ( 914 PWs) bands (ev): -1.0758 -1.0758 3.9492 3.9492 4.6615 4.6615 8.2459 8.2459 16.9713 16.9713 17.7738 17.7738 20.7484 20.7484 21.5917 21.5917 k = 0.3060 0.3342-0.0000 ( 914 PWs) bands (ev): -1.1911 -1.1911 4.0202 4.0202 4.7272 4.7272 8.4885 8.4885 16.8515 16.8515 17.8338 17.8338 20.4621 20.4621 21.5199 21.5199 k = 0.2985 0.3260-0.0000 ( 910 PWs) bands (ev): -1.3037 -1.3037 4.0940 4.0940 4.7954 4.7954 8.7333 8.7333 16.7220 16.7220 17.8962 17.8962 20.1779 20.1779 21.4608 21.4608 k = 0.2910 0.3179-0.0000 ( 910 PWs) bands (ev): -1.4138 -1.4138 4.1705 4.1705 4.8661 4.8661 8.9803 8.9803 16.5832 16.5832 17.9608 17.9608 19.8961 19.8961 21.4137 21.4137 k = 0.2836 0.3097-0.0000 ( 910 PWs) bands (ev): -1.5212 -1.5212 4.2497 4.2497 4.9392 4.9392 9.2295 9.2295 16.4356 16.4356 18.0276 18.0276 19.6168 19.6168 21.3781 21.3781 k = 0.2761 0.3016-0.0000 ( 906 PWs) bands (ev): -1.6260 -1.6260 4.3315 4.3315 5.0146 5.0146 9.4808 9.4808 16.2800 16.2800 18.0966 18.0966 19.3400 19.3400 21.3533 21.3533 k = 0.2687 0.2934-0.0000 ( 905 PWs) bands (ev): -1.7282 -1.7282 4.4161 4.4161 5.0924 5.0924 9.7342 9.7342 16.1171 16.1171 18.1678 18.1678 19.0658 19.0658 21.3386 21.3386 k = 0.2612 0.2853-0.0000 ( 905 PWs) bands (ev): -1.8276 -1.8276 4.5033 4.5033 5.1726 5.1726 9.9896 9.9896 15.9475 15.9475 18.2412 18.2412 18.7943 18.7943 21.3330 21.3330 k = 0.2537 0.2771-0.0000 ( 905 PWs) bands (ev): -1.9244 -1.9244 4.5932 4.5932 5.2550 5.2550 10.2469 10.2469 15.7722 15.7722 18.3165 18.3165 18.5258 18.5258 21.3358 21.3358 k = 0.2463 0.2690-0.0000 ( 905 PWs) bands (ev): -2.0185 -2.0185 4.6857 4.6857 5.3397 5.3397 10.5062 10.5062 15.5916 15.5916 18.2591 18.2591 18.3950 18.3950 21.3461 21.3461 k = 0.2388 0.2608-0.0000 ( 905 PWs) bands (ev): -2.1099 -2.1099 4.7808 4.7808 5.4267 5.4267 10.7673 10.7673 15.4067 15.4067 17.9965 17.9965 18.4744 18.4744 21.3631 21.3631 k = 0.2313 0.2527-0.0000 ( 897 PWs) bands (ev): -2.1985 -2.1985 4.8786 4.8786 5.5158 5.5158 11.0302 11.0302 15.2179 15.2179 17.7366 17.7366 18.5562 18.5562 21.3860 21.3860 k = 0.2239 0.2445-0.0000 ( 899 PWs) bands (ev): -2.2844 -2.2844 4.9790 4.9790 5.6070 5.6070 11.2949 11.2949 15.0259 15.0259 17.4797 17.4797 18.6400 18.6400 21.4138 21.4138 k = 0.2164 0.2364-0.0000 ( 895 PWs) bands (ev): -2.3676 -2.3676 5.0819 5.0819 5.7003 5.7003 11.5614 11.5614 14.8312 14.8312 17.2261 17.2261 18.7257 18.7257 21.4460 21.4460 k = 0.2090 0.2282-0.0000 ( 899 PWs) bands (ev): -2.4480 -2.4480 5.1875 5.1875 5.7956 5.7956 11.8294 11.8294 14.6343 14.6343 16.9756 16.9756 18.8135 18.8135 21.4815 21.4815 k = 0.2015 0.2201-0.0000 ( 899 PWs) bands (ev): -2.5257 -2.5257 5.2956 5.2956 5.8929 5.8929 12.0991 12.0991 14.4356 14.4356 16.7286 16.7286 18.9031 18.9031 21.5198 21.5198 k = 0.1940 0.2119-0.0000 ( 893 PWs) bands (ev): -2.6006 -2.6006 5.4063 5.4063 5.9920 5.9920 12.3702 12.3702 14.2356 14.2356 16.4850 16.4850 18.9945 18.9945 21.5599 21.5599 k = 0.1866 0.2038-0.0000 ( 885 PWs) bands (ev): -2.6727 -2.6727 5.5194 5.5194 6.0929 6.0929 12.6429 12.6429 14.0346 14.0346 16.2449 16.2449 19.0876 19.0876 21.6013 21.6013 k = 0.1791 0.1956-0.0000 ( 881 PWs) bands (ev): -2.7420 -2.7420 5.6351 5.6351 6.1955 6.1955 12.9168 12.9168 13.8329 13.8329 16.0086 16.0086 19.1825 19.1825 21.6430 21.6430 k = 0.1716 0.1875-0.0000 ( 881 PWs) bands (ev): -2.8086 -2.8086 5.7533 5.7533 6.2996 6.2996 13.1921 13.1921 13.6308 13.6308 15.7760 15.7760 19.2789 19.2789 21.6844 21.6844 k = 0.1642 0.1793-0.0000 ( 885 PWs) bands (ev): -2.8724 -2.8724 5.8739 5.8739 6.4051 6.4051 13.4286 13.4286 13.4686 13.4686 15.5475 15.5475 19.3767 19.3767 21.7248 21.7248 k = 0.1567 0.1712-0.0000 ( 885 PWs) bands (ev): -2.9333 -2.9333 5.9970 5.9970 6.5119 6.5119 13.2265 13.2265 13.7461 13.7461 15.3230 15.3230 19.4759 19.4759 21.7636 21.7636 k = 0.1493 0.1630-0.0000 ( 885 PWs) bands (ev): -2.9915 -2.9915 6.1225 6.1225 6.6197 6.6197 13.0248 13.0248 14.0246 14.0246 15.1029 15.1029 19.5763 19.5763 21.8001 21.8001 k = 0.1418 0.1549-0.0000 ( 887 PWs) bands (ev): -3.0468 -3.0468 6.2504 6.2504 6.7285 6.7285 12.8236 12.8236 14.3040 14.3040 14.8873 14.8873 19.6777 19.6777 21.8339 21.8339 k = 0.1343 0.1467-0.0000 ( 887 PWs) bands (ev): -3.0994 -3.0994 6.3806 6.3806 6.8379 6.8379 12.6231 12.6231 14.5842 14.5842 14.6765 14.6765 19.7800 19.7800 21.8647 21.8647 k = 0.1269 0.1386-0.0000 ( 889 PWs) bands (ev): -3.1491 -3.1491 6.5131 6.5131 6.9477 6.9477 12.4235 12.4235 14.4708 14.4708 14.8650 14.8650 19.8829 19.8829 21.8920 21.8920 k = 0.1194 0.1304-0.0000 ( 889 PWs) bands (ev): -3.1960 -3.1960 6.6478 6.6478 7.0575 7.0575 12.2250 12.2250 14.2704 14.2704 15.1462 15.1462 19.9861 19.9861 21.9159 21.9159 k = 0.1119 0.1223-0.0000 ( 889 PWs) bands (ev): -3.2401 -3.2401 6.7848 6.7848 7.1671 7.1671 12.0277 12.0277 14.0758 14.0758 15.4276 15.4276 20.0892 20.0892 21.9362 21.9362 k = 0.1045 0.1141-0.0000 ( 885 PWs) bands (ev): -3.2813 -3.2813 6.9238 6.9238 7.2759 7.2759 11.8318 11.8318 13.8874 13.8874 15.7091 15.7091 20.1919 20.1919 21.9528 21.9528 k = 0.0970 0.1060-0.0000 ( 885 PWs) bands (ev): -3.3197 -3.3197 7.0650 7.0650 7.3836 7.3836 11.6374 11.6374 13.7056 13.7056 15.9904 15.9904 20.2936 20.2936 21.9655 21.9655 k = 0.0896 0.0978-0.0000 ( 885 PWs) bands (ev): -3.3553 -3.3553 7.2080 7.2080 7.4895 7.4895 11.4448 11.4448 13.5311 13.5311 16.2711 16.2711 20.3938 20.3938 21.9735 21.9735 k = 0.0821 0.0897-0.0000 ( 885 PWs) bands (ev): -3.3880 -3.3880 7.3528 7.3528 7.5929 7.5929 11.2541 11.2541 13.3645 13.3645 16.5510 16.5510 20.4915 20.4915 21.9748 21.9748 k = 0.0746 0.0815-0.0000 ( 887 PWs) bands (ev): -3.4179 -3.4179 7.4992 7.4992 7.6932 7.6932 11.0656 11.0656 13.2066 13.2066 16.8296 16.8296 20.5857 20.5857 21.9672 21.9672 k = 0.0672 0.0734-0.0000 ( 887 PWs) bands (ev): -3.4450 -3.4450 7.6469 7.6469 7.7896 7.7896 10.8796 10.8796 13.0583 13.0583 17.1063 17.1063 20.6750 20.6750 21.9529 21.9529 k = 0.0597 0.0652-0.0000 ( 887 PWs) bands (ev): -3.4692 -3.4692 7.7952 7.7952 7.8812 7.8812 10.6964 10.6964 12.9206 12.9206 17.3803 17.3803 20.7569 20.7569 21.9317 21.9317 k = 0.0522 0.0571-0.0000 ( 887 PWs) bands (ev): -3.4906 -3.4906 7.9405 7.9405 7.9702 7.9702 10.5166 10.5166 12.7945 12.7945 17.6506 17.6506 20.8278 20.8278 21.7785 21.7785 k = 0.0448 0.0489-0.0000 ( 885 PWs) bands (ev): -3.5091 -3.5091 8.0392 8.0392 8.0982 8.0982 10.3410 10.3410 12.6814 12.6814 17.9156 17.9156 20.8795 20.8795 21.5766 21.5766 k = 0.0373 0.0408-0.0000 ( 877 PWs) bands (ev): -3.5248 -3.5248 8.1093 8.1093 8.2444 8.2444 10.1710 10.1710 12.5825 12.5825 18.1728 18.1728 20.8935 20.8935 21.4050 21.4050 k = 0.0299 0.0326-0.0000 ( 877 PWs) bands (ev): -3.5376 -3.5376 8.1682 8.1682 8.3879 8.3879 10.0089 10.0089 12.4992 12.4992 18.4182 18.4182 20.8369 20.8369 21.3005 21.3005 k = 0.0224 0.0245-0.0000 ( 881 PWs) bands (ev): -3.5476 -3.5476 8.2156 8.2156 8.5236 8.5236 9.8587 9.8587 12.4327 12.4327 18.6446 18.6446 20.7093 20.7093 21.2691 21.2691 k = 0.0149 0.0163-0.0000 ( 881 PWs) bands (ev): -3.5547 -3.5547 8.2504 8.2504 8.6433 8.6433 9.7288 9.7288 12.3843 12.3843 18.8390 18.8390 20.5622 20.5622 21.2711 21.2711 k = 0.0075 0.0082-0.0000 ( 881 PWs) bands (ev): -3.5590 -3.5590 8.2716 8.2716 8.7315 8.7315 9.6345 9.6345 12.3548 12.3548 18.9781 18.9781 20.4454 20.4454 21.2789 21.2789 k = 0.0000 0.0000 0.0000 ( 885 PWs) bands (ev): -3.5604 -3.5604 8.2788 8.2788 8.7653 8.7653 9.5986 9.5986 12.3449 12.3449 19.0302 19.0302 20.3999 20.3999 21.2824 21.2824 k = 0.0000 0.0000 0.0000 ( 885 PWs) bands (ev): -3.5604 -3.5604 8.2788 8.2788 8.7653 8.7653 9.5986 9.5986 12.3449 12.3449 19.0302 19.0302 20.3999 20.3999 21.2824 21.2824 k = 0.0071-0.0065 0.0055 ( 881 PWs) bands (ev): -3.5590 -3.5590 8.2534 8.2534 8.7562 8.7562 9.6264 9.6264 12.3566 12.3566 19.0227 19.0227 20.4010 20.4010 21.2796 21.2796 k = 0.0142-0.0130 0.0109 ( 885 PWs) bands (ev): -3.5547 -3.5547 8.1827 8.1827 8.7293 8.7293 9.7041 9.7041 12.3913 12.3913 19.0000 19.0000 20.4046 20.4046 21.2703 21.2703 k = 0.0213-0.0195 0.0164 ( 881 PWs) bands (ev): -3.5475 -3.5475 8.0789 8.0789 8.6857 8.6857 9.8197 9.8197 12.4480 12.4480 18.9617 18.9617 20.4106 20.4106 21.2528 21.2528 k = 0.0284-0.0260 0.0218 ( 877 PWs) bands (ev): -3.5374 -3.5374 7.9535 7.9535 8.6269 8.6269 9.9614 9.9614 12.5251 12.5251 18.9073 18.9073 20.4189 20.4189 21.2236 21.2236 k = 0.0355-0.0325 0.0273 ( 879 PWs) bands (ev): -3.5244 -3.5244 7.8148 7.8148 8.5546 8.5546 10.1211 10.1211 12.6210 12.6210 18.8362 18.8362 20.4296 20.4296 21.1792 21.1792 k = 0.0426-0.0390 0.0327 ( 879 PWs) bands (ev): -3.5086 -3.5086 7.6682 7.6682 8.4708 8.4708 10.2933 10.2933 12.7337 12.7337 18.7477 18.7477 20.4426 20.4426 21.1177 21.1177 k = 0.0497-0.0455 0.0382 ( 875 PWs) bands (ev): -3.4899 -3.4899 7.5171 7.5171 8.3774 8.3774 10.4748 10.4748 12.8612 12.8612 18.6412 18.6412 20.4581 20.4581 21.0409 21.0409 k = 0.0568-0.0520 0.0436 ( 879 PWs) bands (ev): -3.4683 -3.4683 7.3635 7.3635 8.2760 8.2760 10.6632 10.6632 13.0019 13.0019 18.5166 18.5166 20.4759 20.4759 20.9535 20.9535 k = 0.0639-0.0585 0.0491 ( 879 PWs) bands (ev): -3.4438 -3.4438 7.2088 7.2088 8.1683 8.1683 10.8574 10.8574 13.1543 13.1543 18.3739 18.3739 20.4960 20.4960 20.8607 20.8607 k = 0.0710-0.0650 0.0545 ( 881 PWs) bands (ev): -3.4164 -3.4164 7.0540 7.0540 8.0555 8.0555 11.0562 11.0562 13.3168 13.3168 18.2136 18.2136 20.5184 20.5184 20.7667 20.7667 k = 0.0781-0.0715 0.0600 ( 881 PWs) bands (ev): -3.3862 -3.3862 6.8998 6.8998 7.9389 7.9389 11.2591 11.2591 13.4885 13.4885 18.0366 18.0366 20.5429 20.5429 20.6744 20.6744 k = 0.0852-0.0780 0.0654 ( 881 PWs) bands (ev): -3.3531 -3.3531 6.7465 6.7465 7.8194 7.8194 11.4657 11.4657 13.6683 13.6683 17.8443 17.8443 20.5655 20.5655 20.5892 20.5892 k = 0.0923-0.0845 0.0709 ( 881 PWs) bands (ev): -3.3172 -3.3172 6.5946 6.5946 7.6978 7.6978 11.6754 11.6754 13.8553 13.8553 17.6381 17.6381 20.4966 20.4966 20.6013 20.6013 k = 0.0994-0.0910 0.0764 ( 883 PWs) bands (ev): -3.2783 -3.2783 6.4442 6.4442 7.5748 7.5748 11.8881 11.8881 14.0489 14.0489 17.4197 17.4197 20.4143 20.4143 20.6324 20.6324 k = 0.1065-0.0975 0.0818 ( 883 PWs) bands (ev): -3.2366 -3.2366 6.2956 6.2956 7.4510 7.4510 12.1036 12.1036 14.2485 14.2485 17.1905 17.1905 20.3351 20.3351 20.6648 20.6648 k = 0.1136-0.1040 0.0873 ( 883 PWs) bands (ev): -3.1921 -3.1921 6.1489 6.1489 7.3268 7.3268 12.3216 12.3216 14.4536 14.4536 16.9521 16.9521 20.2586 20.2586 20.6724 20.6724 k = 0.1207-0.1105 0.0927 ( 891 PWs) bands (ev): -3.1447 -3.1447 6.0042 6.0042 7.2028 7.2028 12.5421 12.5421 14.6637 14.6637 16.7060 16.7060 20.1845 20.1845 20.5718 20.5718 k = 0.1278-0.1170 0.0982 ( 893 PWs) bands (ev): -3.0944 -3.0944 5.8616 5.8616 7.0791 7.0791 12.7648 12.7648 14.8786 14.8786 16.4534 16.4534 20.1124 20.1124 20.4612 20.4612 k = 0.1349-0.1235 0.1036 ( 893 PWs) bands (ev): -3.0412 -3.0412 5.7212 5.7212 6.9562 6.9562 12.9897 12.9897 15.0978 15.0978 16.1953 16.1953 20.0418 20.0418 20.3509 20.3509 k = 0.1420-0.1300 0.1091 ( 893 PWs) bands (ev): -2.9853 -2.9853 5.5830 5.5830 6.8342 6.8342 13.2166 13.2166 15.3212 15.3212 15.9328 15.9328 19.9724 19.9724 20.2417 20.2417 k = 0.1491-0.1365 0.1145 ( 897 PWs) bands (ev): -2.9264 -2.9264 5.4472 5.4472 6.7134 6.7134 13.4454 13.4454 15.5485 15.5485 15.6667 15.6667 19.9040 19.9040 20.1341 20.1341 k = 0.1562-0.1430 0.1200 ( 897 PWs) bands (ev): -2.8647 -2.8647 5.3138 5.3138 6.5940 6.5940 13.6760 13.6760 15.3976 15.3976 15.7795 15.7795 19.8363 19.8363 20.0282 20.0282 k = 0.1633-0.1495 0.1254 ( 897 PWs) bands (ev): -2.8002 -2.8002 5.1827 5.1827 6.4760 6.4760 13.9082 13.9082 15.1264 15.1264 16.0140 16.0140 19.7692 19.7692 19.9244 19.9244 k = 0.1704-0.1560 0.1309 ( 893 PWs) bands (ev): -2.7328 -2.7328 5.0541 5.0541 6.3597 6.3597 14.1419 14.1419 14.8534 14.8534 16.2519 16.2519 19.7025 19.7025 19.8229 19.8229 k = 0.1775-0.1625 0.1363 ( 893 PWs) bands (ev): -2.6626 -2.6626 4.9280 4.9280 6.2451 6.2451 14.3769 14.3769 14.5792 14.5792 16.4930 16.4930 19.6362 19.6362 19.7239 19.7239 k = 0.1846-0.1690 0.1418 ( 893 PWs) bands (ev): -2.5895 -2.5895 4.8044 4.8044 6.1324 6.1324 14.3041 14.3041 14.6130 14.6130 16.7372 16.7372 19.5702 19.5702 19.6276 19.6276 k = 0.1917-0.1755 0.1472 ( 893 PWs) bands (ev): -2.5137 -2.5137 4.6832 4.6832 6.0216 6.0216 14.0286 14.0286 14.8500 14.8500 16.9843 16.9843 19.5046 19.5046 19.5344 19.5344 k = 0.1988-0.1821 0.1527 ( 893 PWs) bands (ev): -2.4350 -2.4350 4.5647 4.5647 5.9128 5.9128 13.7528 13.7528 15.0874 15.0874 17.2343 17.2343 19.4389 19.4389 19.4450 19.4450 k = 0.2059-0.1886 0.1582 ( 897 PWs) bands (ev): -2.3534 -2.3534 4.4487 4.4487 5.8061 5.8061 13.4771 13.4771 15.3250 15.3250 17.4871 17.4871 19.3583 19.3583 19.3747 19.3747 k = 0.2130-0.1951 0.1636 ( 897 PWs) bands (ev): -2.2691 -2.2691 4.3352 4.3352 5.7015 5.7015 13.2018 13.2018 15.5621 15.5621 17.7425 17.7425 19.2768 19.2768 19.3102 19.3102 k = 0.2202-0.2016 0.1691 ( 897 PWs) bands (ev): -2.1819 -2.1819 4.2244 4.2244 5.5991 5.5991 12.9270 12.9270 15.7981 15.7981 18.0005 18.0005 19.2002 19.2002 19.2462 19.2462 k = 0.2273-0.2081 0.1745 ( 899 PWs) bands (ev): -2.0920 -2.0920 4.1162 4.1162 5.4990 5.4990 12.6530 12.6530 16.0321 16.0321 18.2609 18.2609 19.1296 19.1296 19.1829 19.1829 k = 0.2344-0.2146 0.1800 ( 895 PWs) bands (ev): -1.9992 -1.9992 4.0107 4.0107 5.4012 5.4012 12.3798 12.3798 16.2627 16.2627 18.5237 18.5237 19.0663 19.0663 19.1201 19.1201 k = 0.2415-0.2211 0.1854 ( 895 PWs) bands (ev): -1.9037 -1.9037 3.9077 3.9077 5.3057 5.3057 12.1076 12.1076 16.4882 16.4882 18.7887 18.7887 19.0120 19.0120 19.0582 19.0582 k = 0.2486-0.2276 0.1909 ( 897 PWs) bands (ev): -1.8053 -1.8053 3.8075 3.8075 5.2125 5.2125 11.8366 11.8366 16.7058 16.7058 18.9691 18.9691 18.9969 18.9969 19.0564 19.0564 k = 0.2557-0.2341 0.1963 ( 897 PWs) bands (ev): -1.7042 -1.7042 3.7099 3.7099 5.1217 5.1217 11.5669 11.5669 16.9120 16.9120 18.9335 18.9335 18.9451 18.9451 19.3255 19.3255 k = 0.2628-0.2406 0.2018 ( 905 PWs) bands (ev): -1.6003 -1.6003 3.6150 3.6150 5.0334 5.0334 11.2985 11.2985 17.1018 17.1018 18.8759 18.8759 18.9362 18.9362 19.5969 19.5969 k = 0.2699-0.2471 0.2072 ( 905 PWs) bands (ev): -1.4936 -1.4936 3.5228 3.5228 4.9474 4.9474 11.0316 11.0316 17.2688 17.2688 18.8176 18.8176 18.9557 18.9557 19.8702 19.8702 k = 0.2770-0.2536 0.2127 ( 905 PWs) bands (ev): -1.3841 -1.3841 3.4333 3.4333 4.8640 4.8640 10.7663 10.7663 17.4064 17.4064 18.7601 18.7601 19.0084 19.0084 20.1453 20.1453 k = 0.2841-0.2601 0.2181 ( 909 PWs) bands (ev): -1.2719 -1.2719 3.3465 3.3465 4.7830 4.7830 10.5027 10.5027 17.5100 17.5100 18.7038 18.7038 19.0990 19.0990 20.4222 20.4222 k = 0.2912-0.2666 0.2236 ( 909 PWs) bands (ev): -1.1570 -1.1570 3.2624 3.2624 4.7045 4.7045 10.2407 10.2407 17.5787 17.5787 18.6486 18.6486 19.2281 19.2281 20.7006 20.7006 k = 0.2983-0.2731 0.2291 ( 913 PWs) bands (ev): -1.0393 -1.0393 3.1811 3.1811 4.6285 4.6285 9.9806 9.9806 17.6167 17.6167 18.5947 18.5947 19.3914 19.3914 20.9806 20.9806 k = 0.3054-0.2796 0.2345 ( 913 PWs) bands (ev): -0.9188 -0.9188 3.1025 3.1025 4.5551 4.5551 9.7223 9.7223 17.6305 17.6305 18.5421 18.5421 19.5826 19.5826 21.2619 21.2619 k = 0.3125-0.2861 0.2400 ( 911 PWs) bands (ev): -0.7957 -0.7957 3.0266 3.0266 4.4842 4.4842 9.4659 9.4659 17.6267 17.6267 18.4909 18.4909 19.7948 19.7948 21.5445 21.5445 k = 0.3196-0.2926 0.2454 ( 911 PWs) bands (ev): -0.6698 -0.6698 2.9536 2.9536 4.4158 4.4158 9.2115 9.2115 17.6107 17.6107 18.4412 18.4412 20.0225 20.0225 21.8282 21.8282 k = 0.3267-0.2991 0.2509 ( 915 PWs) bands (ev): -0.5413 -0.5413 2.8832 2.8832 4.3501 4.3501 8.9590 8.9590 17.5865 17.5865 18.3929 18.3929 20.2615 20.2615 22.1129 22.1129 k = 0.3338-0.3056 0.2563 ( 913 PWs) bands (ev): -0.4100 -0.4100 2.8157 2.8157 4.2869 4.2869 8.7087 8.7087 17.5571 17.5571 18.3462 18.3462 20.5090 20.5090 22.3984 22.3984 k = 0.3409-0.3121 0.2618 ( 913 PWs) bands (ev): -0.2761 -0.2761 2.7509 2.7509 4.2263 4.2263 8.4604 8.4604 17.5244 17.5244 18.3012 18.3012 20.7627 20.7627 22.6845 22.6845 k = 0.3480-0.3186 0.2672 ( 913 PWs) bands (ev): -0.1395 -0.1395 2.6889 2.6889 4.1682 4.1682 8.2143 8.2143 17.4898 17.4898 18.2578 18.2578 21.0212 21.0212 22.9710 22.9710 k = 0.3551-0.3251 0.2727 ( 913 PWs) bands (ev): -0.0002 -0.0002 2.6298 2.6298 4.1128 4.1128 7.9704 7.9704 17.4543 17.4543 18.2160 18.2160 21.2831 21.2831 23.2578 23.2578 k = 0.3622-0.3316 0.2781 ( 913 PWs) bands (ev): 0.1417 0.1417 2.5734 2.5734 4.0600 4.0600 7.7288 7.7288 17.4187 17.4187 18.1761 18.1761 21.5477 21.5477 23.4547 23.4547 k = 0.3693-0.3381 0.2836 ( 913 PWs) bands (ev): 0.2861 0.2861 2.5198 2.5198 4.0098 4.0098 7.4894 7.4894 17.3835 17.3835 18.1379 18.1379 21.8142 21.8142 23.5720 23.5720 k = 0.3764-0.3446 0.2890 ( 909 PWs) bands (ev): 0.4332 0.4332 2.4690 2.4690 3.9623 3.9623 7.2524 7.2524 17.3491 17.3491 18.1015 18.1015 22.0819 22.0819 23.6909 23.6909 k = 0.3835-0.3511 0.2945 ( 905 PWs) bands (ev): 0.5828 0.5828 2.4210 2.4210 3.9173 3.9173 7.0177 7.0177 17.3158 17.3158 18.0670 18.0670 22.3503 22.3503 23.8113 23.8113 k = 0.3906-0.3576 0.3000 ( 907 PWs) bands (ev): 0.7350 0.7350 2.3758 2.3758 3.8750 3.8750 6.7855 6.7855 17.2838 17.2838 18.0344 18.0344 22.6187 22.6187 23.9332 23.9332 k = 0.3977-0.3641 0.3054 ( 909 PWs) bands (ev): 0.8896 0.8896 2.3335 2.3335 3.8354 3.8354 6.5558 6.5558 17.2533 17.2533 18.0037 18.0037 22.8867 22.8867 24.0563 24.0563 k = 0.4048-0.3706 0.3109 ( 917 PWs) bands (ev): 1.0466 1.0466 2.2940 2.2940 3.7984 3.7984 6.3286 6.3286 17.2244 17.2244 17.9749 17.9749 23.1538 23.1538 24.1803 24.1803 k = 0.4119-0.3771 0.3163 ( 921 PWs) bands (ev): 1.2060 1.2060 2.2573 2.2573 3.7640 3.7640 6.1040 6.1040 17.1973 17.1973 17.9481 17.9481 23.4193 23.4193 24.3051 24.3051 k = 0.4190-0.3836 0.3218 ( 921 PWs) bands (ev): 1.3676 1.3676 2.2234 2.2234 3.7323 3.7323 5.8822 5.8822 17.1721 17.1721 17.9233 17.9233 23.6826 23.6826 24.4303 24.4303 k = 0.4261-0.3901 0.3272 ( 921 PWs) bands (ev): 1.5314 1.5314 2.1924 2.1924 3.7032 3.7032 5.6633 5.6633 17.1487 17.1487 17.9005 17.9005 23.9431 23.9431 24.5554 24.5554 k = 0.4332-0.3966 0.3327 ( 921 PWs) bands (ev): 1.6972 1.6972 2.1642 2.1642 3.6768 3.6768 5.4474 5.4474 17.1274 17.1274 17.8797 17.8797 24.1999 24.1999 24.6797 24.6797 k = 0.4403-0.4031 0.3381 ( 921 PWs) bands (ev): 1.8647 1.8647 2.1388 2.1388 3.6531 3.6531 5.2348 5.2348 17.1081 17.1081 17.8610 17.8610 24.4524 24.4524 24.8026 24.8026 k = 0.4474-0.4096 0.3436 ( 917 PWs) bands (ev): 2.0337 2.0337 2.1163 2.1163 3.6320 3.6320 5.0258 5.0258 17.0909 17.0909 17.8443 17.8443 24.6994 24.6994 24.9230 24.9230 k = 0.4545-0.4161 0.3490 ( 917 PWs) bands (ev): 2.0966 2.0966 2.2035 2.2035 3.6136 3.6136 4.8210 4.8210 17.0759 17.0759 17.8297 17.8297 24.9399 24.9399 25.0395 25.0395 k = 0.4616-0.4226 0.3545 ( 917 PWs) bands (ev): 2.0798 2.0798 2.3734 2.3734 3.5978 3.5978 4.6212 4.6212 17.0629 17.0629 17.8172 17.8172 25.1483 25.1483 25.1744 25.1744 k = 0.4687-0.4291 0.3599 ( 917 PWs) bands (ev): 2.0658 2.0658 2.5417 2.5417 3.5847 3.5847 4.4281 4.4281 17.0521 17.0521 17.8068 17.8068 25.2510 25.2510 25.3975 25.3975 k = 0.4758-0.4356 0.3654 ( 911 PWs) bands (ev): 2.0547 2.0547 2.7056 2.7056 3.5743 3.5743 4.2444 4.2444 17.0435 17.0435 17.7986 17.7986 25.3406 25.3406 25.6105 25.6105 k = 0.4758-0.4356 0.3654 ( 911 PWs) bands (ev): 2.0547 2.0547 2.7056 2.7056 3.5743 3.5743 4.2444 4.2444 17.0435 17.0435 17.7986 17.7986 25.3406 25.3406 25.6105 25.6105 k = 0.4763-0.4252 0.3616 ( 914 PWs) bands (ev): 2.0509 2.0509 2.5937 2.5937 3.5938 3.5938 4.3708 4.3708 17.0499 17.0499 17.8039 17.8039 25.2642 25.2642 25.4603 25.4603 k = 0.4769-0.4148 0.3579 ( 918 PWs) bands (ev): 2.0271 2.0271 2.4806 2.4806 3.6385 3.6385 4.5038 4.5038 17.0585 17.0585 17.8099 17.8099 25.1521 25.1521 25.2963 25.2963 k = 0.4774-0.4043 0.3541 ( 918 PWs) bands (ev): 1.9860 1.9860 2.3675 2.3675 3.7059 3.7059 4.6421 4.6421 17.0695 17.0695 17.8165 17.8165 25.0102 25.0102 25.1196 25.1196 k = 0.4779-0.3939 0.3503 ( 918 PWs) bands (ev): 1.9312 1.9312 2.2553 2.2553 3.7924 3.7924 4.7848 4.7848 17.0827 17.0827 17.8236 17.8236 24.8442 24.8442 24.9308 24.9308 k = 0.4784-0.3835 0.3465 ( 918 PWs) bands (ev): 1.8660 1.8660 2.1444 2.1444 3.8945 3.8945 4.9315 4.9315 17.0982 17.0982 17.8310 17.8310 24.6587 24.6587 24.7306 24.7306 k = 0.4790-0.3730 0.3428 ( 916 PWs) bands (ev): 1.7934 1.7934 2.0352 2.0352 4.0092 4.0092 5.0817 5.0817 17.1160 17.1160 17.8386 17.8386 24.4576 24.4576 24.5200 24.5200 k = 0.4795-0.3626 0.3390 ( 917 PWs) bands (ev): 1.7158 1.7158 1.9280 1.9280 4.1343 4.1343 5.2353 5.2353 17.1360 17.1360 17.8460 17.8460 24.2440 24.2440 24.2998 24.2998 k = 0.4800-0.3522 0.3352 ( 915 PWs) bands (ev): 1.6350 1.6350 1.8229 1.8229 4.2679 4.2679 5.3919 5.3919 17.1582 17.1582 17.8531 17.8531 24.0206 24.0206 24.0709 24.0709 k = 0.4805-0.3417 0.3315 ( 915 PWs) bands (ev): 1.5524 1.5524 1.7201 1.7201 4.4087 4.4087 5.5516 5.5516 17.1826 17.1826 17.8594 17.8594 23.7899 23.7899 23.8343 23.8343 k = 0.4811-0.3313 0.3277 ( 915 PWs) bands (ev): 1.4688 1.4688 1.6196 1.6196 4.5556 4.5556 5.7141 5.7141 17.2091 17.2091 17.8646 17.8646 23.5539 23.5539 23.5909 23.5909 k = 0.4816-0.3209 0.3239 ( 917 PWs) bands (ev): 1.3852 1.3852 1.5216 1.5216 4.7078 4.7078 5.8795 5.8795 17.2378 17.2378 17.8681 17.8681 23.3144 23.3144 23.3419 23.3419 k = 0.4821-0.3105 0.3202 ( 917 PWs) bands (ev): 1.3020 1.3020 1.4260 1.4260 4.8648 4.8648 6.0475 6.0475 17.2684 17.2684 17.8693 17.8693 23.0726 23.0726 23.0889 23.0889 k = 0.4826-0.3000 0.3164 ( 915 PWs) bands (ev): 1.2197 1.2197 1.3330 1.3330 5.0262 5.0262 6.2182 6.2182 17.3010 17.3010 17.8675 17.8675 22.8235 22.8235 22.8395 22.8395 k = 0.4832-0.2896 0.3126 ( 913 PWs) bands (ev): 1.1387 1.1387 1.2425 1.2425 5.1915 5.1915 6.3914 6.3914 17.3355 17.3355 17.8617 17.8617 22.5633 22.5633 22.6002 22.6002 k = 0.4837-0.2792 0.3089 ( 914 PWs) bands (ev): 1.0592 1.0592 1.1547 1.1547 5.3605 5.3605 6.5672 6.5672 17.3718 17.3718 17.8511 17.8511 22.2986 22.2986 22.3668 22.3668 k = 0.4842-0.2687 0.3051 ( 913 PWs) bands (ev): 0.9814 0.9814 1.0695 1.0695 5.5330 5.5330 6.7455 6.7455 17.4097 17.4097 17.8343 17.8343 22.0316 22.0316 22.1399 22.1399 k = 0.4848-0.2583 0.3013 ( 905 PWs) bands (ev): 0.9055 0.9055 0.9870 0.9870 5.7087 5.7087 6.9261 6.9261 17.4490 17.4490 17.8099 17.8099 21.7631 21.7631 21.9215 21.9215 k = 0.4853-0.2479 0.2975 ( 903 PWs) bands (ev): 0.8316 0.8316 0.9071 0.9071 5.8875 5.8875 7.1091 7.1091 17.4895 17.4895 17.7765 17.7765 21.4938 21.4938 21.7134 21.7134 k = 0.4858-0.2374 0.2938 ( 903 PWs) bands (ev): 0.7598 0.7598 0.8299 0.8299 6.0693 6.0693 7.2944 7.2944 17.5308 17.5308 17.7323 17.7323 21.2246 21.2246 21.5178 21.5178 k = 0.4863-0.2270 0.2900 ( 905 PWs) bands (ev): 0.6903 0.6903 0.7555 0.7555 6.2539 6.2539 7.4819 7.4819 17.5723 17.5723 17.6759 17.6759 20.9563 20.9563 21.3369 21.3369 k = 0.4869-0.2166 0.2862 ( 908 PWs) bands (ev): 0.6231 0.6231 0.6837 0.6837 6.4413 6.4413 7.6715 7.6715 17.5989 17.5989 17.6201 17.6201 20.6898 20.6898 21.1726 21.1726 k = 0.4874-0.2062 0.2825 ( 904 PWs) bands (ev): 0.5583 0.5583 0.6147 0.6147 6.6313 6.6313 7.8633 7.8633 17.5171 17.5171 17.6559 17.6559 20.4264 20.4264 21.0266 21.0266 k = 0.4879-0.1957 0.2787 ( 904 PWs) bands (ev): 0.4959 0.4959 0.5484 0.5484 6.8238 6.8238 8.0570 8.0570 17.4144 17.4144 17.6938 17.6938 20.1676 20.1676 20.9003 20.9003 k = 0.4884-0.1853 0.2749 ( 905 PWs) bands (ev): 0.4360 0.4360 0.4848 0.4848 7.0187 7.0187 8.2525 8.2525 17.2946 17.2946 17.7273 17.7273 19.9159 19.9159 20.7942 20.7942 k = 0.4890-0.1749 0.2712 ( 905 PWs) bands (ev): 0.3786 0.3786 0.4240 0.4240 7.2159 7.2159 8.4498 8.4498 17.1581 17.1581 17.7534 17.7534 19.6745 19.6745 20.7084 20.7084 k = 0.4895-0.1644 0.2674 ( 904 PWs) bands (ev): 0.3237 0.3237 0.3660 0.3660 7.4154 7.4154 8.6488 8.6488 17.0058 17.0058 17.7670 17.7670 19.4487 19.4487 20.6422 20.6422 k = 0.4900-0.1540 0.2636 ( 904 PWs) bands (ev): 0.2714 0.2714 0.3108 0.3108 7.6170 7.6170 8.8491 8.8491 16.8390 16.8390 17.7609 17.7609 19.2458 19.2458 20.5944 20.5944 k = 0.4905-0.1436 0.2598 ( 902 PWs) bands (ev): 0.2218 0.2218 0.2583 0.2583 7.8206 7.8206 9.0507 9.0507 16.6597 16.6597 17.7252 17.7252 19.0761 19.0761 20.5636 20.5636 k = 0.4911-0.1331 0.2561 ( 902 PWs) bands (ev): 0.1747 0.1747 0.2085 0.2085 8.0261 8.0261 9.2532 9.2532 16.4696 16.4696 17.6495 17.6495 18.9499 18.9499 20.5479 20.5479 k = 0.4916-0.1227 0.2523 ( 904 PWs) bands (ev): 0.1303 0.1303 0.1616 0.1616 8.2333 8.2333 9.4565 9.4565 16.2709 16.2709 17.5291 17.5291 18.8725 18.8725 20.5456 20.5456 k = 0.4921-0.1123 0.2485 ( 904 PWs) bands (ev): 0.0886 0.0886 0.1175 0.1175 8.4421 8.4421 9.6599 9.6599 16.0657 16.0657 17.3678 17.3678 18.8400 18.8400 20.5547 20.5547 k = 0.4926-0.1018 0.2448 ( 906 PWs) bands (ev): 0.0495 0.0495 0.0761 0.0761 8.6523 8.6523 9.8632 9.8632 15.8558 15.8558 17.1757 17.1757 18.8428 18.8428 20.5734 20.5734 k = 0.4932-0.0914 0.2410 ( 905 PWs) bands (ev): 0.0132 0.0132 0.0375 0.0375 8.8637 8.8637 10.0655 10.0655 15.6433 15.6433 16.9630 16.9630 18.8708 18.8708 20.5997 20.5997 k = 0.4937-0.0810 0.2372 ( 903 PWs) bands (ev): -0.0204 -0.0204 0.0017 0.0017 9.0760 9.0760 10.2661 10.2661 15.4302 15.4302 16.7375 16.7375 18.9165 18.9165 20.6312 20.6312 k = 0.4942-0.0706 0.2335 ( 902 PWs) bands (ev): -0.0514 -0.0514 -0.0313 -0.0313 9.2889 9.2889 10.4637 10.4637 15.2185 15.2185 16.5047 16.5047 18.9748 18.9748 20.6649 20.6649 k = 0.4947-0.0601 0.2297 ( 903 PWs) bands (ev): -0.0796 -0.0796 -0.0615 -0.0615 9.5020 9.5020 10.6569 10.6569 15.0108 15.0108 16.2683 16.2683 19.0425 19.0425 20.6956 20.6956 k = 0.4953-0.0497 0.2259 ( 903 PWs) bands (ev): -0.1050 -0.1050 -0.0889 -0.0889 9.7149 9.7149 10.8434 10.8434 14.8099 14.8099 16.0309 16.0309 19.1172 19.1172 20.7147 20.7147 k = 0.4958-0.0393 0.2221 ( 903 PWs) bands (ev): -0.1277 -0.1277 -0.1135 -0.1135 9.9267 9.9267 11.0202 11.0202 14.6193 14.6193 15.7945 15.7945 19.1978 19.1978 20.7089 20.7089 k = 0.4963-0.0288 0.2184 ( 903 PWs) bands (ev): -0.1477 -0.1477 -0.1353 -0.1353 10.1369 10.1369 11.1832 11.1832 14.4437 14.4437 15.5609 15.5609 19.2831 19.2831 20.6679 20.6679 k = 0.4968-0.0184 0.2146 ( 903 PWs) bands (ev): -0.1649 -0.1649 -0.1543 -0.1543 10.3442 10.3442 11.3266 11.3266 14.2892 14.2892 15.3318 15.3318 19.3726 19.3726 20.5954 20.5954 k = 0.4974-0.0080 0.2108 ( 900 PWs) bands (ev): -0.1793 -0.1793 -0.1706 -0.1706 10.5472 10.5472 11.4432 11.4432 14.1635 14.1635 15.1091 15.1091 19.4656 19.4656 20.5034 20.5034 k = 0.4979 0.0025 0.2071 ( 900 PWs) bands (ev): -0.1910 -0.1910 -0.1840 -0.1840 10.7439 10.7439 11.5243 11.5243 14.0754 14.0754 14.8951 14.8951 19.5618 19.5618 20.4015 20.4015 k = 0.4984 0.0129 0.2033 ( 900 PWs) bands (ev): -0.1999 -0.1999 -0.1946 -0.1946 10.9316 10.9316 11.5621 11.5621 14.0330 14.0330 14.6928 14.6928 19.6608 19.6608 20.2952 20.2952 k = 0.4989 0.0233 0.1995 ( 900 PWs) bands (ev): -0.2061 -0.2061 -0.2024 -0.2024 11.1064 11.1064 11.5517 11.5517 14.0413 14.0413 14.5060 14.5060 19.7624 19.7624 20.1872 20.1872 k = 0.4995 0.0337 0.1958 ( 900 PWs) bands (ev): -0.2095 -0.2095 -0.2073 -0.2073 11.2632 11.2632 11.4942 11.4942 14.0995 14.0995 14.3401 14.3401 19.8663 19.8663 20.0792 20.0792 k = 0.5000 0.0442 0.1920 ( 900 PWs) bands (ev): -0.2105 -0.2105 -0.2091 -0.2091 11.3947 11.3947 11.3958 11.3958 14.2012 14.2012 14.2024 14.2024 19.9719 19.9719 19.9721 19.9721 k = 0.5000 0.0442 0.1920 ( 900 PWs) bands (ev): -0.2105 -0.2105 -0.2091 -0.2091 11.3947 11.3947 11.3958 11.3958 14.2012 14.2012 14.2024 14.2024 19.9719 19.9719 19.9721 19.9721 k = 0.4960 0.0479 0.2016 ( 898 PWs) bands (ev): -0.2090 -0.2090 -0.2077 -0.2077 11.3957 11.3957 11.3968 11.3968 14.2023 14.2023 14.2034 14.2034 19.9244 19.9244 19.9247 19.9247 k = 0.4919 0.0516 0.2113 ( 890 PWs) bands (ev): -0.2048 -0.2048 -0.2034 -0.2034 11.3986 11.3986 11.3997 11.3997 14.2053 14.2053 14.2065 14.2065 19.7953 19.7953 19.7956 19.7956 k = 0.4879 0.0553 0.2209 ( 896 PWs) bands (ev): -0.1977 -0.1977 -0.1963 -0.1963 11.4034 11.4034 11.4045 11.4045 14.2103 14.2103 14.2115 14.2115 19.6108 19.6108 19.6111 19.6111 k = 0.4839 0.0589 0.2306 ( 896 PWs) bands (ev): -0.1877 -0.1877 -0.1864 -0.1864 11.4102 11.4102 11.4113 11.4113 14.2173 14.2173 14.2185 14.2185 19.3929 19.3929 19.3933 19.3933 k = 0.4798 0.0626 0.2402 ( 898 PWs) bands (ev): -0.1749 -0.1749 -0.1736 -0.1736 11.4188 11.4188 11.4199 11.4199 14.2262 14.2262 14.2274 14.2274 19.1556 19.1556 19.1559 19.1559 k = 0.4758 0.0663 0.2499 ( 898 PWs) bands (ev): -0.1593 -0.1593 -0.1579 -0.1579 11.4293 11.4293 11.4304 11.4304 14.2369 14.2369 14.2381 14.2381 18.9070 18.9070 18.9073 18.9073 k = 0.4718 0.0700 0.2595 ( 896 PWs) bands (ev): -0.1408 -0.1408 -0.1394 -0.1394 11.4415 11.4415 11.4426 11.4426 14.2494 14.2494 14.2505 14.2505 18.6520 18.6520 18.6524 18.6524 k = 0.4677 0.0737 0.2692 ( 900 PWs) bands (ev): -0.1194 -0.1194 -0.1181 -0.1181 11.4555 11.4555 11.4566 11.4566 14.2633 14.2633 14.2645 14.2645 18.3937 18.3937 18.3942 18.3942 k = 0.4637 0.0774 0.2789 ( 896 PWs) bands (ev): -0.0953 -0.0953 -0.0939 -0.0939 11.4710 11.4710 11.4721 11.4721 14.2787 14.2787 14.2799 14.2799 18.1345 18.1345 18.1349 18.1349 k = 0.4597 0.0811 0.2885 ( 896 PWs) bands (ev): -0.0683 -0.0683 -0.0669 -0.0669 11.4880 11.4880 11.4891 11.4891 14.2953 14.2953 14.2965 14.2965 17.8757 17.8757 17.8762 17.8762 k = 0.4556 0.0848 0.2982 ( 894 PWs) bands (ev): -0.0384 -0.0384 -0.0371 -0.0371 11.5064 11.5064 11.5075 11.5075 14.3126 14.3126 14.3138 14.3138 17.6188 17.6188 17.6193 17.6193 k = 0.4516 0.0885 0.3078 ( 894 PWs) bands (ev): -0.0057 -0.0057 -0.0044 -0.0044 11.5259 11.5259 11.5270 11.5270 14.3303 14.3303 14.3316 14.3316 17.3650 17.3650 17.3655 17.3655 k = 0.4476 0.0922 0.3175 ( 896 PWs) bands (ev): 0.0298 0.0298 0.0311 0.0311 11.5464 11.5464 11.5475 11.5475 14.3478 14.3478 14.3491 14.3491 17.1155 17.1155 17.1160 17.1160 k = 0.4435 0.0959 0.3271 ( 896 PWs) bands (ev): 0.0681 0.0681 0.0695 0.0695 11.5676 11.5676 11.5687 11.5687 14.3642 14.3642 14.3656 14.3656 16.8718 16.8718 16.8724 16.8724 k = 0.4395 0.0996 0.3368 ( 898 PWs) bands (ev): 0.1093 0.1093 0.1106 0.1106 11.5892 11.5892 11.5903 11.5903 14.3784 14.3784 14.3799 14.3799 16.6357 16.6357 16.6363 16.6363 k = 0.4355 0.1032 0.3464 ( 898 PWs) bands (ev): 0.1533 0.1533 0.1546 0.1546 11.6108 11.6108 11.6118 11.6118 14.3888 14.3888 14.3903 14.3903 16.4094 16.4094 16.4100 16.4100 k = 0.4315 0.1069 0.3561 ( 898 PWs) bands (ev): 0.2001 0.2001 0.2015 0.2015 11.6318 11.6318 11.6328 11.6328 14.3929 14.3929 14.3947 14.3947 16.1959 16.1959 16.1965 16.1965 k = 0.4274 0.1106 0.3657 ( 898 PWs) bands (ev): 0.2498 0.2498 0.2511 0.2511 11.6515 11.6515 11.6527 11.6527 14.3877 14.3877 14.3897 14.3897 15.9991 15.9991 15.9998 15.9998 k = 0.4234 0.1143 0.3754 ( 898 PWs) bands (ev): 0.3022 0.3022 0.3036 0.3036 11.6693 11.6693 11.6704 11.6704 14.3691 14.3691 14.3715 14.3715 15.8240 15.8240 15.8249 15.8249 k = 0.4194 0.1180 0.3850 ( 898 PWs) bands (ev): 0.3575 0.3575 0.3588 0.3588 11.6840 11.6840 11.6852 11.6852 14.3325 14.3325 14.3353 14.3353 15.6763 15.6763 15.6775 15.6775 k = 0.4153 0.1217 0.3947 ( 900 PWs) bands (ev): 0.4156 0.4156 0.4169 0.4169 11.6943 11.6943 11.6955 11.6955 14.2743 14.2743 14.2776 14.2776 15.5610 15.5610 15.5625 15.5625 k = 0.4113 0.1254 0.4043 ( 900 PWs) bands (ev): 0.4765 0.4765 0.4778 0.4778 11.6985 11.6985 11.6998 11.6998 14.1941 14.1941 14.1978 14.1978 15.4804 15.4804 15.4822 15.4822 k = 0.4073 0.1291 0.4140 ( 902 PWs) bands (ev): 0.5402 0.5402 0.5415 0.5415 11.6946 11.6946 11.6959 11.6959 14.0958 14.0958 14.0998 14.0998 15.4327 15.4327 15.4346 15.4346 k = 0.4032 0.1328 0.4236 ( 900 PWs) bands (ev): 0.6067 0.6067 0.6080 0.6080 11.6800 11.6800 11.6815 11.6815 13.9867 13.9867 13.9911 13.9911 15.4131 15.4131 15.4151 15.4151 k = 0.3992 0.1365 0.4333 ( 900 PWs) bands (ev): 0.6760 0.6760 0.6773 0.6773 11.6521 11.6521 11.6537 11.6537 13.8757 13.8757 13.8803 13.8803 15.4154 15.4154 15.4175 15.4175 k = 0.3952 0.1402 0.4429 ( 898 PWs) bands (ev): 0.7480 0.7480 0.7494 0.7494 11.6080 11.6080 11.6097 11.6097 13.7708 13.7708 13.7757 13.7757 15.4346 15.4346 15.4366 15.4366 k = 0.3911 0.1439 0.4526 ( 900 PWs) bands (ev): 0.8229 0.8229 0.8243 0.8243 11.5451 11.5451 11.5469 11.5469 13.6786 13.6786 13.6837 13.6837 15.4664 15.4664 15.4684 15.4684 k = 0.3871 0.1475 0.4622 ( 900 PWs) bands (ev): 0.9006 0.9006 0.9019 0.9019 11.4617 11.4617 11.4635 11.4635 13.6039 13.6039 13.6092 13.6092 15.5080 15.5080 15.5100 15.5100 k = 0.3831 0.1512 0.4719 ( 900 PWs) bands (ev): 0.9810 0.9810 0.9824 0.9824 11.3574 11.3574 11.3592 11.3592 13.5491 13.5491 13.5545 13.5545 15.5572 15.5572 15.5592 15.5592 k = 0.3790 0.1549 0.4815 ( 900 PWs) bands (ev): 1.0642 1.0642 1.0656 1.0656 11.2330 11.2330 11.2348 11.2348 13.5147 13.5147 13.5201 13.5201 15.6127 15.6127 15.6146 15.6146 k = 0.3750 0.1586 0.4912 ( 900 PWs) bands (ev): 1.1501 1.1501 1.1515 1.1515 11.0907 11.0907 11.0925 11.0925 13.4997 13.4997 13.5052 13.5052 15.6733 15.6733 15.6752 15.6752 k = 0.3710 0.1623 0.5008 ( 900 PWs) bands (ev): 1.2389 1.2389 1.2403 1.2403 10.9331 10.9331 10.9347 10.9347 13.5022 13.5022 13.5076 13.5076 15.7382 15.7382 15.7401 15.7401 k = 0.3669 0.1660 0.5105 ( 898 PWs) bands (ev): 1.3303 1.3303 1.3317 1.3317 10.7629 10.7629 10.7644 10.7644 13.5198 13.5198 13.5253 13.5253 15.8070 15.8070 15.8089 15.8089 k = 0.3629 0.1697 0.5201 ( 898 PWs) bands (ev): 1.4245 1.4245 1.4259 1.4259 10.5828 10.5828 10.5841 10.5841 13.5504 13.5504 13.5559 13.5559 15.8791 15.8791 15.8810 15.8810 k = 0.3589 0.1734 0.5298 ( 900 PWs) bands (ev): 1.5215 1.5215 1.5229 1.5229 10.3950 10.3950 10.3962 10.3962 13.5919 13.5919 13.5974 13.5974 15.9543 15.9543 15.9561 15.9561 k = 0.3548 0.1771 0.5395 ( 900 PWs) bands (ev): 1.6212 1.6212 1.6226 1.6226 10.2014 10.2014 10.2025 10.2025 13.6427 13.6427 13.6482 13.6482 16.0320 16.0320 16.0339 16.0339 k = 0.3508 0.1808 0.5491 ( 900 PWs) bands (ev): 1.7236 1.7236 1.7250 1.7250 10.0036 10.0036 10.0046 10.0046 13.7012 13.7012 13.7068 13.7068 16.1122 16.1122 16.1141 16.1141 k = 0.3468 0.1845 0.5588 ( 902 PWs) bands (ev): 1.8287 1.8287 1.8301 1.8301 9.8028 9.8028 9.8037 9.8037 13.7665 13.7665 13.7722 13.7722 16.1946 16.1946 16.1964 16.1964 k = 0.3427 0.1882 0.5684 ( 902 PWs) bands (ev): 1.9365 1.9365 1.9379 1.9379 9.5999 9.5999 9.6007 9.6007 13.8376 13.8376 13.8433 13.8433 16.2789 16.2789 16.2807 16.2807 k = 0.3387 0.1918 0.5781 ( 906 PWs) bands (ev): 2.0469 2.0469 2.0484 2.0484 9.3958 9.3958 9.3965 9.3965 13.9137 13.9137 13.9195 13.9195 16.3648 16.3648 16.3667 16.3667 k = 0.3347 0.1955 0.5877 ( 910 PWs) bands (ev): 2.1601 2.1601 2.1615 2.1615 9.1911 9.1911 9.1917 9.1917 13.9941 13.9941 14.0001 14.0001 16.4523 16.4523 16.4542 16.4542 k = 0.3306 0.1992 0.5974 ( 910 PWs) bands (ev): 2.2759 2.2759 2.2774 2.2774 8.9862 8.9862 8.9868 8.9868 14.0784 14.0784 14.0846 14.0846 16.5410 16.5410 16.5429 16.5429 k = 0.3266 0.2029 0.6070 ( 910 PWs) bands (ev): 2.3944 2.3944 2.3959 2.3959 8.7817 8.7817 8.7823 8.7823 14.1661 14.1661 14.1725 14.1725 16.6307 16.6307 16.6327 16.6327 k = 0.3226 0.2066 0.6167 ( 912 PWs) bands (ev): 2.5155 2.5155 2.5170 2.5170 8.5779 8.5779 8.5783 8.5783 14.2567 14.2567 14.2633 14.2633 16.7211 16.7211 16.7231 16.7231 k = 0.3185 0.2103 0.6263 ( 912 PWs) bands (ev): 2.6392 2.6392 2.6407 2.6407 8.3750 8.3750 8.3754 8.3754 14.3498 14.3498 14.3567 14.3567 16.8119 16.8119 16.8140 16.8140 k = 0.3145 0.2140 0.6360 ( 914 PWs) bands (ev): 2.7655 2.7655 2.7670 2.7670 8.1733 8.1733 8.1736 8.1736 14.4450 14.4450 14.4523 14.4523 16.9028 16.9028 16.9050 16.9050 k = 0.3105 0.2177 0.6456 ( 914 PWs) bands (ev): 2.8944 2.8944 2.8959 2.8959 7.9729 7.9729 7.9733 7.9733 14.5420 14.5420 14.5496 14.5496 16.9935 16.9935 16.9957 16.9957 k = 0.3065 0.2214 0.6553 ( 916 PWs) bands (ev): 3.0257 3.0257 3.0273 3.0273 7.7742 7.7742 7.7745 7.7745 14.6402 14.6402 14.6481 14.6481 17.0834 17.0834 17.0858 17.0858 k = 0.3024 0.2251 0.6649 ( 912 PWs) bands (ev): 3.1596 3.1596 3.1612 3.1612 7.5772 7.5772 7.5775 7.5775 14.7391 14.7391 14.7475 14.7475 17.1721 17.1721 17.1747 17.1747 k = 0.2984 0.2288 0.6746 ( 910 PWs) bands (ev): 3.2959 3.2959 3.2975 3.2975 7.3821 7.3821 7.3824 7.3824 14.8383 14.8383 14.8472 14.8472 17.2590 17.2590 17.2619 17.2619 k = 0.2944 0.2325 0.6842 ( 910 PWs) bands (ev): 3.4346 3.4346 3.4362 3.4362 7.1890 7.1890 7.1894 7.1894 14.9371 14.9371 14.9465 14.9465 17.3436 17.3436 17.3468 17.3468 k = 0.2903 0.2361 0.6939 ( 908 PWs) bands (ev): 3.5756 3.5756 3.5772 3.5772 6.9982 6.9982 6.9986 6.9986 15.0347 15.0347 15.0447 15.0447 17.4251 17.4251 17.4287 17.4287 k = 0.2863 0.2398 0.7035 ( 908 PWs) bands (ev): 3.7187 3.7187 3.7204 3.7204 6.8097 6.8097 6.8102 6.8102 15.1302 15.1302 15.1410 15.1410 17.5027 17.5027 17.5068 17.5068 k = 0.2823 0.2435 0.7132 ( 906 PWs) bands (ev): 3.8639 3.8639 3.8657 3.8657 6.6239 6.6239 6.6244 6.6244 15.2227 15.2227 15.2341 15.2341 17.5756 17.5756 17.5804 17.5804 k = 0.2782 0.2472 0.7228 ( 906 PWs) bands (ev): 4.0108 4.0108 4.0126 4.0126 6.4410 6.4410 6.4416 6.4416 15.3108 15.3108 15.3230 15.3230 17.6426 17.6426 17.6485 17.6485 k = 0.2742 0.2509 0.7325 ( 908 PWs) bands (ev): 4.1590 4.1590 4.1610 4.1610 6.2614 6.2614 6.2622 6.2622 15.3930 15.3930 15.4060 15.4060 17.7029 17.7029 17.7100 17.7100 k = 0.2702 0.2546 0.7421 ( 908 PWs) bands (ev): 4.3080 4.3080 4.3101 4.3101 6.0858 6.0858 6.0868 6.0868 15.4677 15.4677 15.4815 15.4815 17.7553 17.7553 17.7640 17.7640 k = 0.2661 0.2583 0.7518 ( 906 PWs) bands (ev): 4.4563 4.4563 4.4587 4.4587 5.9155 5.9155 5.9169 5.9169 15.5329 15.5329 15.5475 15.5475 17.7988 17.7988 17.8094 17.8094 k = 0.2621 0.2620 0.7614 ( 906 PWs) bands (ev): 4.6014 4.6014 4.6041 4.6041 5.7531 5.7531 5.7549 5.7549 15.5865 15.5865 15.6018 15.6018 17.8326 17.8326 17.8453 17.8453 k = 0.2581 0.2657 0.7711 ( 906 PWs) bands (ev): 4.7371 4.7371 4.7405 4.7405 5.6047 5.6047 5.6072 5.6072 15.6266 15.6266 15.6425 15.6425 17.8564 17.8564 17.8712 17.8712 k = 0.2540 0.2694 0.7807 ( 906 PWs) bands (ev): 4.8473 4.8473 4.8517 4.8517 5.4862 5.4862 5.4897 5.4897 15.6515 15.6515 15.6677 15.6677 17.8702 17.8702 17.8868 17.8868 k = 0.2500 0.2731 0.7904 ( 908 PWs) bands (ev): 4.8945 4.8945 4.8994 4.8994 5.4360 5.4360 5.4402 5.4402 15.6599 15.6599 15.6763 15.6763 17.8748 17.8748 17.8919 17.8919 k = 0.2983-0.2731 0.7904 ( 906 PWs) bands (ev): 4.7320 4.7320 5.1798 5.1798 5.7896 5.7896 6.1435 6.1435 6.9267 6.9267 16.6769 16.6769 18.0395 18.0395 18.3851 18.3851 k = 0.3023-0.2768 0.7807 ( 906 PWs) bands (ev): 4.6310 4.6310 5.1469 5.1469 5.8962 5.8962 6.0308 6.0308 6.8173 6.8173 16.8839 16.8839 18.2452 18.2452 18.5700 18.5700 k = 0.3063-0.2805 0.7711 ( 902 PWs) bands (ev): 4.5228 4.5228 5.0761 5.0761 5.9201 5.9201 6.0476 6.0476 6.7185 6.7185 17.0933 17.0933 18.4538 18.4538 18.7562 18.7562 k = 0.3104-0.2841 0.7614 ( 902 PWs) bands (ev): 4.4131 4.4131 4.9876 4.9876 5.8119 5.8119 6.2017 6.2017 6.6464 6.6464 17.3050 17.3050 18.6653 18.6653 18.9437 18.9437 k = 0.3144-0.2878 0.7518 ( 902 PWs) bands (ev): 4.3040 4.3040 4.8916 4.8916 5.7061 5.7061 6.2897 6.2897 6.6575 6.6575 17.5189 17.5189 18.8796 18.8796 19.1325 19.1325 k = 0.3184-0.2915 0.7421 ( 902 PWs) bands (ev): 4.1964 4.1964 4.7930 4.7930 5.6025 5.6025 6.2637 6.2637 6.7943 6.7943 17.7350 17.7350 19.0966 19.0966 19.3224 19.3224 k = 0.3225-0.2952 0.7324 ( 900 PWs) bands (ev): 4.0907 4.0907 4.6939 4.6939 5.5014 5.5014 6.1871 6.1871 6.9906 6.9906 17.9532 17.9532 19.3164 19.3164 19.5135 19.5135 k = 0.3265-0.2989 0.7228 ( 904 PWs) bands (ev): 3.9872 3.9872 4.5954 4.5954 5.4027 5.4027 6.0976 6.0976 7.2073 7.2073 18.1735 18.1735 19.5388 19.5388 19.7056 19.7056 k = 0.3305-0.3026 0.7131 ( 902 PWs) bands (ev): 3.8860 3.8860 4.4983 4.4983 5.3065 5.3065 6.0050 6.0050 7.4337 7.4337 18.3957 18.3957 19.7636 19.7636 19.8988 19.8988 k = 0.3346-0.3063 0.7035 ( 902 PWs) bands (ev): 3.7873 3.7873 4.4030 4.4030 5.2127 5.2127 5.9124 5.9124 7.6663 7.6663 18.6199 18.6199 19.9908 19.9908 20.0930 20.0930 k = 0.3386-0.3100 0.6938 ( 902 PWs) bands (ev): 3.6911 3.6911 4.3098 4.3098 5.1214 5.1214 5.8211 5.8211 7.9035 7.9035 18.8459 18.8459 20.2201 20.2201 20.2883 20.2883 k = 0.3426-0.3137 0.6842 ( 904 PWs) bands (ev): 3.5974 3.5974 4.2187 4.2187 5.0326 5.0326 5.7316 5.7316 8.1446 8.1446 19.0737 19.0737 20.4501 20.4501 20.4859 20.4859 k = 0.3467-0.3174 0.6745 ( 904 PWs) bands (ev): 3.5064 3.5064 4.1300 4.1300 4.9464 4.9464 5.6443 5.6443 8.3889 8.3889 19.3030 19.3030 20.6703 20.6703 20.6962 20.6962 k = 0.3507-0.3211 0.6648 ( 904 PWs) bands (ev): 3.4180 3.4180 4.0437 4.0437 4.8626 4.8626 5.5592 5.5592 8.6363 8.6363 19.5339 19.5339 20.8715 20.8715 20.9281 20.9281 k = 0.3548-0.3248 0.6552 ( 905 PWs) bands (ev): 3.3323 3.3323 3.9599 3.9599 4.7815 4.7815 5.4767 5.4767 8.8866 8.8866 19.7662 19.7662 21.0695 21.0695 21.1657 21.1657 k = 0.3588-0.3285 0.6455 ( 907 PWs) bands (ev): 3.2492 3.2492 3.8786 3.8786 4.7029 4.7029 5.3966 5.3966 9.1396 9.1396 19.9998 19.9998 21.2671 21.2671 21.4057 21.4057 k = 0.3628-0.3322 0.6359 ( 907 PWs) bands (ev): 3.1689 3.1689 3.7999 3.7999 4.6269 4.6269 5.3191 5.3191 9.3952 9.3952 20.2344 20.2344 21.4646 21.4646 21.6477 21.6477 k = 0.3669-0.3359 0.6262 ( 905 PWs) bands (ev): 3.0913 3.0913 3.7239 3.7239 4.5535 4.5535 5.2441 5.2441 9.6533 9.6533 20.4699 20.4699 21.6620 21.6620 21.8913 21.8913 k = 0.3709-0.3396 0.6165 ( 901 PWs) bands (ev): 3.0164 3.0164 3.6504 3.6504 4.4826 4.4826 5.1719 5.1719 9.9138 9.9138 20.7061 20.7061 21.8591 21.8591 22.1362 22.1362 k = 0.3749-0.3433 0.6069 ( 900 PWs) bands (ev): 2.9443 2.9443 3.5797 3.5797 4.4144 4.4144 5.1022 5.1022 10.1767 10.1767 20.9427 20.9427 22.0558 22.0558 22.3822 22.3822 k = 0.3790-0.3470 0.5972 ( 900 PWs) bands (ev): 2.8749 2.8749 3.5116 3.5116 4.3488 4.3488 5.0352 5.0352 10.4419 10.4419 21.1793 21.1793 22.2516 22.2516 22.6288 22.6288 k = 0.3830-0.3506 0.5876 ( 904 PWs) bands (ev): 2.8083 2.8083 3.4462 3.4462 4.2859 4.2859 4.9709 4.9709 10.7094 10.7094 21.4155 21.4155 22.4460 22.4460 22.8756 22.8756 k = 0.3870-0.3543 0.5779 ( 904 PWs) bands (ev): 2.7445 2.7445 3.3835 3.3835 4.2256 4.2256 4.9093 4.9093 10.9791 10.9791 21.6504 21.6504 22.6381 22.6381 23.1221 23.1221 k = 0.3911-0.3580 0.5682 ( 908 PWs) bands (ev): 2.6834 2.6834 3.3235 3.3235 4.1679 4.1679 4.8504 4.8504 11.2509 11.2509 21.8829 21.8829 22.8256 22.8256 23.3674 23.3674 k = 0.3951-0.3617 0.5586 ( 906 PWs) bands (ev): 2.6252 2.6252 3.2663 3.2663 4.1128 4.1128 4.7942 4.7942 11.5249 11.5249 22.1104 22.1104 23.0017 23.0017 23.6104 23.6104 k = 0.3991-0.3654 0.5489 ( 908 PWs) bands (ev): 2.5698 2.5698 3.2118 3.2118 4.0605 4.0605 4.7407 4.7407 11.8010 11.8010 22.3258 22.3258 23.1321 23.1321 23.5449 23.5449 k = 0.4032-0.3691 0.5393 ( 906 PWs) bands (ev): 2.5171 2.5171 3.1601 3.1601 4.0107 4.0107 4.6899 4.6899 12.0791 12.0791 22.5025 22.5025 23.0985 23.0985 23.5300 23.5300 k = 0.4072-0.3728 0.5296 ( 908 PWs) bands (ev): 2.4673 2.4673 3.1111 3.1111 3.9637 3.9637 4.6419 4.6419 12.3592 12.3592 22.5305 22.5305 23.0511 23.0511 23.6711 23.6711 k = 0.4112-0.3765 0.5199 ( 910 PWs) bands (ev): 2.4203 2.4203 3.0649 3.0649 3.9193 3.9193 4.5966 4.5966 12.6412 12.6412 22.3435 22.3435 23.1810 23.1810 23.8430 23.8430 k = 0.4153-0.3802 0.5103 ( 910 PWs) bands (ev): 2.3761 2.3761 3.0215 3.0215 3.8776 3.8776 4.5540 4.5540 12.9252 12.9252 22.0761 22.0761 23.3783 23.3783 24.0205 24.0205 k = 0.4193-0.3839 0.5006 ( 908 PWs) bands (ev): 2.3347 2.3347 2.9809 2.9809 3.8385 3.8385 4.5141 4.5141 13.2109 13.2109 21.7857 21.7857 23.5908 23.5908 24.1980 24.1980 k = 0.4234-0.3876 0.4910 ( 910 PWs) bands (ev): 2.2962 2.2962 2.9430 2.9430 3.8022 3.8022 4.4770 4.4770 13.4984 13.4984 21.4858 21.4858 23.8062 23.8062 24.3730 24.3730 k = 0.4274-0.3913 0.4813 ( 910 PWs) bands (ev): 2.2605 2.2605 2.9079 2.9079 3.7685 3.7685 4.4426 4.4426 13.7875 13.7875 21.1812 21.1812 24.0202 24.0202 24.5443 24.5443 k = 0.4314-0.3950 0.4716 ( 910 PWs) bands (ev): 2.2277 2.2277 2.8756 2.8756 3.7375 3.7375 4.4110 4.4110 14.0782 14.0782 20.8739 20.8739 24.2306 24.2306 24.7109 24.7109 k = 0.4355-0.3987 0.4620 ( 915 PWs) bands (ev): 2.1977 2.1977 2.8461 2.8461 3.7092 3.7092 4.3821 4.3821 14.3704 14.3704 20.5651 20.5651 24.4356 24.4356 24.8717 24.8717 k = 0.4395-0.4024 0.4523 ( 915 PWs) bands (ev): 2.1705 2.1705 2.8194 2.8194 3.6836 3.6836 4.3559 4.3559 14.6638 14.6638 20.2556 20.2556 24.6337 24.6337 25.0262 25.0262 k = 0.4435-0.4061 0.4427 ( 917 PWs) bands (ev): 2.1462 2.1462 2.7956 2.7956 3.6606 3.6606 4.3325 4.3325 14.9582 14.9582 19.9460 19.9460 24.8226 24.8226 25.1740 25.1740 k = 0.4476-0.4098 0.4330 ( 917 PWs) bands (ev): 2.1248 2.1248 2.7745 2.7745 3.6404 3.6404 4.3119 4.3119 15.2535 15.2535 19.6369 19.6369 24.9995 24.9995 25.3138 25.3138 k = 0.4516-0.4135 0.4234 ( 915 PWs) bands (ev): 2.1062 2.1062 2.7562 2.7562 3.6229 3.6229 4.2940 4.2940 15.5489 15.5489 19.3290 19.3290 25.1603 25.1603 25.3319 25.3319 k = 0.4556-0.4171 0.4137 ( 914 PWs) bands (ev): 2.0905 2.0905 2.7407 2.7407 3.6080 3.6080 4.2788 4.2788 15.8439 15.8439 19.0234 19.0234 25.2989 25.2989 25.3378 25.3378 k = 0.4597-0.4208 0.4040 ( 913 PWs) bands (ev): 2.0776 2.0776 2.7281 2.7281 3.5959 3.5959 4.2664 4.2664 16.1367 16.1367 18.7216 18.7216 25.3380 25.3380 25.4155 25.4155 k = 0.4637-0.4245 0.3944 ( 913 PWs) bands (ev): 2.0676 2.0676 2.7182 2.7182 3.5864 3.5864 4.2568 4.2568 16.4243 16.4243 18.4269 18.4269 25.3396 25.3396 25.5022 25.5022 k = 0.4677-0.4282 0.3847 ( 911 PWs) bands (ev): 2.0604 2.0604 2.7112 2.7112 3.5797 3.5797 4.2499 4.2499 16.6985 16.6985 18.1476 18.1476 25.3403 25.3403 25.5629 25.5629 k = 0.4718-0.4319 0.3751 ( 911 PWs) bands (ev): 2.0561 2.0561 2.7070 2.7070 3.5756 3.5756 4.2458 4.2458 16.9335 16.9335 17.9096 17.9096 25.3405 25.3405 25.5987 25.5987 k = 0.4758-0.4356 0.3654 ( 911 PWs) bands (ev): 2.0547 2.0547 2.7056 2.7056 3.5743 3.5743 4.2444 4.2444 17.0435 17.0435 17.7986 17.7986 25.3406 25.3406 25.6105 25.6105 k = 0.5242 0.5240 0.0186 ( 911 PWs) bands (ev): 2.0547 2.0547 2.7056 2.7056 3.5743 3.5743 4.2444 4.2444 17.0435 17.0435 17.7986 17.7986 25.3406 25.3406 25.6105 25.6105 k = 0.5181 0.5295 0.0139 ( 911 PWs) bands (ev): 2.0475 2.0475 2.8372 2.8372 3.5675 3.5675 4.0999 4.0999 17.0379 17.0379 17.7932 17.7932 25.4040 25.4040 25.7815 25.7815 k = 0.5121 0.5351 0.0093 ( 913 PWs) bands (ev): 2.0423 2.0423 2.9536 2.9536 3.5627 3.5627 3.9743 3.9743 17.0339 17.0339 17.7893 17.7893 25.4525 25.4525 25.9394 25.9394 k = 0.5060 0.5406 0.0046 ( 912 PWs) bands (ev): 2.0392 2.0392 3.0398 3.0398 3.5598 3.5598 3.8826 3.8826 17.0315 17.0315 17.7870 17.7870 25.4830 25.4830 26.0730 26.0730 k = 0.5000 0.5461-0.0000 ( 912 PWs) bands (ev): 2.0382 2.0382 3.0731 3.0731 3.5588 3.5588 3.8475 3.8475 17.0307 17.0307 17.7862 17.7862 25.4934 25.4934 26.1352 26.1352 Writing output data file Si.save init_run : 0.07s CPU 0.20s WALL ( 1 calls) electrons : 34.55s CPU 35.92s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.00s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 34.54s CPU 35.91s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.02s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.01s WALL ( 575 calls) cegterg : 31.75s CPU 32.65s WALL ( 657 calls) Called by sum_band: Called by *egterg: h_psi : 15.12s CPU 15.16s WALL ( 9792 calls) s_psi : 0.81s CPU 0.83s WALL ( 9792 calls) g_psi : 0.03s CPU 0.03s WALL ( 8560 calls) cdiaghg : 15.08s CPU 15.81s WALL ( 9135 calls) cegterg:over : 0.90s CPU 0.94s WALL ( 8560 calls) cegterg:upda : 0.59s CPU 0.68s WALL ( 8560 calls) cegterg:last : 0.34s CPU 0.38s WALL ( 1900 calls) cdiaghg:chol : 0.74s CPU 0.90s WALL ( 9135 calls) cdiaghg:inve : 0.23s CPU 0.20s WALL ( 9135 calls) cdiaghg:para : 1.19s CPU 1.16s WALL ( 18270 calls) Called by h_psi: h_psi:vloc : 13.32s CPU 13.24s WALL ( 9792 calls) h_psi:vnl : 1.75s CPU 1.89s WALL ( 9792 calls) add_vuspsi : 0.98s CPU 1.07s WALL ( 9792 calls) General routines calbec : 0.74s CPU 0.80s WALL ( 9792 calls) fft : 0.00s CPU 0.00s WALL ( 15 calls) fftw : 12.80s CPU 12.66s WALL ( 374760 calls) davcio : 0.08s CPU 0.26s WALL ( 1150 calls) Parallel routines fft_scatter : 6.97s CPU 7.01s WALL ( 374775 calls) PWSCF : 0m42.62s CPU 1m26.29s WALL This run was terminated on: 21:17:32 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=