Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:16:26 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: ./BaMgxCO3x2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 88 53 15 2929 1387 210 Max 89 54 16 2932 1413 213 Sum 3189 1943 553 105487 50409 7617 bravais-lattice index = 14 lattice parameter (alat) = 11.9000 a.u. unit-cell volume = 823.9339 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 4 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.900013 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.682001 celldm(5)= 0.682001 celldm(6)= 0.682001 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.682001 0.731352 0.000000 ) a(3) = ( 0.682001 0.296541 0.668535 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.932521 -0.606505 ) b(2) = ( 0.000000 1.367331 -0.606505 ) b(3) = ( 0.000000 0.000000 1.495809 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Mg read from file: /users/gautes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1129 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Ba 10.00 137.32700 Ba( 1.00) Mg 10.00 24.30500 Mg( 1.00) C 4.00 12.01070 C( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 267 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 2) = ( 0.0131579 -0.0122700 -0.0079803), wk = 0.0037453 k( 3) = ( 0.0263158 -0.0245400 -0.0159607), wk = 0.0037453 k( 4) = ( 0.0394737 -0.0368100 -0.0239410), wk = 0.0037453 k( 5) = ( 0.0526316 -0.0490800 -0.0319213), wk = 0.0037453 k( 6) = ( 0.0657895 -0.0613501 -0.0399017), wk = 0.0037453 k( 7) = ( 0.0789474 -0.0736201 -0.0478820), wk = 0.0037453 k( 8) = ( 0.0921053 -0.0858901 -0.0558623), wk = 0.0037453 k( 9) = ( 0.1052632 -0.0981601 -0.0638427), wk = 0.0037453 k( 10) = ( 0.1184210 -0.1104301 -0.0718230), wk = 0.0037453 k( 11) = ( 0.1315790 -0.1227001 -0.0798034), wk = 0.0037453 k( 12) = ( 0.1447368 -0.1349701 -0.0877837), wk = 0.0037453 k( 13) = ( 0.1578947 -0.1472401 -0.0957640), wk = 0.0037453 k( 14) = ( 0.1710526 -0.1595102 -0.1037444), wk = 0.0037453 k( 15) = ( 0.1842105 -0.1717802 -0.1117247), wk = 0.0037453 k( 16) = ( 0.1973684 -0.1840502 -0.1197050), wk = 0.0037453 k( 17) = ( 0.2105263 -0.1963202 -0.1276854), wk = 0.0037453 k( 18) = ( 0.2236842 -0.2085902 -0.1356657), wk = 0.0037453 k( 19) = ( 0.2368421 -0.2208602 -0.1436460), wk = 0.0037453 k( 20) = ( 0.2500000 -0.2331302 -0.1516264), wk = 0.0037453 k( 21) = ( 0.2631579 -0.2454002 -0.1596067), wk = 0.0037453 k( 22) = ( 0.2763158 -0.2576702 -0.1675870), wk = 0.0037453 k( 23) = ( 0.2894737 -0.2699403 -0.1755674), wk = 0.0037453 k( 24) = ( 0.3026316 -0.2822103 -0.1835477), wk = 0.0037453 k( 25) = ( 0.3157895 -0.2944803 -0.1915280), wk = 0.0037453 k( 26) = ( 0.3289474 -0.3067503 -0.1995084), wk = 0.0037453 k( 27) = ( 0.3421053 -0.3190203 -0.2074887), wk = 0.0037453 k( 28) = ( 0.3552632 -0.3312903 -0.2154690), wk = 0.0037453 k( 29) = ( 0.3684211 -0.3435603 -0.2234494), wk = 0.0037453 k( 30) = ( 0.3815789 -0.3558303 -0.2314297), wk = 0.0037453 k( 31) = ( 0.3947368 -0.3681004 -0.2394101), wk = 0.0037453 k( 32) = ( 0.4078947 -0.3803704 -0.2473904), wk = 0.0037453 k( 33) = ( 0.4210526 -0.3926404 -0.2553707), wk = 0.0037453 k( 34) = ( 0.4342105 -0.4049104 -0.2633511), wk = 0.0037453 k( 35) = ( 0.4473684 -0.4171804 -0.2713314), wk = 0.0037453 k( 36) = ( 0.4605263 -0.4294504 -0.2793117), wk = 0.0037453 k( 37) = ( 0.4736842 -0.4417204 -0.2872921), wk = 0.0037453 k( 38) = ( 0.4868421 -0.4539904 -0.2952724), wk = 0.0037453 k( 39) = ( 0.5000000 -0.4662604 -0.3032527), wk = 0.0037453 k( 40) = ( 0.5000000 -0.4662604 -0.3032527), wk = 0.0037453 k( 41) = ( 0.5000000 -0.4555494 -0.3197213), wk = 0.0037453 k( 42) = ( 0.5000000 -0.4448383 -0.3361899), wk = 0.0037453 k( 43) = ( 0.5000000 -0.4341273 -0.3526585), wk = 0.0037453 k( 44) = ( 0.5000000 -0.4234162 -0.3691270), wk = 0.0037453 k( 45) = ( 0.5000000 -0.4127052 -0.3855956), wk = 0.0037453 k( 46) = ( 0.5000000 -0.4019941 -0.4020642), wk = 0.0037453 k( 47) = ( 0.5000000 -0.3912830 -0.4185328), wk = 0.0037453 k( 48) = ( 0.5000000 -0.3805720 -0.4350014), wk = 0.0037453 k( 49) = ( 0.5000000 -0.3698609 -0.4514700), wk = 0.0037453 k( 50) = ( 0.5000000 -0.3591499 -0.4679385), wk = 0.0037453 k( 51) = ( 0.5000000 -0.3484388 -0.4844071), wk = 0.0037453 k( 52) = ( 0.5000000 -0.3377278 -0.5008757), wk = 0.0037453 k( 53) = ( 0.5000000 -0.3270167 -0.5173443), wk = 0.0037453 k( 54) = ( 0.5000000 -0.3163056 -0.5338129), wk = 0.0037453 k( 55) = ( 0.5000000 -0.3055946 -0.5502815), wk = 0.0037453 k( 56) = ( 0.5000000 -0.2948835 -0.5667500), wk = 0.0037453 k( 57) = ( 0.5000000 -0.2841725 -0.5832186), wk = 0.0037453 k( 58) = ( 0.5000000 -0.2734614 -0.5996872), wk = 0.0037453 k( 59) = ( 0.5000000 -0.2627504 -0.6161558), wk = 0.0037453 k( 60) = ( 0.5000000 -0.2520393 -0.6326244), wk = 0.0037453 k( 61) = ( 0.5000000 -0.2413282 -0.6490929), wk = 0.0037453 k( 62) = ( 0.5000000 -0.2306172 -0.6655615), wk = 0.0037453 k( 63) = ( 0.5000000 -0.2199061 -0.6820301), wk = 0.0037453 k( 64) = ( 0.5000000 -0.2091951 -0.6984987), wk = 0.0037453 k( 65) = ( 0.5000000 -0.1984840 -0.7149673), wk = 0.0037453 k( 66) = ( 0.5000000 -0.1877730 -0.7314358), wk = 0.0037453 k( 67) = ( 0.5000000 -0.1770619 -0.7479044), wk = 0.0037453 k( 68) = ( 0.7884942 -0.0516216 -0.4651065), wk = 0.0037453 k( 69) = ( 0.7806971 -0.0443506 -0.4487145), wk = 0.0037453 k( 70) = ( 0.7728999 -0.0370796 -0.4323224), wk = 0.0037453 k( 71) = ( 0.7651028 -0.0298086 -0.4159304), wk = 0.0037453 k( 72) = ( 0.7573056 -0.0225376 -0.3995384), wk = 0.0037453 k( 73) = ( 0.7495085 -0.0152666 -0.3831463), wk = 0.0037453 k( 74) = ( 0.7417113 -0.0079956 -0.3667543), wk = 0.0037453 k( 75) = ( 0.7339142 -0.0007246 -0.3503622), wk = 0.0037453 k( 76) = ( 0.7261171 0.0065464 -0.3339702), wk = 0.0037453 k( 77) = ( 0.7183199 0.0138174 -0.3175782), wk = 0.0037453 k( 78) = ( 0.7105228 0.0210884 -0.3011861), wk = 0.0037453 k( 79) = ( 0.7027256 0.0283594 -0.2847941), wk = 0.0037453 k( 80) = ( 0.6949285 0.0356304 -0.2684020), wk = 0.0037453 k( 81) = ( 0.6871314 0.0429014 -0.2520100), wk = 0.0037453 k( 82) = ( 0.6793342 0.0501723 -0.2356180), wk = 0.0037453 k( 83) = ( 0.6715371 0.0574433 -0.2192259), wk = 0.0037453 k( 84) = ( 0.6637399 0.0647143 -0.2028339), wk = 0.0037453 k( 85) = ( 0.6559428 0.0719853 -0.1864418), wk = 0.0037453 k( 86) = ( 0.6481457 0.0792563 -0.1700498), wk = 0.0037453 k( 87) = ( 0.6403485 0.0865273 -0.1536578), wk = 0.0037453 k( 88) = ( 0.6325514 0.0937983 -0.1372657), wk = 0.0037453 k( 89) = ( 0.6247542 0.1010693 -0.1208737), wk = 0.0037453 k( 90) = ( 0.6169571 0.1083403 -0.1044816), wk = 0.0037453 k( 91) = ( 0.6091600 0.1156113 -0.0880896), wk = 0.0037453 k( 92) = ( 0.6013628 0.1228823 -0.0716976), wk = 0.0037453 k( 93) = ( 0.5935657 0.1301533 -0.0553055), wk = 0.0037453 k( 94) = ( 0.5857685 0.1374243 -0.0389135), wk = 0.0037453 k( 95) = ( 0.5779714 0.1446953 -0.0225214), wk = 0.0037453 k( 96) = ( 0.5701743 0.1519663 -0.0061294), wk = 0.0037453 k( 97) = ( 0.5623771 0.1592373 0.0102626), wk = 0.0037453 k( 98) = ( 0.5545800 0.1665083 0.0266547), wk = 0.0037453 k( 99) = ( 0.5467828 0.1737793 0.0430467), wk = 0.0037453 k( 100) = ( 0.5389857 0.1810503 0.0594388), wk = 0.0037453 k( 101) = ( 0.5311886 0.1883213 0.0758308), wk = 0.0037453 k( 102) = ( 0.5233914 0.1955923 0.0922228), wk = 0.0037453 k( 103) = ( 0.5155943 0.2028633 0.1086149), wk = 0.0037453 k( 104) = ( 0.5077971 0.2101343 0.1250069), wk = 0.0037453 k( 105) = ( 0.5000000 0.2174053 0.1413990), wk = 0.0037453 k( 106) = ( 0.5000000 0.2174053 0.1413990), wk = 0.0037453 k( 107) = ( 0.4827586 0.2099085 0.1365231), wk = 0.0037453 k( 108) = ( 0.4655172 0.2024118 0.1316473), wk = 0.0037453 k( 109) = ( 0.4482759 0.1949151 0.1267715), wk = 0.0037453 k( 110) = ( 0.4310345 0.1874183 0.1218957), wk = 0.0037453 k( 111) = ( 0.4137931 0.1799216 0.1170198), wk = 0.0037453 k( 112) = ( 0.3965517 0.1724249 0.1121440), wk = 0.0037453 k( 113) = ( 0.3793103 0.1649281 0.1072682), wk = 0.0037453 k( 114) = ( 0.3620690 0.1574314 0.1023923), wk = 0.0037453 k( 115) = ( 0.3448276 0.1499347 0.0975165), wk = 0.0037453 k( 116) = ( 0.3275862 0.1424379 0.0926407), wk = 0.0037453 k( 117) = ( 0.3103448 0.1349412 0.0877649), wk = 0.0037453 k( 118) = ( 0.2931034 0.1274445 0.0828890), wk = 0.0037453 k( 119) = ( 0.2758621 0.1199477 0.0780132), wk = 0.0037453 k( 120) = ( 0.2586207 0.1124510 0.0731374), wk = 0.0037453 k( 121) = ( 0.2413793 0.1049543 0.0682616), wk = 0.0037453 k( 122) = ( 0.2241379 0.0974575 0.0633857), wk = 0.0037453 k( 123) = ( 0.2068966 0.0899608 0.0585099), wk = 0.0037453 k( 124) = ( 0.1896552 0.0824641 0.0536341), wk = 0.0037453 k( 125) = ( 0.1724138 0.0749673 0.0487583), wk = 0.0037453 k( 126) = ( 0.1551724 0.0674706 0.0438824), wk = 0.0037453 k( 127) = ( 0.1379310 0.0599739 0.0390066), wk = 0.0037453 k( 128) = ( 0.1206897 0.0524771 0.0341308), wk = 0.0037453 k( 129) = ( 0.1034483 0.0449804 0.0292550), wk = 0.0037453 k( 130) = ( 0.0862069 0.0374837 0.0243791), wk = 0.0037453 k( 131) = ( 0.0689655 0.0299869 0.0195033), wk = 0.0037453 k( 132) = ( 0.0517241 0.0224902 0.0146275), wk = 0.0037453 k( 133) = ( 0.0344828 0.0149935 0.0097517), wk = 0.0037453 k( 134) = ( 0.0172414 0.0074967 0.0048758), wk = 0.0037453 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 137) = ( 0.0079056 -0.0073722 -0.0166201), wk = 0.0037453 k( 138) = ( 0.0158112 -0.0147443 -0.0332402), wk = 0.0037453 k( 139) = ( 0.0237169 -0.0221165 -0.0498603), wk = 0.0037453 k( 140) = ( 0.0316225 -0.0294886 -0.0664804), wk = 0.0037453 k( 141) = ( 0.0395281 -0.0368608 -0.0831005), wk = 0.0037453 k( 142) = ( 0.0474337 -0.0442329 -0.0997206), wk = 0.0037453 k( 143) = ( 0.0553393 -0.0516051 -0.1163407), wk = 0.0037453 k( 144) = ( 0.0632450 -0.0589772 -0.1329608), wk = 0.0037453 k( 145) = ( 0.0711506 -0.0663494 -0.1495809), wk = 0.0037453 k( 146) = ( 0.0790562 -0.0737216 -0.1662010), wk = 0.0037453 k( 147) = ( 0.0869618 -0.0810937 -0.1828211), wk = 0.0037453 k( 148) = ( 0.0948674 -0.0884659 -0.1994412), wk = 0.0037453 k( 149) = ( 0.1027731 -0.0958380 -0.2160613), wk = 0.0037453 k( 150) = ( 0.1106787 -0.1032102 -0.2326814), wk = 0.0037453 k( 151) = ( 0.1185843 -0.1105823 -0.2493015), wk = 0.0037453 k( 152) = ( 0.1264899 -0.1179545 -0.2659216), wk = 0.0037453 k( 153) = ( 0.1343955 -0.1253266 -0.2825417), wk = 0.0037453 k( 154) = ( 0.1423012 -0.1326988 -0.2991618), wk = 0.0037453 k( 155) = ( 0.1502068 -0.1400710 -0.3157819), wk = 0.0037453 k( 156) = ( 0.1581124 -0.1474431 -0.3324020), wk = 0.0037453 k( 157) = ( 0.1660180 -0.1548153 -0.3490221), wk = 0.0037453 k( 158) = ( 0.1739236 -0.1621874 -0.3656422), wk = 0.0037453 k( 159) = ( 0.1818293 -0.1695596 -0.3822623), wk = 0.0037453 k( 160) = ( 0.1897349 -0.1769317 -0.3988824), wk = 0.0037453 k( 161) = ( 0.1976405 -0.1843039 -0.4155025), wk = 0.0037453 k( 162) = ( 0.2055461 -0.1916761 -0.4321226), wk = 0.0037453 k( 163) = ( 0.2134517 -0.1990482 -0.4487426), wk = 0.0037453 k( 164) = ( 0.2213574 -0.2064204 -0.4653627), wk = 0.0037453 k( 165) = ( 0.2292630 -0.2137925 -0.4819828), wk = 0.0037453 k( 166) = ( 0.2371686 -0.2211647 -0.4986029), wk = 0.0037453 k( 167) = ( 0.2450742 -0.2285368 -0.5152230), wk = 0.0037453 k( 168) = ( 0.2529798 -0.2359090 -0.5318431), wk = 0.0037453 k( 169) = ( 0.2608855 -0.2432811 -0.5484632), wk = 0.0037453 k( 170) = ( 0.2687911 -0.2506533 -0.5650833), wk = 0.0037453 k( 171) = ( 0.2766967 -0.2580255 -0.5817034), wk = 0.0037453 k( 172) = ( 0.2846023 -0.2653976 -0.5983235), wk = 0.0037453 k( 173) = ( 0.2925079 -0.2727698 -0.6149436), wk = 0.0037453 k( 174) = ( 0.3004136 -0.2801419 -0.6315637), wk = 0.0037453 k( 175) = ( 0.3083192 -0.2875141 -0.6481838), wk = 0.0037453 k( 176) = ( 0.3162248 -0.2948862 -0.6648039), wk = 0.0037453 k( 177) = ( 0.3241304 -0.3022584 -0.6814240), wk = 0.0037453 k( 178) = ( 0.3320360 -0.3096305 -0.6980441), wk = 0.0037453 k( 179) = ( 0.3399417 -0.3170027 -0.7146642), wk = 0.0037453 k( 180) = ( 0.3478473 -0.3243749 -0.7312843), wk = 0.0037453 k( 181) = ( 0.3557529 -0.3317470 -0.7479044), wk = 0.0037453 k( 182) = ( 0.6442471 -0.1143418 -0.6065055), wk = 0.0037453 k( 183) = ( 0.6366551 -0.0968814 -0.6065055), wk = 0.0037453 k( 184) = ( 0.6290632 -0.0794210 -0.6065055), wk = 0.0037453 k( 185) = ( 0.6214712 -0.0619606 -0.6065055), wk = 0.0037453 k( 186) = ( 0.6138793 -0.0445003 -0.6065055), wk = 0.0037453 k( 187) = ( 0.6062873 -0.0270399 -0.6065055), wk = 0.0037453 k( 188) = ( 0.5986954 -0.0095795 -0.6065055), wk = 0.0037453 k( 189) = ( 0.5911034 0.0078808 -0.6065055), wk = 0.0037453 k( 190) = ( 0.5835115 0.0253412 -0.6065055), wk = 0.0037453 k( 191) = ( 0.5759195 0.0428016 -0.6065055), wk = 0.0037453 k( 192) = ( 0.5683276 0.0602619 -0.6065055), wk = 0.0037453 k( 193) = ( 0.5607356 0.0777223 -0.6065055), wk = 0.0037453 k( 194) = ( 0.5531437 0.0951827 -0.6065055), wk = 0.0037453 k( 195) = ( 0.5455517 0.1126431 -0.6065055), wk = 0.0037453 k( 196) = ( 0.5379598 0.1301034 -0.6065055), wk = 0.0037453 k( 197) = ( 0.5303678 0.1475638 -0.6065055), wk = 0.0037453 k( 198) = ( 0.5227759 0.1650241 -0.6065055), wk = 0.0037453 k( 199) = ( 0.5151839 0.1824845 -0.6065055), wk = 0.0037453 k( 200) = ( 0.5075920 0.1999449 -0.6065055), wk = 0.0037453 k( 201) = ( 0.5000000 0.2174053 -0.6065055), wk = 0.0037453 k( 202) = ( 0.5000000 0.2174053 -0.6065055), wk = 0.0037453 k( 203) = ( 0.5131134 0.2231071 -0.5936510), wk = 0.0037453 k( 204) = ( 0.5262267 0.2288089 -0.5807966), wk = 0.0037453 k( 205) = ( 0.5393401 0.2345108 -0.5679421), wk = 0.0037453 k( 206) = ( 0.5524535 0.2402126 -0.5550877), wk = 0.0037453 k( 207) = ( 0.5655669 0.2459144 -0.5422332), wk = 0.0037453 k( 208) = ( 0.5786802 0.2516163 -0.5293788), wk = 0.0037453 k( 209) = ( 0.5917936 0.2573181 -0.5165243), wk = 0.0037453 k( 210) = ( 0.6049070 0.2630199 -0.5036699), wk = 0.0037453 k( 211) = ( 0.6180203 0.2687218 -0.4908154), wk = 0.0037453 k( 212) = ( 0.6311337 0.2744236 -0.4779610), wk = 0.0037453 k( 213) = ( 0.6442471 0.2801254 -0.4651065), wk = 0.0037453 k( 214) = ( 0.6442471 0.2801254 -0.4651065), wk = 0.0037453 k( 215) = ( 0.6397394 0.2781654 -0.4461532), wk = 0.0037453 k( 216) = ( 0.6352317 0.2762054 -0.4271999), wk = 0.0037453 k( 217) = ( 0.6307239 0.2742454 -0.4082466), wk = 0.0037453 k( 218) = ( 0.6262162 0.2722854 -0.3892933), wk = 0.0037453 k( 219) = ( 0.6217085 0.2703254 -0.3703400), wk = 0.0037453 k( 220) = ( 0.6172008 0.2683654 -0.3513867), wk = 0.0037453 k( 221) = ( 0.6126930 0.2664054 -0.3324334), wk = 0.0037453 k( 222) = ( 0.6081853 0.2644454 -0.3134801), wk = 0.0037453 k( 223) = ( 0.6036776 0.2624854 -0.2945268), wk = 0.0037453 k( 224) = ( 0.5991699 0.2605254 -0.2755736), wk = 0.0037453 k( 225) = ( 0.5946622 0.2585654 -0.2566203), wk = 0.0037453 k( 226) = ( 0.5901544 0.2566054 -0.2376670), wk = 0.0037453 k( 227) = ( 0.5856467 0.2546454 -0.2187137), wk = 0.0037453 k( 228) = ( 0.5811390 0.2526854 -0.1997604), wk = 0.0037453 k( 229) = ( 0.5766313 0.2507253 -0.1808071), wk = 0.0037453 k( 230) = ( 0.5721236 0.2487653 -0.1618538), wk = 0.0037453 k( 231) = ( 0.5676158 0.2468053 -0.1429005), wk = 0.0037453 k( 232) = ( 0.5631081 0.2448453 -0.1239472), wk = 0.0037453 k( 233) = ( 0.5586004 0.2428853 -0.1049939), wk = 0.0037453 k( 234) = ( 0.5540927 0.2409253 -0.0860406), wk = 0.0037453 k( 235) = ( 0.5495849 0.2389653 -0.0670873), wk = 0.0037453 k( 236) = ( 0.5450772 0.2370053 -0.0481340), wk = 0.0037453 k( 237) = ( 0.5405695 0.2350453 -0.0291807), wk = 0.0037453 k( 238) = ( 0.5360618 0.2330853 -0.0102274), wk = 0.0037453 k( 239) = ( 0.5315541 0.2311253 0.0087259), wk = 0.0037453 k( 240) = ( 0.5270463 0.2291653 0.0276792), wk = 0.0037453 k( 241) = ( 0.5225386 0.2272053 0.0466325), wk = 0.0037453 k( 242) = ( 0.5180309 0.2252453 0.0655858), wk = 0.0037453 k( 243) = ( 0.5135232 0.2232853 0.0845391), wk = 0.0037453 k( 244) = ( 0.5090154 0.2213253 0.1034924), wk = 0.0037453 k( 245) = ( 0.5045077 0.2193653 0.1224457), wk = 0.0037453 k( 246) = ( 0.5000000 0.2174053 0.1413990), wk = 0.0037453 k( 247) = ( 0.5000000 -0.4662604 -0.3032527), wk = 0.0037453 k( 248) = ( 0.5144247 -0.4553902 -0.2961828), wk = 0.0037453 k( 249) = ( 0.5288494 -0.4445199 -0.2891128), wk = 0.0037453 k( 250) = ( 0.5432741 -0.4336497 -0.2820429), wk = 0.0037453 k( 251) = ( 0.5576988 -0.4227794 -0.2749729), wk = 0.0037453 k( 252) = ( 0.5721236 -0.4119091 -0.2679030), wk = 0.0037453 k( 253) = ( 0.5865483 -0.4010389 -0.2608330), wk = 0.0037453 k( 254) = ( 0.6009730 -0.3901686 -0.2537631), wk = 0.0037453 k( 255) = ( 0.6153977 -0.3792983 -0.2466932), wk = 0.0037453 k( 256) = ( 0.6298224 -0.3684281 -0.2396232), wk = 0.0037453 k( 257) = ( 0.6442471 -0.3575578 -0.2325533), wk = 0.0037453 k( 258) = ( 0.6586718 -0.3466876 -0.2254833), wk = 0.0037453 k( 259) = ( 0.6730965 -0.3358173 -0.2184134), wk = 0.0037453 k( 260) = ( 0.6875212 -0.3249470 -0.2113434), wk = 0.0037453 k( 261) = ( 0.7019459 -0.3140768 -0.2042735), wk = 0.0037453 k( 262) = ( 0.7163706 -0.3032065 -0.1972035), wk = 0.0037453 k( 263) = ( 0.7307953 -0.2923362 -0.1901336), wk = 0.0037453 k( 264) = ( 0.7452201 -0.2814660 -0.1830636), wk = 0.0037453 k( 265) = ( 0.7596448 -0.2705957 -0.1759937), wk = 0.0037453 k( 266) = ( 0.7740695 -0.2597254 -0.1689237), wk = 0.0037453 k( 267) = ( 0.7884942 -0.2488552 -0.1618538), wk = 0.0037453 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 2) = ( 0.0131579 -0.0000000 0.0000000), wk = 0.0037453 k( 3) = ( 0.0263158 -0.0000000 -0.0000000), wk = 0.0037453 k( 4) = ( 0.0394737 -0.0000000 -0.0000000), wk = 0.0037453 k( 5) = ( 0.0526316 -0.0000000 -0.0000000), wk = 0.0037453 k( 6) = ( 0.0657895 -0.0000000 -0.0000000), wk = 0.0037453 k( 7) = ( 0.0789474 -0.0000000 0.0000000), wk = 0.0037453 k( 8) = ( 0.0921053 0.0000000 0.0000000), wk = 0.0037453 k( 9) = ( 0.1052632 -0.0000000 -0.0000000), wk = 0.0037453 k( 10) = ( 0.1184210 -0.0000000 -0.0000000), wk = 0.0037453 k( 11) = ( 0.1315790 0.0000000 0.0000000), wk = 0.0037453 k( 12) = ( 0.1447368 -0.0000000 0.0000000), wk = 0.0037453 k( 13) = ( 0.1578947 -0.0000000 0.0000000), wk = 0.0037453 k( 14) = ( 0.1710526 -0.0000000 -0.0000000), wk = 0.0037453 k( 15) = ( 0.1842105 0.0000000 -0.0000000), wk = 0.0037453 k( 16) = ( 0.1973684 -0.0000000 -0.0000000), wk = 0.0037453 k( 17) = ( 0.2105263 -0.0000000 -0.0000000), wk = 0.0037453 k( 18) = ( 0.2236842 0.0000000 -0.0000000), wk = 0.0037453 k( 19) = ( 0.2368421 -0.0000000 0.0000000), wk = 0.0037453 k( 20) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0037453 k( 21) = ( 0.2631579 -0.0000000 -0.0000000), wk = 0.0037453 k( 22) = ( 0.2763158 -0.0000000 0.0000000), wk = 0.0037453 k( 23) = ( 0.2894737 -0.0000000 0.0000000), wk = 0.0037453 k( 24) = ( 0.3026316 -0.0000000 -0.0000000), wk = 0.0037453 k( 25) = ( 0.3157895 -0.0000000 0.0000000), wk = 0.0037453 k( 26) = ( 0.3289474 -0.0000000 -0.0000000), wk = 0.0037453 k( 27) = ( 0.3421053 -0.0000000 -0.0000000), wk = 0.0037453 k( 28) = ( 0.3552632 -0.0000000 -0.0000000), wk = 0.0037453 k( 29) = ( 0.3684211 -0.0000000 -0.0000000), wk = 0.0037453 k( 30) = ( 0.3815789 -0.0000000 -0.0000000), wk = 0.0037453 k( 31) = ( 0.3947368 -0.0000000 -0.0000000), wk = 0.0037453 k( 32) = ( 0.4078947 -0.0000000 -0.0000000), wk = 0.0037453 k( 33) = ( 0.4210526 -0.0000000 0.0000000), wk = 0.0037453 k( 34) = ( 0.4342105 -0.0000000 -0.0000000), wk = 0.0037453 k( 35) = ( 0.4473684 0.0000000 -0.0000000), wk = 0.0037453 k( 36) = ( 0.4605263 0.0000000 0.0000000), wk = 0.0037453 k( 37) = ( 0.4736842 -0.0000000 0.0000000), wk = 0.0037453 k( 38) = ( 0.4868421 -0.0000000 -0.0000000), wk = 0.0037453 k( 39) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037453 k( 40) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037453 k( 41) = ( 0.5000000 0.0078335 -0.0078336), wk = 0.0037453 k( 42) = ( 0.5000000 0.0156671 -0.0156671), wk = 0.0037453 k( 43) = ( 0.5000000 0.0235006 -0.0235007), wk = 0.0037453 k( 44) = ( 0.5000000 0.0313342 -0.0313342), wk = 0.0037453 k( 45) = ( 0.5000000 0.0391677 -0.0391677), wk = 0.0037453 k( 46) = ( 0.5000000 0.0470013 -0.0470013), wk = 0.0037453 k( 47) = ( 0.5000000 0.0548348 -0.0548348), wk = 0.0037453 k( 48) = ( 0.5000000 0.0626684 -0.0626684), wk = 0.0037453 k( 49) = ( 0.5000000 0.0705019 -0.0705019), wk = 0.0037453 k( 50) = ( 0.5000000 0.0783355 -0.0783355), wk = 0.0037453 k( 51) = ( 0.5000000 0.0861690 -0.0861690), wk = 0.0037453 k( 52) = ( 0.5000000 0.0940026 -0.0940026), wk = 0.0037453 k( 53) = ( 0.5000000 0.1018361 -0.1018361), wk = 0.0037453 k( 54) = ( 0.5000000 0.1096697 -0.1096697), wk = 0.0037453 k( 55) = ( 0.5000000 0.1175032 -0.1175032), wk = 0.0037453 k( 56) = ( 0.5000000 0.1253368 -0.1253368), wk = 0.0037453 k( 57) = ( 0.5000000 0.1331703 -0.1331703), wk = 0.0037453 k( 58) = ( 0.5000000 0.1410039 -0.1410039), wk = 0.0037453 k( 59) = ( 0.5000000 0.1488374 -0.1488374), wk = 0.0037453 k( 60) = ( 0.5000000 0.1566710 -0.1566710), wk = 0.0037453 k( 61) = ( 0.5000000 0.1645045 -0.1645045), wk = 0.0037453 k( 62) = ( 0.5000000 0.1723381 -0.1723381), wk = 0.0037453 k( 63) = ( 0.5000000 0.1801716 -0.1801716), wk = 0.0037453 k( 64) = ( 0.5000000 0.1880052 -0.1880052), wk = 0.0037453 k( 65) = ( 0.5000000 0.1958387 -0.1958387), wk = 0.0037453 k( 66) = ( 0.5000000 0.2036723 -0.2036723), wk = 0.0037453 k( 67) = ( 0.5000000 0.2115058 -0.2115058), wk = 0.0037453 k( 68) = ( 0.7884942 0.5000000 0.2115058), wk = 0.0037453 k( 69) = ( 0.7806971 0.5000000 0.2193029), wk = 0.0037453 k( 70) = ( 0.7728999 0.5000000 0.2271001), wk = 0.0037453 k( 71) = ( 0.7651028 0.5000000 0.2348972), wk = 0.0037453 k( 72) = ( 0.7573056 0.5000000 0.2426944), wk = 0.0037453 k( 73) = ( 0.7495085 0.5000000 0.2504915), wk = 0.0037453 k( 74) = ( 0.7417113 0.5000000 0.2582887), wk = 0.0037453 k( 75) = ( 0.7339142 0.5000000 0.2660858), wk = 0.0037453 k( 76) = ( 0.7261171 0.5000000 0.2738829), wk = 0.0037453 k( 77) = ( 0.7183199 0.5000000 0.2816801), wk = 0.0037453 k( 78) = ( 0.7105228 0.5000000 0.2894772), wk = 0.0037453 k( 79) = ( 0.7027256 0.5000000 0.2972744), wk = 0.0037453 k( 80) = ( 0.6949285 0.5000000 0.3050715), wk = 0.0037453 k( 81) = ( 0.6871314 0.5000000 0.3128686), wk = 0.0037453 k( 82) = ( 0.6793342 0.5000000 0.3206658), wk = 0.0037453 k( 83) = ( 0.6715371 0.5000000 0.3284629), wk = 0.0037453 k( 84) = ( 0.6637399 0.5000000 0.3362600), wk = 0.0037453 k( 85) = ( 0.6559428 0.5000000 0.3440572), wk = 0.0037453 k( 86) = ( 0.6481457 0.5000000 0.3518543), wk = 0.0037453 k( 87) = ( 0.6403485 0.5000000 0.3596515), wk = 0.0037453 k( 88) = ( 0.6325514 0.5000000 0.3674486), wk = 0.0037453 k( 89) = ( 0.6247542 0.5000000 0.3752458), wk = 0.0037453 k( 90) = ( 0.6169571 0.5000000 0.3830429), wk = 0.0037453 k( 91) = ( 0.6091600 0.5000000 0.3908400), wk = 0.0037453 k( 92) = ( 0.6013628 0.5000000 0.3986372), wk = 0.0037453 k( 93) = ( 0.5935657 0.5000000 0.4064343), wk = 0.0037453 k( 94) = ( 0.5857685 0.5000000 0.4142315), wk = 0.0037453 k( 95) = ( 0.5779714 0.5000000 0.4220286), wk = 0.0037453 k( 96) = ( 0.5701743 0.5000000 0.4298257), wk = 0.0037453 k( 97) = ( 0.5623771 0.5000000 0.4376229), wk = 0.0037453 k( 98) = ( 0.5545800 0.5000000 0.4454200), wk = 0.0037453 k( 99) = ( 0.5467828 0.5000000 0.4532172), wk = 0.0037453 k( 100) = ( 0.5389857 0.5000000 0.4610143), wk = 0.0037453 k( 101) = ( 0.5311886 0.5000000 0.4688114), wk = 0.0037453 k( 102) = ( 0.5233914 0.5000000 0.4766086), wk = 0.0037453 k( 103) = ( 0.5155943 0.5000000 0.4844057), wk = 0.0037453 k( 104) = ( 0.5077971 0.5000000 0.4922029), wk = 0.0037453 k( 105) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 106) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 107) = ( 0.4827586 0.4827586 0.4827586), wk = 0.0037453 k( 108) = ( 0.4655172 0.4655172 0.4655172), wk = 0.0037453 k( 109) = ( 0.4482759 0.4482759 0.4482759), wk = 0.0037453 k( 110) = ( 0.4310345 0.4310345 0.4310345), wk = 0.0037453 k( 111) = ( 0.4137931 0.4137931 0.4137931), wk = 0.0037453 k( 112) = ( 0.3965517 0.3965517 0.3965517), wk = 0.0037453 k( 113) = ( 0.3793103 0.3793103 0.3793103), wk = 0.0037453 k( 114) = ( 0.3620690 0.3620690 0.3620690), wk = 0.0037453 k( 115) = ( 0.3448276 0.3448276 0.3448276), wk = 0.0037453 k( 116) = ( 0.3275862 0.3275862 0.3275862), wk = 0.0037453 k( 117) = ( 0.3103448 0.3103448 0.3103448), wk = 0.0037453 k( 118) = ( 0.2931034 0.2931034 0.2931034), wk = 0.0037453 k( 119) = ( 0.2758621 0.2758621 0.2758621), wk = 0.0037453 k( 120) = ( 0.2586207 0.2586207 0.2586207), wk = 0.0037453 k( 121) = ( 0.2413793 0.2413793 0.2413793), wk = 0.0037453 k( 122) = ( 0.2241379 0.2241379 0.2241379), wk = 0.0037453 k( 123) = ( 0.2068966 0.2068966 0.2068966), wk = 0.0037453 k( 124) = ( 0.1896552 0.1896552 0.1896552), wk = 0.0037453 k( 125) = ( 0.1724138 0.1724138 0.1724138), wk = 0.0037453 k( 126) = ( 0.1551724 0.1551724 0.1551724), wk = 0.0037453 k( 127) = ( 0.1379310 0.1379310 0.1379310), wk = 0.0037453 k( 128) = ( 0.1206897 0.1206897 0.1206897), wk = 0.0037453 k( 129) = ( 0.1034483 0.1034483 0.1034483), wk = 0.0037453 k( 130) = ( 0.0862069 0.0862069 0.0862069), wk = 0.0037453 k( 131) = ( 0.0689655 0.0689655 0.0689655), wk = 0.0037453 k( 132) = ( 0.0517241 0.0517241 0.0517241), wk = 0.0037453 k( 133) = ( 0.0344828 0.0344828 0.0344828), wk = 0.0037453 k( 134) = ( 0.0172414 0.0172414 0.0172414), wk = 0.0037453 k( 135) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 136) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037453 k( 137) = ( 0.0079056 -0.0000000 -0.0079056), wk = 0.0037453 k( 138) = ( 0.0158112 -0.0000000 -0.0158112), wk = 0.0037453 k( 139) = ( 0.0237169 -0.0000000 -0.0237169), wk = 0.0037453 k( 140) = ( 0.0316225 -0.0000000 -0.0316225), wk = 0.0037453 k( 141) = ( 0.0395281 -0.0000000 -0.0395281), wk = 0.0037453 k( 142) = ( 0.0474337 -0.0000000 -0.0474337), wk = 0.0037453 k( 143) = ( 0.0553393 -0.0000000 -0.0553393), wk = 0.0037453 k( 144) = ( 0.0632450 -0.0000000 -0.0632450), wk = 0.0037453 k( 145) = ( 0.0711506 -0.0000000 -0.0711506), wk = 0.0037453 k( 146) = ( 0.0790562 -0.0000000 -0.0790562), wk = 0.0037453 k( 147) = ( 0.0869618 -0.0000000 -0.0869618), wk = 0.0037453 k( 148) = ( 0.0948674 -0.0000000 -0.0948674), wk = 0.0037453 k( 149) = ( 0.1027731 -0.0000000 -0.1027731), wk = 0.0037453 k( 150) = ( 0.1106787 -0.0000000 -0.1106787), wk = 0.0037453 k( 151) = ( 0.1185843 -0.0000000 -0.1185843), wk = 0.0037453 k( 152) = ( 0.1264899 -0.0000000 -0.1264899), wk = 0.0037453 k( 153) = ( 0.1343955 -0.0000000 -0.1343955), wk = 0.0037453 k( 154) = ( 0.1423012 -0.0000000 -0.1423012), wk = 0.0037453 k( 155) = ( 0.1502068 -0.0000000 -0.1502068), wk = 0.0037453 k( 156) = ( 0.1581124 -0.0000000 -0.1581124), wk = 0.0037453 k( 157) = ( 0.1660180 -0.0000000 -0.1660180), wk = 0.0037453 k( 158) = ( 0.1739236 -0.0000000 -0.1739236), wk = 0.0037453 k( 159) = ( 0.1818293 -0.0000000 -0.1818293), wk = 0.0037453 k( 160) = ( 0.1897349 -0.0000000 -0.1897349), wk = 0.0037453 k( 161) = ( 0.1976405 0.0000000 -0.1976405), wk = 0.0037453 k( 162) = ( 0.2055461 -0.0000000 -0.2055461), wk = 0.0037453 k( 163) = ( 0.2134517 -0.0000000 -0.2134517), wk = 0.0037453 k( 164) = ( 0.2213574 -0.0000000 -0.2213574), wk = 0.0037453 k( 165) = ( 0.2292630 -0.0000000 -0.2292630), wk = 0.0037453 k( 166) = ( 0.2371686 -0.0000000 -0.2371686), wk = 0.0037453 k( 167) = ( 0.2450742 -0.0000000 -0.2450742), wk = 0.0037453 k( 168) = ( 0.2529798 -0.0000000 -0.2529798), wk = 0.0037453 k( 169) = ( 0.2608855 0.0000000 -0.2608855), wk = 0.0037453 k( 170) = ( 0.2687911 -0.0000000 -0.2687911), wk = 0.0037453 k( 171) = ( 0.2766967 -0.0000000 -0.2766967), wk = 0.0037453 k( 172) = ( 0.2846023 -0.0000000 -0.2846023), wk = 0.0037453 k( 173) = ( 0.2925079 -0.0000000 -0.2925079), wk = 0.0037453 k( 174) = ( 0.3004136 -0.0000000 -0.3004136), wk = 0.0037453 k( 175) = ( 0.3083192 -0.0000000 -0.3083192), wk = 0.0037453 k( 176) = ( 0.3162248 -0.0000000 -0.3162248), wk = 0.0037453 k( 177) = ( 0.3241304 -0.0000000 -0.3241304), wk = 0.0037453 k( 178) = ( 0.3320360 -0.0000000 -0.3320360), wk = 0.0037453 k( 179) = ( 0.3399417 0.0000000 -0.3399417), wk = 0.0037453 k( 180) = ( 0.3478473 -0.0000000 -0.3478473), wk = 0.0037453 k( 181) = ( 0.3557529 0.0000000 -0.3557529), wk = 0.0037453 k( 182) = ( 0.6442471 0.3557529 0.0000000), wk = 0.0037453 k( 183) = ( 0.6366551 0.3633449 0.0000000), wk = 0.0037453 k( 184) = ( 0.6290632 0.3709368 0.0000000), wk = 0.0037453 k( 185) = ( 0.6214712 0.3785288 0.0000000), wk = 0.0037453 k( 186) = ( 0.6138793 0.3861207 0.0000000), wk = 0.0037453 k( 187) = ( 0.6062873 0.3937127 0.0000000), wk = 0.0037453 k( 188) = ( 0.5986954 0.4013046 0.0000000), wk = 0.0037453 k( 189) = ( 0.5911034 0.4088966 0.0000000), wk = 0.0037453 k( 190) = ( 0.5835115 0.4164885 -0.0000000), wk = 0.0037453 k( 191) = ( 0.5759195 0.4240805 0.0000000), wk = 0.0037453 k( 192) = ( 0.5683276 0.4316724 0.0000000), wk = 0.0037453 k( 193) = ( 0.5607356 0.4392644 -0.0000000), wk = 0.0037453 k( 194) = ( 0.5531437 0.4468563 0.0000000), wk = 0.0037453 k( 195) = ( 0.5455517 0.4544483 -0.0000000), wk = 0.0037453 k( 196) = ( 0.5379598 0.4620402 0.0000000), wk = 0.0037453 k( 197) = ( 0.5303678 0.4696322 0.0000000), wk = 0.0037453 k( 198) = ( 0.5227759 0.4772241 0.0000000), wk = 0.0037453 k( 199) = ( 0.5151839 0.4848161 0.0000000), wk = 0.0037453 k( 200) = ( 0.5075920 0.4924081 0.0000000), wk = 0.0037453 k( 201) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0037453 k( 202) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0037453 k( 203) = ( 0.5131134 0.5131134 0.0192278), wk = 0.0037453 k( 204) = ( 0.5262267 0.5262267 0.0384556), wk = 0.0037453 k( 205) = ( 0.5393401 0.5393401 0.0576834), wk = 0.0037453 k( 206) = ( 0.5524535 0.5524535 0.0769112), wk = 0.0037453 k( 207) = ( 0.5655669 0.5655669 0.0961390), wk = 0.0037453 k( 208) = ( 0.5786802 0.5786802 0.1153668), wk = 0.0037453 k( 209) = ( 0.5917936 0.5917936 0.1345946), wk = 0.0037453 k( 210) = ( 0.6049070 0.6049070 0.1538224), wk = 0.0037453 k( 211) = ( 0.6180203 0.6180203 0.1730502), wk = 0.0037453 k( 212) = ( 0.6311337 0.6311337 0.1922780), wk = 0.0037453 k( 213) = ( 0.6442471 0.6442471 0.2115058), wk = 0.0037453 k( 214) = ( 0.6442471 0.6442471 0.2115058), wk = 0.0037453 k( 215) = ( 0.6397394 0.6397394 0.2205212), wk = 0.0037453 k( 216) = ( 0.6352317 0.6352317 0.2295367), wk = 0.0037453 k( 217) = ( 0.6307239 0.6307239 0.2385521), wk = 0.0037453 k( 218) = ( 0.6262162 0.6262162 0.2475676), wk = 0.0037453 k( 219) = ( 0.6217085 0.6217085 0.2565830), wk = 0.0037453 k( 220) = ( 0.6172008 0.6172008 0.2655985), wk = 0.0037453 k( 221) = ( 0.6126930 0.6126930 0.2746139), wk = 0.0037453 k( 222) = ( 0.6081853 0.6081853 0.2836294), wk = 0.0037453 k( 223) = ( 0.6036776 0.6036776 0.2926448), wk = 0.0037453 k( 224) = ( 0.5991699 0.5991699 0.3016602), wk = 0.0037453 k( 225) = ( 0.5946622 0.5946622 0.3106757), wk = 0.0037453 k( 226) = ( 0.5901544 0.5901544 0.3196911), wk = 0.0037453 k( 227) = ( 0.5856467 0.5856467 0.3287066), wk = 0.0037453 k( 228) = ( 0.5811390 0.5811390 0.3377220), wk = 0.0037453 k( 229) = ( 0.5766313 0.5766313 0.3467375), wk = 0.0037453 k( 230) = ( 0.5721236 0.5721236 0.3557529), wk = 0.0037453 k( 231) = ( 0.5676158 0.5676158 0.3647684), wk = 0.0037453 k( 232) = ( 0.5631081 0.5631081 0.3737838), wk = 0.0037453 k( 233) = ( 0.5586004 0.5586004 0.3827992), wk = 0.0037453 k( 234) = ( 0.5540927 0.5540927 0.3918147), wk = 0.0037453 k( 235) = ( 0.5495849 0.5495849 0.4008301), wk = 0.0037453 k( 236) = ( 0.5450772 0.5450772 0.4098456), wk = 0.0037453 k( 237) = ( 0.5405695 0.5405695 0.4188610), wk = 0.0037453 k( 238) = ( 0.5360618 0.5360618 0.4278765), wk = 0.0037453 k( 239) = ( 0.5315541 0.5315541 0.4368919), wk = 0.0037453 k( 240) = ( 0.5270463 0.5270463 0.4459073), wk = 0.0037453 k( 241) = ( 0.5225386 0.5225386 0.4549228), wk = 0.0037453 k( 242) = ( 0.5180309 0.5180309 0.4639382), wk = 0.0037453 k( 243) = ( 0.5135232 0.5135232 0.4729537), wk = 0.0037453 k( 244) = ( 0.5090154 0.5090154 0.4819691), wk = 0.0037453 k( 245) = ( 0.5045077 0.5045077 0.4909846), wk = 0.0037453 k( 246) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0037453 k( 247) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037453 k( 248) = ( 0.5144247 0.0177877 0.0177877), wk = 0.0037453 k( 249) = ( 0.5288494 0.0355753 0.0355753), wk = 0.0037453 k( 250) = ( 0.5432741 0.0533629 0.0533629), wk = 0.0037453 k( 251) = ( 0.5576988 0.0711506 0.0711506), wk = 0.0037453 k( 252) = ( 0.5721236 0.0889382 0.0889382), wk = 0.0037453 k( 253) = ( 0.5865483 0.1067259 0.1067259), wk = 0.0037453 k( 254) = ( 0.6009730 0.1245135 0.1245135), wk = 0.0037453 k( 255) = ( 0.6153977 0.1423012 0.1423012), wk = 0.0037453 k( 256) = ( 0.6298224 0.1600888 0.1600888), wk = 0.0037453 k( 257) = ( 0.6442471 0.1778764 0.1778765), wk = 0.0037453 k( 258) = ( 0.6586718 0.1956641 0.1956641), wk = 0.0037453 k( 259) = ( 0.6730965 0.2134517 0.2134517), wk = 0.0037453 k( 260) = ( 0.6875212 0.2312394 0.2312394), wk = 0.0037453 k( 261) = ( 0.7019459 0.2490270 0.2490270), wk = 0.0037453 k( 262) = ( 0.7163706 0.2668147 0.2668147), wk = 0.0037453 k( 263) = ( 0.7307953 0.2846023 0.2846023), wk = 0.0037453 k( 264) = ( 0.7452201 0.3023900 0.3023900), wk = 0.0037453 k( 265) = ( 0.7596448 0.3201776 0.3201776), wk = 0.0037453 k( 266) = ( 0.7740695 0.3379653 0.3379653), wk = 0.0037453 k( 267) = ( 0.7884942 0.3557529 0.3557529), wk = 0.0037453 Dense grid: 105487 G-vectors FFT dimensions: ( 75, 75, 75) Smooth grid: 50409 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.42 Mb ( 364, 76) NL pseudopotentials 0.45 Mb ( 182, 161) Each V/rho on FFT grid 0.26 Mb ( 16875) Each G-vector array 0.02 Mb ( 2931) G-vector shells 0.02 Mb ( 2413) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.69 Mb ( 364, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.37 Mb ( 161, 2, 76) Check: negative/imaginary core charge= -0.000008 0.000000 The potential is recalculated from file : ./BaMgxCO3x2.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.6 secs Computing kpt #: 2 total cpu time spent up to now is 6.9 secs Computing kpt #: 3 total cpu time spent up to now is 8.1 secs Computing kpt #: 4 total cpu time spent up to now is 9.3 secs Computing kpt #: 5 total cpu time spent up to now is 10.5 secs Computing kpt #: 6 total cpu time spent up to now is 11.6 secs Computing kpt #: 7 total cpu time spent up to now is 13.0 secs Computing kpt #: 8 total cpu time spent up to now is 14.3 secs Computing kpt #: 9 total cpu time spent up to now is 15.6 secs Computing kpt #: 10 total cpu time spent up to now is 17.0 secs Computing kpt #: 11 total cpu time spent up to now is 18.7 secs Computing kpt #: 12 total cpu time spent up to now is 20.3 secs Computing kpt #: 13 total cpu time spent up to now is 21.8 secs Computing kpt #: 14 total cpu time spent up to now is 23.6 secs Computing kpt #: 15 total cpu time spent up to now is 25.3 secs Computing kpt #: 16 total cpu time spent up to now is 26.9 secs Computing kpt #: 17 total cpu time spent up to now is 28.6 secs Computing kpt #: 18 total cpu time spent up to now is 30.4 secs Computing kpt #: 19 total cpu time spent up to now is 32.2 secs Computing kpt #: 20 total cpu time spent up to now is 34.0 secs Computing kpt #: 21 total cpu time spent up to now is 35.9 secs Computing kpt #: 22 total cpu time spent up to now is 37.7 secs Computing kpt #: 23 total cpu time spent up to now is 40.1 secs Computing kpt #: 24 total cpu time spent up to now is 41.9 secs Computing kpt #: 25 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 45.2 secs Computing kpt #: 26 total cpu time spent up to now is 48.2 secs Computing kpt #: 27 total cpu time spent up to now is 50.4 secs Computing kpt #: 28 total cpu time spent up to now is 53.1 secs Computing kpt #: 29 total cpu time spent up to now is 56.2 secs Computing kpt #: 30 total cpu time spent up to now is 58.5 secs Computing kpt #: 31 total cpu time spent up to now is 60.8 secs Computing kpt #: 32 total cpu time spent up to now is 63.0 secs Computing kpt #: 33 total cpu time spent up to now is 65.3 secs Computing kpt #: 34 total cpu time spent up to now is 67.5 secs Computing kpt #: 35 total cpu time spent up to now is 69.5 secs Computing kpt #: 36 total cpu time spent up to now is 71.4 secs Computing kpt #: 37 total cpu time spent up to now is 73.2 secs Computing kpt #: 38 total cpu time spent up to now is 75.1 secs Computing kpt #: 39 total cpu time spent up to now is 77.0 secs Computing kpt #: 40 total cpu time spent up to now is 78.9 secs Computing kpt #: 41 total cpu time spent up to now is 80.7 secs Computing kpt #: 42 total cpu time spent up to now is 82.6 secs Computing kpt #: 43 total cpu time spent up to now is 84.5 secs Computing kpt #: 44 total cpu time spent up to now is 86.2 secs Computing kpt #: 45 total cpu time spent up to now is 87.9 secs Computing kpt #: 46 total cpu time spent up to now is 89.7 secs Computing kpt #: 47 total cpu time spent up to now is 91.3 secs Computing kpt #: 48 total cpu time spent up to now is 93.0 secs Computing kpt #: 49 total cpu time spent up to now is 94.7 secs Computing kpt #: 50 total cpu time spent up to now is 96.4 secs Computing kpt #: 51 total cpu time spent up to now is 98.0 secs Computing kpt #: 52 total cpu time spent up to now is 99.8 secs Computing kpt #: 53 total cpu time spent up to now is 101.5 secs Computing kpt #: 54 total cpu time spent up to now is 103.2 secs Computing kpt #: 55 total cpu time spent up to now is 105.0 secs Computing kpt #: 56 total cpu time spent up to now is 106.9 secs Computing kpt #: 57 total cpu time spent up to now is 108.8 secs Computing kpt #: 58 total cpu time spent up to now is 110.7 secs Computing kpt #: 59 total cpu time spent up to now is 112.7 secs Computing kpt #: 60 total cpu time spent up to now is 114.4 secs Computing kpt #: 61 total cpu time spent up to now is 116.2 secs Computing kpt #: 62 total cpu time spent up to now is 118.0 secs Computing kpt #: 63 total cpu time spent up to now is 119.8 secs Computing kpt #: 64 total cpu time spent up to now is 121.7 secs Computing kpt #: 65 total cpu time spent up to now is 123.5 secs Computing kpt #: 66 total cpu time spent up to now is 125.3 secs Computing kpt #: 67 total cpu time spent up to now is 126.9 secs Computing kpt #: 68 total cpu time spent up to now is 128.8 secs Computing kpt #: 69 total cpu time spent up to now is 130.5 secs Computing kpt #: 70 total cpu time spent up to now is 132.3 secs Computing kpt #: 71 total cpu time spent up to now is 134.0 secs Computing kpt #: 72 total cpu time spent up to now is 135.6 secs Computing kpt #: 73 total cpu time spent up to now is 137.2 secs Computing kpt #: 74 total cpu time spent up to now is 138.9 secs Computing kpt #: 75 total cpu time spent up to now is 140.7 secs Computing kpt #: 76 total cpu time spent up to now is 142.5 secs Computing kpt #: 77 total cpu time spent up to now is 144.2 secs Computing kpt #: 78 total cpu time spent up to now is 145.8 secs Computing kpt #: 79 total cpu time spent up to now is 147.4 secs Computing kpt #: 80 total cpu time spent up to now is 149.0 secs Computing kpt #: 81 total cpu time spent up to now is 150.8 secs Computing kpt #: 82 total cpu time spent up to now is 152.6 secs Computing kpt #: 83 total cpu time spent up to now is 154.4 secs Computing kpt #: 84 total cpu time spent up to now is 156.0 secs Computing kpt #: 85 total cpu time spent up to now is 157.7 secs Computing kpt #: 86 total cpu time spent up to now is 159.4 secs Computing kpt #: 87 total cpu time spent up to now is 161.2 secs Computing kpt #: 88 total cpu time spent up to now is 163.0 secs Computing kpt #: 89 total cpu time spent up to now is 164.6 secs Computing kpt #: 90 total cpu time spent up to now is 166.5 secs Computing kpt #: 91 total cpu time spent up to now is 168.3 secs Computing kpt #: 92 total cpu time spent up to now is 170.0 secs Computing kpt #: 93 total cpu time spent up to now is 171.7 secs Computing kpt #: 94 total cpu time spent up to now is 173.4 secs Computing kpt #: 95 total cpu time spent up to now is 175.2 secs Computing kpt #: 96 total cpu time spent up to now is 176.8 secs Computing kpt #: 97 total cpu time spent up to now is 178.4 secs Computing kpt #: 98 total cpu time spent up to now is 180.0 secs Computing kpt #: 99 total cpu time spent up to now is 181.6 secs Computing kpt #: 100 total cpu time spent up to now is 183.1 secs Computing kpt #: 101 total cpu time spent up to now is 184.6 secs Computing kpt #: 102 total cpu time spent up to now is 186.0 secs Computing kpt #: 103 total cpu time spent up to now is 187.5 secs Computing kpt #: 104 total cpu time spent up to now is 189.0 secs Computing kpt #: 105 total cpu time spent up to now is 190.4 secs Computing kpt #: 106 total cpu time spent up to now is 191.9 secs Computing kpt #: 107 total cpu time spent up to now is 193.4 secs Computing kpt #: 108 total cpu time spent up to now is 195.0 secs Computing kpt #: 109 total cpu time spent up to now is 196.5 secs Computing kpt #: 110 total cpu time spent up to now is 198.0 secs Computing kpt #: 111 total cpu time spent up to now is 199.5 secs Computing kpt #: 112 total cpu time spent up to now is 201.0 secs Computing kpt #: 113 total cpu time spent up to now is 202.5 secs Computing kpt #: 114 total cpu time spent up to now is 204.1 secs Computing kpt #: 115 total cpu time spent up to now is 205.6 secs Computing kpt #: 116 total cpu time spent up to now is 207.1 secs Computing kpt #: 117 total cpu time spent up to now is 208.6 secs Computing kpt #: 118 total cpu time spent up to now is 210.1 secs Computing kpt #: 119 total cpu time spent up to now is 211.6 secs Computing kpt #: 120 total cpu time spent up to now is 213.0 secs Computing kpt #: 121 total cpu time spent up to now is 214.5 secs Computing kpt #: 122 total cpu time spent up to now is 216.0 secs Computing kpt #: 123 total cpu time spent up to now is 217.4 secs Computing kpt #: 124 total cpu time spent up to now is 218.9 secs Computing kpt #: 125 total cpu time spent up to now is 220.2 secs Computing kpt #: 126 total cpu time spent up to now is 221.6 secs Computing kpt #: 127 total cpu time spent up to now is 222.9 secs Computing kpt #: 128 total cpu time spent up to now is 224.1 secs Computing kpt #: 129 total cpu time spent up to now is 225.2 secs Computing kpt #: 130 total cpu time spent up to now is 226.4 secs Computing kpt #: 131 total cpu time spent up to now is 227.7 secs Computing kpt #: 132 total cpu time spent up to now is 228.9 secs Computing kpt #: 133 total cpu time spent up to now is 230.1 secs Computing kpt #: 134 total cpu time spent up to now is 231.4 secs Computing kpt #: 135 total cpu time spent up to now is 232.6 secs Computing kpt #: 136 total cpu time spent up to now is 234.3 secs Computing kpt #: 137 total cpu time spent up to now is 235.6 secs Computing kpt #: 138 total cpu time spent up to now is 236.8 secs Computing kpt #: 139 total cpu time spent up to now is 237.9 secs Computing kpt #: 140 total cpu time spent up to now is 239.1 secs Computing kpt #: 141 total cpu time spent up to now is 240.4 secs Computing kpt #: 142 total cpu time spent up to now is 241.8 secs Computing kpt #: 143 total cpu time spent up to now is 243.0 secs Computing kpt #: 144 total cpu time spent up to now is 244.3 secs Computing kpt #: 145 total cpu time spent up to now is 245.7 secs Computing kpt #: 146 total cpu time spent up to now is 247.0 secs Computing kpt #: 147 total cpu time spent up to now is 248.4 secs Computing kpt #: 148 total cpu time spent up to now is 249.7 secs Computing kpt #: 149 total cpu time spent up to now is 251.2 secs Computing kpt #: 150 total cpu time spent up to now is 253.0 secs Computing kpt #: 151 total cpu time spent up to now is 254.7 secs Computing kpt #: 152 total cpu time spent up to now is 256.4 secs Computing kpt #: 153 total cpu time spent up to now is 258.2 secs Computing kpt #: 154 total cpu time spent up to now is 260.0 secs Computing kpt #: 155 total cpu time spent up to now is 261.8 secs Computing kpt #: 156 total cpu time spent up to now is 263.7 secs Computing kpt #: 157 total cpu time spent up to now is 265.3 secs Computing kpt #: 158 total cpu time spent up to now is 267.2 secs Computing kpt #: 159 total cpu time spent up to now is 268.8 secs Computing kpt #: 160 total cpu time spent up to now is 270.5 secs Computing kpt #: 161 total cpu time spent up to now is 272.1 secs Computing kpt #: 162 total cpu time spent up to now is 273.8 secs Computing kpt #: 163 total cpu time spent up to now is 275.4 secs Computing kpt #: 164 total cpu time spent up to now is 277.3 secs Computing kpt #: 165 total cpu time spent up to now is 279.2 secs Computing kpt #: 166 total cpu time spent up to now is 281.2 secs Computing kpt #: 167 total cpu time spent up to now is 283.2 secs Computing kpt #: 168 total cpu time spent up to now is 285.2 secs Computing kpt #: 169 total cpu time spent up to now is 287.1 secs Computing kpt #: 170 total cpu time spent up to now is 289.0 secs Computing kpt #: 171 total cpu time spent up to now is 290.9 secs Computing kpt #: 172 total cpu time spent up to now is 292.8 secs Computing kpt #: 173 total cpu time spent up to now is 294.7 secs Computing kpt #: 174 total cpu time spent up to now is 296.6 secs Computing kpt #: 175 total cpu time spent up to now is 298.6 secs Computing kpt #: 176 total cpu time spent up to now is 300.6 secs Computing kpt #: 177 total cpu time spent up to now is 303.8 secs Computing kpt #: 178 total cpu time spent up to now is 305.7 secs Computing kpt #: 179 total cpu time spent up to now is 307.6 secs Computing kpt #: 180 total cpu time spent up to now is 309.3 secs Computing kpt #: 181 total cpu time spent up to now is 311.1 secs Computing kpt #: 182 total cpu time spent up to now is 313.0 secs Computing kpt #: 183 total cpu time spent up to now is 314.9 secs Computing kpt #: 184 total cpu time spent up to now is 316.4 secs Computing kpt #: 185 total cpu time spent up to now is 318.0 secs Computing kpt #: 186 total cpu time spent up to now is 319.5 secs Computing kpt #: 187 total cpu time spent up to now is 320.9 secs Computing kpt #: 188 total cpu time spent up to now is 322.4 secs Computing kpt #: 189 total cpu time spent up to now is 323.8 secs Computing kpt #: 190 total cpu time spent up to now is 325.3 secs Computing kpt #: 191 total cpu time spent up to now is 326.7 secs Computing kpt #: 192 total cpu time spent up to now is 328.2 secs Computing kpt #: 193 total cpu time spent up to now is 329.8 secs Computing kpt #: 194 total cpu time spent up to now is 331.3 secs Computing kpt #: 195 total cpu time spent up to now is 333.0 secs Computing kpt #: 196 total cpu time spent up to now is 334.9 secs Computing kpt #: 197 total cpu time spent up to now is 336.6 secs Computing kpt #: 198 total cpu time spent up to now is 338.4 secs Computing kpt #: 199 total cpu time spent up to now is 340.2 secs Computing kpt #: 200 total cpu time spent up to now is 342.0 secs Computing kpt #: 201 total cpu time spent up to now is 343.7 secs Computing kpt #: 202 total cpu time spent up to now is 345.4 secs Computing kpt #: 203 total cpu time spent up to now is 346.7 secs Computing kpt #: 204 total cpu time spent up to now is 348.3 secs Computing kpt #: 205 total cpu time spent up to now is 351.2 secs Computing kpt #: 206 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 354.4 secs Computing kpt #: 207 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 357.6 secs Computing kpt #: 208 total cpu time spent up to now is 360.8 secs Computing kpt #: 209 total cpu time spent up to now is 363.4 secs Computing kpt #: 210 total cpu time spent up to now is 365.7 secs Computing kpt #: 211 total cpu time spent up to now is 367.6 secs Computing kpt #: 212 total cpu time spent up to now is 369.5 secs Computing kpt #: 213 total cpu time spent up to now is 371.5 secs Computing kpt #: 214 total cpu time spent up to now is 373.4 secs Computing kpt #: 215 total cpu time spent up to now is 375.3 secs Computing kpt #: 216 total cpu time spent up to now is 377.1 secs Computing kpt #: 217 total cpu time spent up to now is 379.1 secs Computing kpt #: 218 total cpu time spent up to now is 380.8 secs Computing kpt #: 219 total cpu time spent up to now is 382.6 secs Computing kpt #: 220 total cpu time spent up to now is 384.5 secs Computing kpt #: 221 total cpu time spent up to now is 386.4 secs Computing kpt #: 222 total cpu time spent up to now is 388.2 secs Computing kpt #: 223 total cpu time spent up to now is 390.0 secs Computing kpt #: 224 total cpu time spent up to now is 391.8 secs Computing kpt #: 225 total cpu time spent up to now is 393.6 secs Computing kpt #: 226 total cpu time spent up to now is 395.4 secs Computing kpt #: 227 total cpu time spent up to now is 397.2 secs Computing kpt #: 228 total cpu time spent up to now is 398.8 secs Computing kpt #: 229 total cpu time spent up to now is 400.6 secs Computing kpt #: 230 total cpu time spent up to now is 402.4 secs Computing kpt #: 231 total cpu time spent up to now is 404.1 secs Computing kpt #: 232 total cpu time spent up to now is 405.8 secs Computing kpt #: 233 total cpu time spent up to now is 407.5 secs Computing kpt #: 234 total cpu time spent up to now is 409.1 secs Computing kpt #: 235 total cpu time spent up to now is 410.8 secs Computing kpt #: 236 total cpu time spent up to now is 412.5 secs Computing kpt #: 237 total cpu time spent up to now is 414.1 secs Computing kpt #: 238 total cpu time spent up to now is 415.7 secs Computing kpt #: 239 total cpu time spent up to now is 417.3 secs Computing kpt #: 240 total cpu time spent up to now is 418.8 secs Computing kpt #: 241 total cpu time spent up to now is 420.4 secs Computing kpt #: 242 total cpu time spent up to now is 421.9 secs Computing kpt #: 243 total cpu time spent up to now is 423.4 secs Computing kpt #: 244 total cpu time spent up to now is 424.9 secs Computing kpt #: 245 total cpu time spent up to now is 426.3 secs Computing kpt #: 246 total cpu time spent up to now is 427.8 secs Computing kpt #: 247 total cpu time spent up to now is 429.6 secs Computing kpt #: 248 total cpu time spent up to now is 431.7 secs Computing kpt #: 249 total cpu time spent up to now is 433.6 secs Computing kpt #: 250 total cpu time spent up to now is 437.5 secs Computing kpt #: 251 total cpu time spent up to now is 439.4 secs Computing kpt #: 252 total cpu time spent up to now is 441.4 secs Computing kpt #: 253 total cpu time spent up to now is 443.3 secs Computing kpt #: 254 total cpu time spent up to now is 445.2 secs Computing kpt #: 255 total cpu time spent up to now is 447.1 secs Computing kpt #: 256 total cpu time spent up to now is 449.0 secs Computing kpt #: 257 total cpu time spent up to now is 450.5 secs Computing kpt #: 258 total cpu time spent up to now is 452.4 secs Computing kpt #: 259 total cpu time spent up to now is 454.3 secs Computing kpt #: 260 total cpu time spent up to now is 456.3 secs Computing kpt #: 261 total cpu time spent up to now is 458.2 secs Computing kpt #: 262 total cpu time spent up to now is 460.1 secs Computing kpt #: 263 total cpu time spent up to now is 462.1 secs Computing kpt #: 264 total cpu time spent up to now is 463.9 secs Computing kpt #: 265 total cpu time spent up to now is 465.9 secs Computing kpt #: 266 total cpu time spent up to now is 467.7 secs Computing kpt #: 267 total cpu time spent up to now is 469.6 secs ethr = 1.56E-08, avg # of iterations = 42.3 total cpu time spent up to now is 469.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6319 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7114 -19.7114 -16.4958 -16.4958 -16.3664 -16.3664 -13.1076 -13.1076 -13.1071 -13.1071 -13.0725 -13.0725 -13.0713 -13.0713 -6.3378 -6.3378 -4.4315 -4.4315 -4.3955 -4.3955 -3.1505 -3.1505 -2.4799 -2.4799 -1.0214 -1.0214 -0.4609 -0.4609 -0.4502 -0.4502 -0.4182 -0.4182 -0.3648 -0.3648 0.3893 0.3893 3.4335 3.4335 3.4474 3.4474 3.7678 3.7678 3.7729 3.7729 3.9971 3.9971 4.0136 4.0136 4.3381 4.3381 4.4038 4.4038 5.7416 5.7416 6.0263 6.0263 10.5478 10.5478 11.1452 11.1452 11.2109 11.2109 12.1330 12.1330 13.1566 13.1566 13.2838 13.2838 k = 0.0132-0.0123-0.0080 ( 6320 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7113 -19.7113 -16.4957 -16.4957 -16.3663 -16.3663 -13.1078 -13.1078 -13.1073 -13.1073 -13.0726 -13.0726 -13.0714 -13.0714 -6.3377 -6.3377 -4.4314 -4.4314 -4.3955 -4.3955 -3.1491 -3.1491 -2.4795 -2.4795 -1.0203 -1.0203 -0.4608 -0.4608 -0.4501 -0.4501 -0.4183 -0.4183 -0.3651 -0.3651 0.3886 0.3886 3.4333 3.4333 3.4472 3.4472 3.7677 3.7677 3.7727 3.7727 3.9969 3.9969 4.0135 4.0135 4.3371 4.3371 4.4027 4.4027 5.7405 5.7405 6.0252 6.0252 10.5495 10.5495 11.1469 11.1469 11.2114 11.2114 12.1340 12.1340 13.1565 13.1565 13.2836 13.2836 k = 0.0263-0.0245-0.0160 ( 6325 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7111 -19.7111 -16.4956 -16.4956 -16.3662 -16.3662 -13.1087 -13.1087 -13.1074 -13.1074 -13.0730 -13.0730 -13.0717 -13.0717 -6.3376 -6.3376 -4.4310 -4.4310 -4.3954 -4.3954 -3.1447 -3.1447 -2.4781 -2.4781 -1.0171 -1.0171 -0.4608 -0.4608 -0.4498 -0.4498 -0.4184 -0.4184 -0.3660 -0.3660 0.3865 0.3865 3.4325 3.4325 3.4465 3.4465 3.7670 3.7670 3.7724 3.7724 3.9965 3.9965 4.0132 4.0132 4.3338 4.3338 4.3995 4.3995 5.7371 5.7371 6.0222 6.0222 10.5547 10.5547 11.1521 11.1521 11.2130 11.2130 12.1372 12.1372 13.1560 13.1560 13.2834 13.2834 k = 0.0395-0.0368-0.0239 ( 6327 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7108 -19.7108 -16.4954 -16.4954 -16.3661 -16.3661 -13.1102 -13.1102 -13.1076 -13.1076 -13.0739 -13.0739 -13.0720 -13.0720 -6.3373 -6.3373 -4.4304 -4.4304 -4.3953 -4.3953 -3.1374 -3.1374 -2.4757 -2.4757 -1.0117 -1.0117 -0.4614 -0.4614 -0.4487 -0.4487 -0.4189 -0.4189 -0.3673 -0.3673 0.3831 0.3831 3.4312 3.4312 3.4455 3.4455 3.7654 3.7654 3.7722 3.7722 3.9957 3.9957 4.0127 4.0127 4.3281 4.3281 4.3945 4.3945 5.7315 5.7315 6.0171 6.0171 10.5633 10.5633 11.1605 11.1605 11.2158 11.2158 12.1426 12.1426 13.1550 13.1550 13.2833 13.2833 k = 0.0526-0.0491-0.0319 ( 6325 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7103 -19.7103 -16.4950 -16.4950 -16.3659 -16.3659 -13.1124 -13.1124 -13.1078 -13.1078 -13.0752 -13.0752 -13.0724 -13.0724 -6.3369 -6.3369 -4.4297 -4.4297 -4.3951 -4.3951 -3.1273 -3.1273 -2.4724 -2.4724 -1.0043 -1.0043 -0.4634 -0.4634 -0.4461 -0.4461 -0.4198 -0.4198 -0.3686 -0.3686 0.3783 0.3783 3.4292 3.4292 3.4441 3.4441 3.7626 3.7626 3.7725 3.7725 3.9946 3.9946 4.0121 4.0121 4.3194 4.3194 4.3885 4.3885 5.7238 5.7238 6.0100 6.0100 10.5753 10.5753 11.1714 11.1714 11.2204 11.2204 12.1500 12.1500 13.1532 13.1532 13.2836 13.2836 k = 0.0658-0.0614-0.0399 ( 6329 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7097 -19.7097 -16.4946 -16.4946 -16.3657 -16.3657 -13.1152 -13.1152 -13.1080 -13.1080 -13.0769 -13.0769 -13.0728 -13.0728 -6.3364 -6.3364 -4.4288 -4.4288 -4.3947 -4.3947 -3.1145 -3.1145 -2.4680 -2.4680 -0.9948 -0.9948 -0.4669 -0.4669 -0.4424 -0.4424 -0.4215 -0.4215 -0.3695 -0.3695 0.3721 0.3721 3.4265 3.4265 3.4426 3.4426 3.7586 3.7586 3.7731 3.7731 3.9931 3.9931 4.0115 4.0115 4.3073 4.3073 4.3819 4.3819 5.7140 5.7140 6.0010 6.0010 10.5904 10.5904 11.1838 11.1838 11.2277 11.2277 12.1596 12.1596 13.1500 13.1500 13.2850 13.2850 k = 0.0789-0.0736-0.0479 ( 6332 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7090 -19.7090 -16.4940 -16.4940 -16.3655 -16.3655 -13.1186 -13.1186 -13.1083 -13.1083 -13.0789 -13.0789 -13.0733 -13.0733 -6.3358 -6.3358 -4.4278 -4.4278 -4.3941 -4.3941 -3.0990 -3.0990 -2.4625 -2.4625 -0.9833 -0.9833 -0.4720 -0.4720 -0.4381 -0.4381 -0.4236 -0.4236 -0.3695 -0.3695 0.3648 0.3648 3.4230 3.4230 3.4409 3.4409 3.7535 3.7535 3.7742 3.7742 3.9912 3.9912 4.0109 4.0109 4.2916 4.2916 4.3753 4.3753 5.7022 5.7022 5.9901 5.9901 10.6086 10.6086 11.1959 11.1959 11.2392 11.2392 12.1714 12.1714 13.1452 13.1452 13.2877 13.2877 k = 0.0921-0.0859-0.0559 ( 6331 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7081 -19.7081 -16.4934 -16.4934 -16.3652 -16.3652 -13.1226 -13.1226 -13.1087 -13.1087 -13.0812 -13.0812 -13.0739 -13.0739 -6.3350 -6.3350 -4.4269 -4.4269 -4.3931 -4.3931 -3.0810 -3.0810 -2.4560 -2.4560 -0.9699 -0.9699 -0.4788 -0.4788 -0.4357 -0.4357 -0.4240 -0.4240 -0.3683 -0.3683 0.3563 0.3563 3.4186 3.4186 3.4391 3.4391 3.7470 3.7470 3.7755 3.7755 3.9890 3.9890 4.0105 4.0105 4.2723 4.2723 4.3689 4.3689 5.6885 5.6885 5.9773 5.9773 10.6296 10.6296 11.2062 11.2062 11.2563 11.2563 12.1853 12.1853 13.1386 13.1386 13.2922 13.2922 k = 0.1053-0.0982-0.0638 ( 6333 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7072 -19.7072 -16.4926 -16.4926 -16.3649 -16.3649 -13.1272 -13.1272 -13.1091 -13.1091 -13.0837 -13.0837 -13.0745 -13.0745 -6.3342 -6.3342 -4.4260 -4.4260 -4.3917 -4.3917 -3.0605 -3.0605 -2.4482 -2.4482 -0.9547 -0.9547 -0.4875 -0.4875 -0.4382 -0.4382 -0.4194 -0.4194 -0.3660 -0.3660 0.3466 0.3466 3.4135 3.4135 3.4371 3.4371 3.7393 3.7393 3.7772 3.7772 3.9864 3.9864 4.0101 4.0101 4.2497 4.2497 4.3628 4.3628 5.6731 5.6731 5.9627 5.9627 10.6532 10.6532 11.2147 11.2147 11.2785 11.2785 12.2015 12.2015 13.1300 13.1300 13.2986 13.2986 k = 0.1184-0.1104-0.0718 ( 6328 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7061 -19.7061 -16.4917 -16.4917 -16.3647 -16.3647 -13.1324 -13.1324 -13.1095 -13.1095 -13.0865 -13.0865 -13.0752 -13.0752 -6.3333 -6.3333 -4.4254 -4.4254 -4.3898 -4.3898 -3.0378 -3.0378 -2.4392 -2.4392 -0.9378 -0.9378 -0.4982 -0.4982 -0.4434 -0.4434 -0.4120 -0.4120 -0.3625 -0.3625 0.3360 0.3360 3.4076 3.4076 3.4348 3.4348 3.7302 3.7302 3.7792 3.7792 3.9833 3.9833 4.0098 4.0098 4.2245 4.2245 4.3567 4.3567 5.6562 5.6562 5.9464 5.9464 10.6793 10.6793 11.2224 11.2224 11.3046 11.3046 12.2199 12.2199 13.1197 13.1197 13.3067 13.3067 k = 0.1316-0.1227-0.0798 ( 6333 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7050 -19.7050 -16.4906 -16.4906 -16.3644 -16.3644 -13.1382 -13.1382 -13.1099 -13.1099 -13.0894 -13.0894 -13.0760 -13.0760 -6.3323 -6.3323 -4.4249 -4.4249 -4.3874 -4.3874 -3.0129 -3.0129 -2.4289 -2.4289 -0.9193 -0.9193 -0.5112 -0.5112 -0.4495 -0.4495 -0.4034 -0.4034 -0.3579 -0.3579 0.3243 0.3243 3.4012 3.4012 3.4322 3.4322 3.7197 3.7197 3.7816 3.7816 3.9798 3.9798 4.0097 4.0097 4.1972 4.1972 4.3506 4.3506 5.6378 5.6378 5.9285 5.9285 10.7075 10.7075 11.2300 11.2300 11.3332 11.3332 12.2407 12.2407 13.1079 13.1079 13.3165 13.3165 k = 0.1447-0.1350-0.0878 ( 6335 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7037 -19.7037 -16.4894 -16.4894 -16.3643 -16.3643 -13.1445 -13.1445 -13.1104 -13.1104 -13.0925 -13.0925 -13.0768 -13.0768 -6.3313 -6.3313 -4.4246 -4.4246 -4.3845 -4.3845 -2.9861 -2.9861 -2.4172 -2.4172 -0.8994 -0.8994 -0.5262 -0.5262 -0.4562 -0.4562 -0.3942 -0.3942 -0.3523 -0.3523 0.3118 0.3118 3.3941 3.3941 3.4292 3.4292 3.7078 3.7078 3.7844 3.7844 3.9753 3.9753 4.0096 4.0096 4.1686 4.1686 4.3445 4.3445 5.6182 5.6182 5.9090 5.9090 10.7377 10.7377 11.2379 11.2379 11.3636 11.3636 12.2638 12.2638 13.0950 13.0950 13.3278 13.3278 k = 0.1579-0.1472-0.0958 ( 6329 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7024 -19.7024 -16.4881 -16.4881 -16.3641 -16.3641 -13.1513 -13.1513 -13.1109 -13.1109 -13.0957 -13.0957 -13.0777 -13.0777 -6.3302 -6.3302 -4.4245 -4.4245 -4.3811 -4.3811 -2.9575 -2.9575 -2.4041 -2.4041 -0.8782 -0.8782 -0.5430 -0.5430 -0.4635 -0.4635 -0.3845 -0.3845 -0.3457 -0.3457 0.2984 0.2984 3.3867 3.3867 3.4259 3.4259 3.6944 3.6944 3.7876 3.7876 3.9696 3.9696 4.0096 4.0096 4.1397 4.1397 4.3382 4.3382 5.5975 5.5975 5.8882 5.8882 10.7694 10.7694 11.2462 11.2462 11.3950 11.3950 12.2895 12.2895 13.0814 13.0814 13.3402 13.3402 k = 0.1711-0.1595-0.1037 ( 6327 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7010 -19.7010 -16.4866 -16.4866 -16.3641 -16.3641 -13.1585 -13.1585 -13.1114 -13.1114 -13.0990 -13.0990 -13.0787 -13.0787 -6.3290 -6.3290 -4.4246 -4.4246 -4.3773 -4.3773 -2.9272 -2.9272 -2.3895 -2.3895 -0.8559 -0.8559 -0.5614 -0.5614 -0.4714 -0.4714 -0.3747 -0.3747 -0.3379 -0.3379 0.2843 0.2843 3.3788 3.3788 3.4220 3.4220 3.6794 3.6794 3.7911 3.7911 3.9619 3.9619 4.0097 4.0097 4.1118 4.1118 4.3317 4.3317 5.5760 5.5760 5.8660 5.8660 10.8025 10.8025 11.2552 11.2552 11.4267 11.4267 12.3178 12.3178 13.0674 13.0674 13.3535 13.3535 k = 0.1842-0.1718-0.1117 ( 6322 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6995 -19.6995 -16.4849 -16.4849 -16.3641 -16.3641 -13.1662 -13.1662 -13.1119 -13.1119 -13.1024 -13.1024 -13.0797 -13.0797 -6.3277 -6.3277 -4.4248 -4.4248 -4.3731 -4.3731 -2.8954 -2.8954 -2.3734 -2.3734 -0.8328 -0.8328 -0.5810 -0.5810 -0.4800 -0.4800 -0.3650 -0.3650 -0.3290 -0.3290 0.2696 0.2696 3.3706 3.3706 3.4177 3.4177 3.6630 3.6630 3.7951 3.7951 3.9509 3.9509 4.0099 4.0099 4.0863 4.0863 4.3250 4.3250 5.5538 5.5538 5.8426 5.8426 10.8367 10.8367 11.2649 11.2649 11.4579 11.4579 12.3486 12.3486 13.0535 13.0535 13.3676 13.3676 k = 0.1974-0.1841-0.1197 ( 6316 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6980 -19.6980 -16.4831 -16.4831 -16.3642 -16.3642 -13.1742 -13.1742 -13.1124 -13.1124 -13.1058 -13.1058 -13.0808 -13.0808 -6.3264 -6.3264 -4.4250 -4.4250 -4.3686 -4.3686 -2.8623 -2.8623 -2.3559 -2.3559 -0.8091 -0.8091 -0.6015 -0.6015 -0.4895 -0.4895 -0.3556 -0.3556 -0.3188 -0.3188 0.2541 0.2541 3.3622 3.3622 3.4129 3.4129 3.6451 3.6451 3.7994 3.7994 3.9356 3.9356 4.0101 4.0101 4.0650 4.0650 4.3181 4.3181 5.5312 5.5312 5.8182 5.8182 10.8715 10.8715 11.2753 11.2753 11.4880 11.4880 12.3821 12.3821 13.0401 13.0401 13.3820 13.3820 k = 0.2105-0.1963-0.1277 ( 6316 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6964 -19.6964 -16.4812 -16.4812 -16.3644 -16.3644 -13.1825 -13.1825 -13.1129 -13.1129 -13.1092 -13.1092 -13.0819 -13.0819 -6.3251 -6.3251 -4.4253 -4.4253 -4.3639 -4.3639 -2.8280 -2.8280 -2.3370 -2.3370 -0.7856 -0.7856 -0.6223 -0.6223 -0.4998 -0.4998 -0.3465 -0.3465 -0.3075 -0.3075 0.2382 0.2382 3.3536 3.3536 3.4076 3.4076 3.6257 3.6257 3.8039 3.8039 3.9155 3.9155 4.0104 4.0104 4.0488 4.0488 4.3111 4.3111 5.5082 5.5082 5.7929 5.7929 10.9068 10.9068 11.2866 11.2866 11.5162 11.5162 12.4180 12.4180 13.0277 13.0277 13.3967 13.3967 k = 0.2237-0.2086-0.1357 ( 6322 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6948 -19.6948 -16.4790 -16.4790 -16.3648 -16.3648 -13.1911 -13.1911 -13.1134 -13.1134 -13.1125 -13.1125 -13.0831 -13.0831 -6.3238 -6.3238 -4.4255 -4.4255 -4.3591 -4.3591 -2.7927 -2.7927 -2.3166 -2.3166 -0.7634 -0.7634 -0.6420 -0.6420 -0.5110 -0.5110 -0.3378 -0.3378 -0.2952 -0.2952 0.2217 0.2217 3.3449 3.3449 3.4018 3.4018 3.6048 3.6048 3.8085 3.8085 3.8915 3.8915 4.0107 4.0107 4.0373 4.0373 4.3038 4.3038 5.4852 5.4852 5.7667 5.7667 10.9421 10.9421 11.2988 11.2988 11.5422 11.5422 12.4560 12.4560 13.0167 13.0167 13.4113 13.4113 k = 0.2368-0.2209-0.1436 ( 6326 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6932 -19.6932 -16.4767 -16.4767 -16.3653 -16.3653 -13.1998 -13.1998 -13.1159 -13.1159 -13.1139 -13.1139 -13.0843 -13.0843 -6.3225 -6.3225 -4.4258 -4.4258 -4.3541 -4.3541 -2.7564 -2.7564 -2.2950 -2.2950 -0.7456 -0.7456 -0.6577 -0.6577 -0.5231 -0.5231 -0.3293 -0.3293 -0.2822 -0.2822 0.2047 0.2047 3.3361 3.3361 3.3956 3.3956 3.5824 3.5824 3.8127 3.8127 3.8658 3.8658 4.0111 4.0111 4.0294 4.0294 4.2964 4.2964 5.4622 5.4622 5.7400 5.7400 10.9771 10.9771 11.3119 11.3119 11.5653 11.5653 12.4955 12.4955 13.0080 13.0080 13.4255 13.4255 k = 0.2500-0.2331-0.1516 ( 6323 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6915 -19.6915 -16.4743 -16.4743 -16.3659 -16.3659 -13.2087 -13.2087 -13.1192 -13.1192 -13.1143 -13.1143 -13.0856 -13.0856 -6.3211 -6.3211 -4.4261 -4.4261 -4.3491 -4.3491 -2.7194 -2.7194 -2.2722 -2.2722 -0.7397 -0.7397 -0.6619 -0.6619 -0.5361 -0.5361 -0.3211 -0.3211 -0.2685 -0.2685 0.1874 0.1874 3.3273 3.3273 3.3890 3.3890 3.5585 3.5585 3.8139 3.8139 3.8425 3.8425 4.0115 4.0115 4.0239 4.0239 4.2889 4.2889 5.4396 5.4396 5.7128 5.7128 11.0114 11.0114 11.3260 11.3260 11.5853 11.5853 12.5357 12.5357 13.0021 13.0021 13.4391 13.4391 k = 0.2632-0.2454-0.1596 ( 6321 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6899 -19.6899 -16.4716 -16.4716 -16.3667 -16.3667 -13.2177 -13.2177 -13.1223 -13.1223 -13.1147 -13.1147 -13.0868 -13.0868 -6.3198 -6.3198 -4.4263 -4.4263 -4.3440 -4.3440 -2.6817 -2.6817 -2.2484 -2.2484 -0.7497 -0.7497 -0.6507 -0.6507 -0.5497 -0.5497 -0.3130 -0.3130 -0.2545 -0.2545 0.1698 0.1698 3.3184 3.3184 3.3820 3.3820 3.5333 3.5333 3.8008 3.8008 3.8339 3.8339 4.0117 4.0117 4.0200 4.0200 4.2813 4.2813 5.4174 5.4174 5.6853 5.6853 11.0448 11.0448 11.3411 11.3411 11.6019 11.6019 12.5751 12.5751 13.0000 13.0000 13.4516 13.4516 k = 0.2763-0.2577-0.1676 ( 6316 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6882 -19.6882 -16.4689 -16.4689 -16.3677 -16.3677 -13.2266 -13.2266 -13.1254 -13.1254 -13.1151 -13.1151 -13.0881 -13.0881 -6.3184 -6.3184 -4.4265 -4.4265 -4.3390 -4.3390 -2.6435 -2.6435 -2.2238 -2.2238 -0.7688 -0.7688 -0.6319 -0.6319 -0.5632 -0.5632 -0.3052 -0.3052 -0.2402 -0.2402 0.1520 0.1520 3.3094 3.3094 3.3747 3.3747 3.5071 3.5071 3.7775 3.7775 3.8368 3.8368 4.0114 4.0114 4.0177 4.0177 4.2737 4.2737 5.3959 5.3959 5.6577 5.6577 11.0767 11.0767 11.3575 11.3575 11.6152 11.6152 12.6123 12.6123 13.0028 13.0028 13.4623 13.4623 k = 0.2895-0.2699-0.1756 ( 6312 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6866 -19.6866 -16.4660 -16.4660 -16.3688 -16.3688 -13.2355 -13.2355 -13.1284 -13.1284 -13.1155 -13.1155 -13.0894 -13.0894 -6.3171 -6.3171 -4.4266 -4.4266 -4.3341 -4.3341 -2.6049 -2.6049 -2.1987 -2.1987 -0.7913 -0.7913 -0.6142 -0.6142 -0.5731 -0.5731 -0.2974 -0.2974 -0.2260 -0.2260 0.1339 0.1339 3.3004 3.3004 3.3672 3.3672 3.4800 3.4800 3.7538 3.7538 3.8420 3.8420 4.0100 4.0100 4.0171 4.0171 4.2660 4.2660 5.3752 5.3752 5.6301 5.6301 11.1068 11.1068 11.3750 11.3750 11.6251 11.6251 12.6452 12.6452 13.0113 13.0113 13.4705 13.4705 k = 0.3026-0.2822-0.1835 ( 6311 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6850 -19.6850 -16.4629 -16.4629 -16.3701 -16.3701 -13.2442 -13.2442 -13.1312 -13.1312 -13.1158 -13.1158 -13.0908 -13.0908 -6.3159 -6.3159 -4.4267 -4.4267 -4.3293 -4.3293 -2.5660 -2.5660 -2.1733 -2.1733 -0.8149 -0.8149 -0.6122 -0.6122 -0.5672 -0.5672 -0.2899 -0.2899 -0.2118 -0.2118 0.1158 0.1158 3.2911 3.2911 3.3595 3.3595 3.4525 3.4525 3.7316 3.7316 3.8477 3.8477 4.0077 4.0077 4.0177 4.0177 4.2584 4.2584 5.3555 5.3555 5.6026 5.6026 11.1349 11.1349 11.3936 11.3936 11.6318 11.6318 12.6725 12.6725 13.0258 13.0258 13.4764 13.4764 k = 0.3158-0.2945-0.1915 ( 6311 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6835 -19.6835 -16.4598 -16.4598 -16.3715 -16.3715 -13.2528 -13.2528 -13.1339 -13.1339 -13.1161 -13.1161 -13.0921 -13.0921 -6.3146 -6.3146 -4.4268 -4.4268 -4.3246 -4.3246 -2.5269 -2.5269 -2.1479 -2.1479 -0.8389 -0.8389 -0.6250 -0.6250 -0.5472 -0.5472 -0.2826 -0.2826 -0.1978 -0.1978 0.0978 0.0978 3.2814 3.2814 3.3517 3.3517 3.4252 3.4252 3.7115 3.7115 3.8534 3.8534 4.0051 4.0051 4.0190 4.0190 4.2508 4.2508 5.3368 5.3368 5.5755 5.5755 11.1606 11.1606 11.4133 11.4133 11.6357 11.6357 12.6932 12.6932 13.0454 13.0454 13.4818 13.4818 k = 0.3289-0.3068-0.1995 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6820 -19.6820 -16.4565 -16.4565 -16.3732 -16.3732 -13.2611 -13.2611 -13.1365 -13.1365 -13.1163 -13.1163 -13.0934 -13.0934 -6.3135 -6.3135 -4.4269 -4.4269 -4.3201 -4.3201 -2.4877 -2.4877 -2.1230 -2.1230 -0.8625 -0.8625 -0.6417 -0.6417 -0.5241 -0.5241 -0.2756 -0.2756 -0.1842 -0.1842 0.0799 0.0799 3.2712 3.2712 3.3439 3.3439 3.3987 3.3987 3.6935 3.6935 3.8591 3.8591 4.0022 4.0022 4.0207 4.0207 4.2434 4.2434 5.3194 5.3194 5.5490 5.5490 11.1839 11.1839 11.4340 11.4340 11.6371 11.6371 12.7076 12.7076 13.0680 13.0680 13.4899 13.4899 k = 0.3421-0.3190-0.2075 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6806 -19.6806 -16.4531 -16.4531 -16.3750 -16.3750 -13.2690 -13.2690 -13.1388 -13.1388 -13.1164 -13.1164 -13.0947 -13.0947 -6.3124 -6.3124 -4.4269 -4.4269 -4.3159 -4.3159 -2.4487 -2.4487 -2.0989 -2.0989 -0.8857 -0.8857 -0.6597 -0.6597 -0.5009 -0.5009 -0.2688 -0.2688 -0.1711 -0.1711 0.0623 0.0623 3.2600 3.2600 3.3362 3.3362 3.3739 3.3739 3.6777 3.6777 3.8646 3.8646 3.9991 3.9991 4.0227 4.0227 4.2361 4.2361 5.3033 5.3033 5.5232 5.5232 11.2046 11.2046 11.4552 11.4552 11.6364 11.6364 12.7168 12.7168 13.0906 13.0906 13.5033 13.5033 k = 0.3553-0.3313-0.2155 ( 6310 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6792 -19.6792 -16.4496 -16.4496 -16.3770 -16.3770 -13.2766 -13.2766 -13.1410 -13.1410 -13.1165 -13.1165 -13.0960 -13.0960 -6.3113 -6.3113 -4.4269 -4.4269 -4.3119 -4.3119 -2.4099 -2.4099 -2.0760 -2.0760 -0.9079 -0.9079 -0.6782 -0.6782 -0.4784 -0.4784 -0.2624 -0.2624 -0.1585 -0.1585 0.0451 0.0451 3.2475 3.2475 3.3286 3.3286 3.3515 3.3515 3.6639 3.6639 3.8698 3.8698 3.9958 3.9958 4.0250 4.0250 4.2290 4.2290 5.2886 5.2886 5.4982 5.4982 11.2229 11.2229 11.4767 11.4767 11.6341 11.6341 12.7220 12.7220 13.1106 13.1106 13.5218 13.5218 k = 0.3684-0.3436-0.2234 ( 6311 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6780 -19.6780 -16.4461 -16.4461 -16.3791 -16.3791 -13.2837 -13.2837 -13.1431 -13.1431 -13.1166 -13.1166 -13.0972 -13.0972 -6.3103 -6.3103 -4.4269 -4.4269 -4.3081 -4.3081 -2.3716 -2.3716 -2.0548 -2.0548 -0.9290 -0.9290 -0.6967 -0.6967 -0.4569 -0.4569 -0.2563 -0.2563 -0.1467 -0.1467 0.0285 0.0285 3.2336 3.2336 3.3210 3.3210 3.3324 3.3324 3.6521 3.6521 3.8746 3.8746 3.9925 3.9925 4.0275 4.0275 4.2222 4.2222 5.2753 5.2753 5.4743 5.4743 11.2388 11.2388 11.4979 11.4979 11.6306 11.6306 12.7244 12.7244 13.1265 13.1265 13.5421 13.5421 k = 0.3816-0.3558-0.2314 ( 6307 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6768 -19.6768 -16.4424 -16.4424 -16.3814 -16.3814 -13.2904 -13.2904 -13.1449 -13.1449 -13.1166 -13.1166 -13.0984 -13.0984 -6.3094 -6.3094 -4.4269 -4.4269 -4.3047 -4.3047 -2.3339 -2.3339 -2.0357 -2.0357 -0.9486 -0.9486 -0.7150 -0.7150 -0.4367 -0.4367 -0.2507 -0.2507 -0.1356 -0.1356 0.0127 0.0127 3.2183 3.2183 3.3122 3.3122 3.3182 3.3182 3.6421 3.6421 3.8790 3.8790 3.9890 3.9890 4.0302 4.0302 4.2158 4.2158 5.2637 5.2637 5.4517 5.4517 11.2525 11.2525 11.5184 11.5184 11.6263 11.6263 12.7251 12.7251 13.1379 13.1379 13.5592 13.5592 k = 0.3947-0.3681-0.2394 ( 6299 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6757 -19.6757 -16.4388 -16.4388 -16.3839 -16.3839 -13.2964 -13.2964 -13.1466 -13.1466 -13.1165 -13.1165 -13.0996 -13.0996 -6.3086 -6.3086 -4.4268 -4.4268 -4.3015 -4.3015 -2.2973 -2.2973 -2.0191 -2.0191 -0.9667 -0.9667 -0.7328 -0.7328 -0.4182 -0.4182 -0.2456 -0.2456 -0.1254 -0.1254 -0.0021 -0.0021 3.2022 3.2022 3.3010 3.3010 3.3099 3.3099 3.6337 3.6337 3.8830 3.8830 3.9856 3.9856 4.0330 4.0330 4.2098 4.2098 5.2535 5.2535 5.4305 5.4305 11.2642 11.2642 11.5376 11.5376 11.6220 11.6220 12.7246 12.7246 13.1456 13.1456 13.5718 13.5718 k = 0.4079-0.3804-0.2474 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6748 -19.6748 -16.4351 -16.4351 -16.3865 -16.3865 -13.3019 -13.3019 -13.1481 -13.1481 -13.1164 -13.1164 -13.1007 -13.1007 -6.3079 -6.3079 -4.4268 -4.4268 -4.2987 -4.2987 -2.2619 -2.2619 -2.0055 -2.0055 -0.9829 -0.9829 -0.7496 -0.7496 -0.4014 -0.4014 -0.2409 -0.2409 -0.1162 -0.1162 -0.0158 -0.0158 3.1860 3.1860 3.2910 3.2910 3.3037 3.3037 3.6269 3.6269 3.8865 3.8865 3.9822 3.9822 4.0358 4.0358 4.2042 4.2042 5.2450 5.2450 5.4109 5.4109 11.2740 11.2740 11.5547 11.5547 11.6182 11.6182 12.7234 12.7234 13.1504 13.1504 13.5812 13.5812 k = 0.4211-0.3926-0.2554 ( 6299 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6739 -19.6739 -16.4313 -16.4313 -16.3893 -16.3893 -13.3067 -13.3067 -13.1494 -13.1494 -13.1163 -13.1163 -13.1017 -13.1017 -6.3072 -6.3072 -4.4267 -4.4267 -4.2963 -4.2963 -2.2282 -2.2282 -1.9950 -1.9950 -0.9971 -0.9971 -0.7652 -0.7652 -0.3866 -0.3866 -0.2367 -0.2367 -0.1081 -0.1081 -0.0281 -0.0281 3.1705 3.1705 3.2828 3.2828 3.2984 3.2984 3.6214 3.6214 3.8895 3.8895 3.9790 3.9790 4.0385 4.0385 4.1991 4.1991 5.2380 5.2380 5.3932 5.3932 11.2822 11.2822 11.5687 11.5687 11.6159 11.6159 12.7219 12.7219 13.1532 13.1532 13.5886 13.5886 k = 0.4342-0.4049-0.2634 ( 6286 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6732 -19.6732 -16.4276 -16.4276 -16.3922 -16.3922 -13.3109 -13.3109 -13.1505 -13.1505 -13.1161 -13.1161 -13.1026 -13.1026 -6.3067 -6.3067 -4.4267 -4.4267 -4.2942 -4.2942 -2.1968 -2.1968 -1.9878 -1.9878 -1.0091 -1.0091 -0.7792 -0.7792 -0.3738 -0.3738 -0.2331 -0.2331 -0.1011 -0.1011 -0.0389 -0.0389 3.1565 3.1565 3.2764 3.2764 3.2938 3.2938 3.6171 3.6171 3.8921 3.8921 3.9761 3.9761 4.0412 4.0412 4.1946 4.1946 5.2324 5.2324 5.3776 5.3776 11.2888 11.2888 11.5781 11.5781 11.6166 11.6166 12.7203 12.7203 13.1548 13.1548 13.5944 13.5944 k = 0.4474-0.4172-0.2713 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6726 -19.6726 -16.4240 -16.4240 -16.3952 -16.3952 -13.3144 -13.3144 -13.1514 -13.1514 -13.1160 -13.1160 -13.1034 -13.1034 -6.3062 -6.3062 -4.4267 -4.4267 -4.2924 -4.2924 -2.1682 -2.1682 -1.9839 -1.9839 -1.0190 -1.0190 -0.7913 -0.7913 -0.3632 -0.3632 -0.2301 -0.2301 -0.0953 -0.0953 -0.0480 -0.0480 3.1445 3.1445 3.2713 3.2713 3.2899 3.2899 3.6137 3.6137 3.8942 3.8942 3.9735 3.9735 4.0435 4.0435 4.1909 4.1909 5.2282 5.2282 5.3643 5.3643 11.2939 11.2939 11.5824 11.5824 11.6207 11.6207 12.7187 12.7187 13.1556 13.1556 13.5990 13.5990 k = 0.4605-0.4295-0.2793 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6721 -19.6721 -16.4204 -16.4204 -16.3983 -16.3983 -13.3171 -13.3171 -13.1521 -13.1521 -13.1158 -13.1158 -13.1040 -13.1040 -6.3059 -6.3059 -4.4266 -4.4266 -4.2911 -4.2911 -2.1434 -2.1434 -1.9829 -1.9829 -1.0266 -1.0266 -0.8011 -0.8011 -0.3550 -0.3550 -0.2277 -0.2277 -0.0907 -0.0907 -0.0552 -0.0552 3.1348 3.1348 3.2675 3.2675 3.2869 3.2869 3.6113 3.6113 3.8959 3.8959 3.9714 3.9714 4.0455 4.0455 4.1878 4.1878 5.2251 5.2251 5.3535 5.3535 11.2978 11.2978 11.5832 11.5832 11.6265 11.6265 12.7175 12.7175 13.1559 13.1559 13.6025 13.6025 k = 0.4737-0.4417-0.2873 ( 6296 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6718 -19.6718 -16.4169 -16.4169 -16.4013 -16.4013 -13.3190 -13.3190 -13.1526 -13.1526 -13.1157 -13.1157 -13.1045 -13.1045 -6.3056 -6.3056 -4.4266 -4.4266 -4.2901 -4.2901 -2.1236 -2.1236 -1.9840 -1.9840 -1.0320 -1.0320 -0.8084 -0.8084 -0.3490 -0.3490 -0.2260 -0.2260 -0.0875 -0.0875 -0.0604 -0.0604 3.1276 3.1276 3.2649 3.2649 3.2847 3.2847 3.6097 3.6097 3.8970 3.8970 3.9698 3.9698 4.0469 4.0469 4.1856 4.1856 5.2232 5.2232 5.3456 5.3456 11.3005 11.3005 11.5827 11.5827 11.6318 11.6318 12.7165 12.7165 13.1561 13.1561 13.6049 13.6049 k = 0.4868-0.4540-0.2953 ( 6291 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6716 -19.6716 -16.4138 -16.4138 -16.4042 -16.4042 -13.3202 -13.3202 -13.1528 -13.1528 -13.1156 -13.1156 -13.1048 -13.1048 -6.3055 -6.3055 -4.4266 -4.4266 -4.2895 -4.2895 -2.1105 -2.1105 -1.9858 -1.9858 -1.0352 -1.0352 -0.8128 -0.8128 -0.3455 -0.3455 -0.2249 -0.2249 -0.0856 -0.0856 -0.0636 -0.0636 3.1233 3.1233 3.2633 3.2633 3.2834 3.2834 3.6088 3.6088 3.8977 3.8977 3.9689 3.9689 4.0478 4.0478 4.1843 4.1843 5.2221 5.2221 5.3408 5.3408 11.3021 11.3021 11.5821 11.5821 11.6353 11.6353 12.7159 12.7159 13.1561 13.1561 13.6064 13.6064 k = 0.5000-0.4663-0.3033 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4122 -16.4122 -16.4057 -16.4057 -13.3206 -13.3206 -13.1529 -13.1529 -13.1156 -13.1156 -13.1049 -13.1049 -6.3054 -6.3054 -4.4266 -4.4266 -4.2893 -4.2893 -2.1059 -2.1059 -1.9866 -1.9866 -1.0362 -1.0362 -0.8144 -0.8144 -0.3443 -0.3443 -0.2246 -0.2246 -0.0849 -0.0849 -0.0646 -0.0646 3.1218 3.1218 3.2628 3.2628 3.2830 3.2830 3.6084 3.6084 3.8980 3.8980 3.9685 3.9685 4.0482 4.0482 4.1838 4.1838 5.2217 5.2217 5.3391 5.3391 11.3027 11.3027 11.5819 11.5819 11.6365 11.6365 12.7156 12.7156 13.1561 13.1561 13.6068 13.6068 k = 0.5000-0.4663-0.3033 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4122 -16.4122 -16.4057 -16.4057 -13.3206 -13.3206 -13.1529 -13.1529 -13.1156 -13.1156 -13.1049 -13.1049 -6.3054 -6.3054 -4.4266 -4.4266 -4.2893 -4.2893 -2.1059 -2.1059 -1.9866 -1.9866 -1.0362 -1.0362 -0.8144 -0.8144 -0.3443 -0.3443 -0.2246 -0.2246 -0.0849 -0.0849 -0.0646 -0.0646 3.1218 3.1218 3.2628 3.2628 3.2830 3.2830 3.6084 3.6084 3.8980 3.8980 3.9685 3.9685 4.0482 4.0482 4.1838 4.1838 5.2217 5.2217 5.3391 5.3391 11.3027 11.3027 11.5819 11.5819 11.6365 11.6365 12.7156 12.7156 13.1561 13.1561 13.6068 13.6068 k = 0.5000-0.4555-0.3197 ( 6296 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4122 -16.4122 -16.4057 -16.4057 -13.3208 -13.3208 -13.1531 -13.1531 -13.1155 -13.1155 -13.1048 -13.1048 -6.3054 -6.3054 -4.4264 -4.4264 -4.2894 -4.2894 -2.1047 -2.1047 -1.9858 -1.9858 -1.0382 -1.0382 -0.8153 -0.8153 -0.3437 -0.3437 -0.2235 -0.2235 -0.0846 -0.0846 -0.0648 -0.0648 3.1218 3.1218 3.2576 3.2576 3.2882 3.2882 3.6082 3.6082 3.8926 3.8926 3.9735 3.9735 4.0490 4.0490 4.1831 4.1831 5.2212 5.2212 5.3380 5.3380 11.3033 11.3033 11.5834 11.5834 11.6366 11.6366 12.7162 12.7162 13.1570 13.1570 13.5975 13.5975 k = 0.5000-0.4448-0.3362 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6714 -19.6714 -16.4120 -16.4120 -16.4058 -16.4058 -13.3213 -13.3213 -13.1536 -13.1536 -13.1153 -13.1153 -13.1047 -13.1047 -6.3053 -6.3053 -4.4256 -4.4256 -4.2898 -4.2898 -2.1013 -2.1013 -1.9833 -1.9833 -1.0441 -1.0441 -0.8180 -0.8180 -0.3421 -0.3421 -0.2205 -0.2205 -0.0836 -0.0836 -0.0652 -0.0652 3.1215 3.1215 3.2477 3.2477 3.2981 3.2981 3.6074 3.6074 3.8794 3.8794 3.9854 3.9854 4.0517 4.0517 4.1812 4.1812 5.2196 5.2196 5.3347 5.3347 11.3051 11.3051 11.5878 11.5878 11.6369 11.6369 12.7179 12.7179 13.1598 13.1598 13.5722 13.5722 k = 0.5000-0.4341-0.3527 ( 6296 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6713 -19.6713 -16.4118 -16.4118 -16.4058 -16.4058 -13.3222 -13.3222 -13.1543 -13.1543 -13.1149 -13.1149 -13.1044 -13.1044 -6.3051 -6.3051 -4.4244 -4.4244 -4.2904 -4.2904 -2.0957 -2.0957 -1.9793 -1.9793 -1.0539 -1.0539 -0.8225 -0.8225 -0.3394 -0.3394 -0.2155 -0.2155 -0.0820 -0.0820 -0.0659 -0.0659 3.1211 3.1211 3.2366 3.2366 3.3091 3.3091 3.6062 3.6062 3.8626 3.8626 3.9999 3.9999 4.0559 4.0559 4.1780 4.1780 5.2171 5.2171 5.3293 5.3293 11.3080 11.3080 11.5952 11.5952 11.6373 11.6373 12.7208 12.7208 13.1644 13.1644 13.5360 13.5360 k = 0.5000-0.4234-0.3691 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6711 -19.6711 -16.4115 -16.4115 -16.4059 -16.4059 -13.3235 -13.3235 -13.1553 -13.1553 -13.1145 -13.1145 -13.1042 -13.1042 -6.3048 -6.3048 -4.4228 -4.4228 -4.2912 -4.2912 -2.0878 -2.0878 -1.9735 -1.9735 -1.0672 -1.0672 -0.8287 -0.8287 -0.3356 -0.3356 -0.2088 -0.2088 -0.0798 -0.0798 -0.0668 -0.0668 3.1205 3.1205 3.2249 3.2249 3.3207 3.3207 3.6049 3.6049 3.8441 3.8441 4.0151 4.0151 4.0617 4.0617 4.1738 4.1738 5.2137 5.2137 5.3219 5.3219 11.3121 11.3121 11.6054 11.6054 11.6379 11.6379 12.7249 12.7249 13.1707 13.1707 13.4936 13.4936 k = 0.5000-0.4127-0.3856 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6709 -19.6709 -16.4111 -16.4111 -16.4059 -16.4059 -13.3251 -13.3251 -13.1565 -13.1565 -13.1138 -13.1138 -13.1038 -13.1038 -6.3044 -6.3044 -4.4207 -4.4207 -4.2923 -4.2923 -2.0778 -2.0778 -1.9662 -1.9662 -1.0840 -1.0840 -0.8364 -0.8364 -0.3309 -0.3309 -0.2007 -0.2007 -0.0771 -0.0771 -0.0680 -0.0680 3.1198 3.1198 3.2128 3.2128 3.3325 3.3325 3.6037 3.6037 3.8249 3.8249 4.0297 4.0297 4.0688 4.0688 4.1686 4.1686 5.2094 5.2094 5.3127 5.3127 11.3170 11.3170 11.6183 11.6183 11.6386 11.6386 12.7301 12.7301 13.1786 13.1786 13.4479 13.4479 k = 0.5000-0.4020-0.4021 ( 6296 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6707 -19.6707 -16.4107 -16.4107 -16.4060 -16.4060 -13.3270 -13.3270 -13.1578 -13.1578 -13.1131 -13.1131 -13.1035 -13.1035 -6.3040 -6.3040 -4.4182 -4.4182 -4.2936 -4.2936 -2.0658 -2.0658 -1.9572 -1.9572 -1.1039 -1.1039 -0.8457 -0.8457 -0.3251 -0.3251 -0.1914 -0.1914 -0.0742 -0.0742 -0.0693 -0.0693 3.1188 3.1188 3.2001 3.2001 3.3446 3.3446 3.6029 3.6029 3.8052 3.8052 4.0429 4.0429 4.0772 4.0772 4.1630 4.1630 5.2046 5.2046 5.3019 5.3019 11.3229 11.3229 11.6335 11.6335 11.6396 11.6396 12.7367 12.7367 13.1878 13.1878 13.4009 13.4009 k = 0.5000-0.3913-0.4185 ( 6298 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6704 -19.6704 -16.4102 -16.4102 -16.4061 -16.4061 -13.3292 -13.3292 -13.1593 -13.1593 -13.1122 -13.1122 -13.1033 -13.1033 -6.3035 -6.3035 -4.4153 -4.4153 -4.2951 -4.2951 -2.0517 -2.0517 -1.9466 -1.9466 -1.1266 -1.1266 -0.8563 -0.8563 -0.3185 -0.3185 -0.1813 -0.1813 -0.0722 -0.0722 -0.0696 -0.0696 3.1177 3.1177 3.1868 3.1868 3.3569 3.3569 3.6028 3.6028 3.7854 3.7854 4.0537 4.0537 4.0865 4.0865 4.1574 4.1574 5.1992 5.1992 5.2898 5.2898 11.3294 11.3294 11.6394 11.6394 11.6523 11.6523 12.7446 12.7446 13.1977 13.1977 13.3540 13.3540 k = 0.5000-0.3806-0.4350 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6701 -19.6701 -16.4097 -16.4097 -16.4062 -16.4062 -13.3316 -13.3316 -13.1608 -13.1608 -13.1112 -13.1112 -13.1031 -13.1031 -6.3030 -6.3030 -4.4120 -4.4120 -4.2968 -4.2968 -2.0359 -2.0359 -1.9344 -1.9344 -1.1519 -1.1519 -0.8681 -0.8681 -0.3109 -0.3109 -0.1706 -0.1706 -0.0733 -0.0733 -0.0667 -0.0667 3.1163 3.1163 3.1730 3.1730 3.3693 3.3693 3.6037 3.6037 3.7655 3.7655 4.0615 4.0615 4.0963 4.0963 4.1531 4.1531 5.1935 5.1935 5.2765 5.2765 11.3364 11.3364 11.6399 11.6399 11.6725 11.6725 12.7539 12.7539 13.2068 13.2068 13.3095 13.3095 k = 0.5000-0.3699-0.4515 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6697 -19.6697 -16.4091 -16.4091 -16.4063 -16.4063 -13.3342 -13.3342 -13.1623 -13.1623 -13.1101 -13.1101 -13.1031 -13.1031 -6.3024 -6.3024 -4.4085 -4.4085 -4.2987 -4.2987 -2.0183 -2.0183 -1.9206 -1.9206 -1.1794 -1.1794 -0.8809 -0.8809 -0.3027 -0.3027 -0.1598 -0.1598 -0.0749 -0.0749 -0.0632 -0.0632 3.1147 3.1147 3.1586 3.1586 3.3818 3.3818 3.6058 3.6058 3.7458 3.7458 4.0651 4.0651 4.1056 4.1056 4.1518 4.1518 5.1877 5.1877 5.2625 5.2625 11.3437 11.3437 11.6402 11.6402 11.6948 11.6948 12.7646 12.7646 13.2082 13.2082 13.2745 13.2745 k = 0.5000-0.3591-0.4679 ( 6298 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6694 -19.6694 -16.4085 -16.4085 -16.4064 -16.4064 -13.3370 -13.3370 -13.1638 -13.1638 -13.1089 -13.1089 -13.1032 -13.1032 -6.3018 -6.3018 -4.4047 -4.4047 -4.3007 -4.3007 -1.9993 -1.9993 -1.9054 -1.9054 -1.2088 -1.2088 -0.8945 -0.8945 -0.2937 -0.2937 -0.1493 -0.1493 -0.0764 -0.0764 -0.0596 -0.0596 3.1128 3.1128 3.1436 3.1436 3.3944 3.3944 3.6092 3.6092 3.7262 3.7262 4.0638 4.0638 4.1138 4.1138 4.1546 4.1546 5.1819 5.1819 5.2481 5.2481 11.3510 11.3510 11.6400 11.6400 11.7190 11.7190 12.7767 12.7767 13.1859 13.1859 13.2653 13.2653 k = 0.5000-0.3484-0.4844 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6690 -19.6690 -16.4079 -16.4079 -16.4064 -16.4064 -13.3399 -13.3399 -13.1652 -13.1652 -13.1076 -13.1076 -13.1034 -13.1034 -6.3012 -6.3012 -4.4007 -4.4007 -4.3029 -4.3029 -1.9788 -1.9788 -1.8888 -1.8888 -1.2400 -1.2400 -0.9087 -0.9087 -0.2842 -0.2842 -0.1398 -0.1398 -0.0773 -0.0773 -0.0562 -0.0562 3.1106 3.1106 3.1283 3.1283 3.4069 3.4069 3.6140 3.6140 3.7068 3.7068 4.0576 4.0576 4.1210 4.1210 4.1614 4.1614 5.1764 5.1764 5.2334 5.2334 11.3582 11.3582 11.6394 11.6394 11.7448 11.7448 12.7904 12.7904 13.1471 13.1471 13.2750 13.2750 k = 0.5000-0.3377-0.5009 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6686 -19.6686 -16.4074 -16.4074 -16.4064 -16.4064 -13.3429 -13.3429 -13.1665 -13.1665 -13.1062 -13.1062 -13.1038 -13.1038 -6.3006 -6.3006 -4.3965 -4.3965 -4.3052 -4.3052 -1.9573 -1.9573 -1.8708 -1.8708 -1.2725 -1.2725 -0.9233 -0.9233 -0.2743 -0.2743 -0.1320 -0.1320 -0.0770 -0.0770 -0.0531 -0.0531 3.1070 3.1070 3.1137 3.1137 3.4193 3.4193 3.6203 3.6203 3.6876 3.6876 4.0475 4.0475 4.1277 4.1277 4.1708 4.1708 5.1713 5.1713 5.2189 5.2189 11.3649 11.3649 11.6382 11.6382 11.7720 11.7720 12.8055 12.8055 13.1049 13.1049 13.2905 13.2905 k = 0.5000-0.3270-0.5173 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6683 -19.6683 -16.4070 -16.4070 -16.4063 -16.4063 -13.3460 -13.3460 -13.1676 -13.1676 -13.1050 -13.1050 -13.1040 -13.1040 -6.3000 -6.3000 -4.3923 -4.3923 -4.3076 -4.3076 -1.9348 -1.9348 -1.8517 -1.8517 -1.3060 -1.3060 -0.9379 -0.9379 -0.2641 -0.2641 -0.1268 -0.1268 -0.0748 -0.0748 -0.0501 -0.0501 3.0949 3.0949 3.1073 3.1073 3.4317 3.4317 3.6278 3.6278 3.6689 3.6689 4.0346 4.0346 4.1341 4.1341 4.1814 4.1814 5.1668 5.1668 5.2049 5.2049 11.3708 11.3708 11.6363 11.6363 11.8005 11.8005 12.8219 12.8219 13.0630 13.0630 13.3084 13.3084 k = 0.5000-0.3163-0.5338 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6679 -19.6679 -16.4068 -16.4068 -16.4060 -16.4060 -13.3490 -13.3490 -13.1686 -13.1686 -13.1054 -13.1054 -13.1027 -13.1027 -6.2994 -6.2994 -4.3879 -4.3879 -4.3101 -4.3101 -1.9118 -1.9118 -1.8319 -1.8319 -1.3401 -1.3401 -0.9524 -0.9524 -0.2538 -0.2538 -0.1247 -0.1247 -0.0705 -0.0705 -0.0476 -0.0476 3.0789 3.0789 3.1044 3.1044 3.4439 3.4439 3.6350 3.6350 3.6521 3.6521 4.0200 4.0200 4.1401 4.1401 4.1924 4.1924 5.1630 5.1630 5.1915 5.1915 11.3758 11.3758 11.6335 11.6335 11.8298 11.8298 12.8391 12.8391 13.0229 13.0229 13.3276 13.3276 k = 0.5000-0.3056-0.5503 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6675 -19.6675 -16.4067 -16.4067 -16.4056 -16.4056 -13.3520 -13.3520 -13.1694 -13.1694 -13.1063 -13.1063 -13.1011 -13.1011 -6.2988 -6.2988 -4.3836 -4.3836 -4.3126 -4.3126 -1.8886 -1.8886 -1.8116 -1.8116 -1.3742 -1.3742 -0.9665 -0.9665 -0.2436 -0.2436 -0.1254 -0.1254 -0.0644 -0.0644 -0.0454 -0.0454 3.0626 3.0626 3.1016 3.1016 3.4559 3.4559 3.6278 3.6278 3.6510 3.6510 4.0043 4.0043 4.1458 4.1458 4.2035 4.2035 5.1600 5.1600 5.1791 5.1791 11.3795 11.3795 11.6299 11.6299 11.8599 11.8599 12.8557 12.8557 12.9865 12.9865 13.3476 13.3476 k = 0.5000-0.2949-0.5668 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6672 -19.6672 -16.4066 -16.4066 -16.4053 -16.4053 -13.3548 -13.3548 -13.1699 -13.1699 -13.1074 -13.1074 -13.0993 -13.0993 -6.2982 -6.2982 -4.3794 -4.3794 -4.3152 -4.3152 -1.8655 -1.8655 -1.7916 -1.7916 -1.4076 -1.4076 -0.9798 -0.9798 -0.2337 -0.2337 -0.1280 -0.1280 -0.0577 -0.0577 -0.0433 -0.0433 3.0464 3.0464 3.0990 3.0990 3.4678 3.4678 3.6103 3.6103 3.6615 3.6615 3.9880 3.9880 4.1512 4.1512 4.2145 4.2145 5.1575 5.1575 5.1683 5.1683 11.3816 11.3816 11.6251 11.6251 11.8906 11.8906 12.8670 12.8670 12.9585 12.9585 13.3681 13.3681 k = 0.5000-0.2842-0.5832 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6669 -19.6669 -16.4065 -16.4065 -16.4050 -16.4050 -13.3575 -13.3575 -13.1702 -13.1702 -13.1087 -13.1087 -13.0974 -13.0974 -6.2977 -6.2977 -4.3754 -4.3754 -4.3177 -4.3177 -1.8430 -1.8430 -1.7731 -1.7731 -1.4391 -1.4391 -0.9919 -0.9919 -0.2242 -0.2242 -0.1320 -0.1320 -0.0518 -0.0518 -0.0408 -0.0408 3.0304 3.0304 3.0963 3.0963 3.4795 3.4795 3.5922 3.5922 3.6738 3.6738 3.9715 3.9715 4.1563 4.1563 4.2252 4.2252 5.1535 5.1535 5.1613 5.1613 11.3820 11.3820 11.6192 11.6192 11.9216 11.9216 12.8623 12.8623 12.9498 12.9498 13.3886 13.3886 k = 0.5000-0.2735-0.5997 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6667 -19.6667 -16.4064 -16.4064 -16.4049 -16.4049 -13.3600 -13.3600 -13.1702 -13.1702 -13.1102 -13.1102 -13.0955 -13.0955 -6.2972 -6.2972 -4.3715 -4.3715 -4.3201 -4.3201 -1.8215 -1.8215 -1.7579 -1.7579 -1.4667 -1.4667 -1.0024 -1.0024 -0.2155 -0.2155 -0.1368 -0.1368 -0.0483 -0.0483 -0.0367 -0.0367 3.0150 3.0150 3.0937 3.0937 3.4910 3.4910 3.5741 3.5741 3.6868 3.6868 3.9551 3.9551 4.1613 4.1613 4.2357 4.2357 5.1464 5.1464 5.1601 5.1601 11.3803 11.3803 11.6119 11.6119 11.9528 11.9528 12.8396 12.8396 12.9621 12.9621 13.4076 13.4076 k = 0.5000-0.2628-0.6162 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6664 -19.6664 -16.4062 -16.4062 -16.4048 -16.4048 -13.3622 -13.3622 -13.1700 -13.1700 -13.1118 -13.1118 -13.0936 -13.0936 -6.2968 -6.2968 -4.3680 -4.3680 -4.3223 -4.3223 -1.8015 -1.8015 -1.7489 -1.7489 -1.4875 -1.4875 -1.0110 -1.0110 -0.2078 -0.2078 -0.1419 -0.1419 -0.0474 -0.0474 -0.0311 -0.0311 3.0002 3.0002 3.0913 3.0913 3.5023 3.5023 3.5563 3.5563 3.7004 3.7004 3.9392 3.9392 4.1661 4.1661 4.2458 4.2458 5.1394 5.1394 5.1614 5.1614 11.3764 11.3764 11.6033 11.6033 11.9841 11.9841 12.8103 12.8103 12.9843 12.9843 13.4198 13.4198 k = 0.5000-0.2520-0.6326 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6663 -19.6663 -16.4060 -16.4060 -16.4049 -16.4049 -13.3642 -13.3642 -13.1695 -13.1695 -13.1136 -13.1136 -13.0915 -13.0915 -6.2965 -6.2965 -4.3650 -4.3650 -4.3244 -4.3244 -1.7839 -1.7839 -1.7493 -1.7493 -1.4981 -1.4981 -1.0171 -1.0171 -0.2017 -0.2017 -0.1469 -0.1469 -0.0480 -0.0480 -0.0254 -0.0254 2.9862 2.9862 3.0891 3.0891 3.5132 3.5132 3.5390 3.5390 3.7141 3.7141 3.9239 3.9239 4.1711 4.1711 4.2557 4.2557 5.1337 5.1337 5.1643 5.1643 11.3701 11.3701 11.5931 11.5931 12.0153 12.0153 12.7799 12.7799 13.0103 13.0103 13.4099 13.4099 k = 0.5000-0.2413-0.6491 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6662 -19.6662 -16.4058 -16.4058 -16.4051 -16.4051 -13.3657 -13.3657 -13.1686 -13.1686 -13.1155 -13.1155 -13.0895 -13.0895 -6.2962 -6.2962 -4.3625 -4.3625 -4.3260 -4.3260 -1.7710 -1.7710 -1.7593 -1.7593 -1.4965 -1.4965 -1.0203 -1.0203 -0.1977 -0.1977 -0.1511 -0.1511 -0.0497 -0.0497 -0.0201 -0.0201 2.9732 2.9732 3.0872 3.0872 3.5189 3.5189 3.5272 3.5272 3.7278 3.7278 3.9095 3.9095 4.1764 4.1764 4.2653 4.2653 5.1296 5.1296 5.1684 5.1684 11.3613 11.3613 11.5814 11.5814 12.0464 12.0464 12.7501 12.7501 13.0381 13.0381 13.3812 13.3812 k = 0.5000-0.2306-0.6656 ( 6288 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6661 -19.6661 -16.4060 -16.4060 -16.4049 -16.4049 -13.3669 -13.3669 -13.1675 -13.1675 -13.1176 -13.1176 -13.0874 -13.0874 -6.2960 -6.2960 -4.3607 -4.3607 -4.3272 -4.3272 -1.7866 -1.7866 -1.7547 -1.7547 -1.4836 -1.4836 -1.0203 -1.0203 -0.1965 -0.1965 -0.1540 -0.1540 -0.0523 -0.0523 -0.0157 -0.0157 2.9613 2.9613 3.0856 3.0856 3.5044 3.5044 3.5359 3.5359 3.7411 3.7411 3.8962 3.8962 4.1821 4.1821 4.2745 4.2745 5.1271 5.1271 5.1739 5.1739 11.3499 11.3499 11.5681 11.5681 12.0772 12.0772 12.7217 12.7217 13.0666 13.0666 13.3483 13.3483 k = 0.5000-0.2199-0.6820 ( 6290 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6662 -19.6662 -16.4066 -16.4066 -16.4045 -16.4045 -13.3676 -13.3676 -13.1661 -13.1661 -13.1197 -13.1197 -13.0854 -13.0854 -6.2959 -6.2959 -4.3597 -4.3597 -4.3279 -4.3279 -1.8173 -1.8173 -1.7465 -1.7465 -1.4623 -1.4623 -1.0167 -1.0167 -0.1985 -0.1985 -0.1553 -0.1553 -0.0557 -0.0557 -0.0121 -0.0121 2.9506 2.9506 3.0844 3.0844 3.4891 3.4891 3.5461 3.5461 3.7539 3.7539 3.8840 3.8840 4.1885 4.1885 4.2833 4.2833 5.1264 5.1264 5.1805 5.1805 11.3358 11.3358 11.5531 11.5531 12.1077 12.1077 12.6948 12.6948 13.0946 13.0946 13.3158 13.3158 k = 0.5000-0.2092-0.6985 ( 6284 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6663 -19.6663 -16.4075 -16.4075 -16.4040 -16.4040 -13.3678 -13.3678 -13.1644 -13.1644 -13.1218 -13.1218 -13.0833 -13.0833 -6.2958 -6.2958 -4.3595 -4.3595 -4.3280 -4.3280 -1.8536 -1.8536 -1.7419 -1.7419 -1.4352 -1.4352 -1.0094 -1.0094 -0.2030 -0.2030 -0.1554 -0.1554 -0.0599 -0.0599 -0.0094 -0.0094 2.9414 2.9414 3.0837 3.0837 3.4748 3.4748 3.5562 3.5562 3.7659 3.7659 3.8730 3.8730 4.1958 4.1958 4.2917 4.2917 5.1274 5.1274 5.1884 5.1884 11.3190 11.3190 11.5365 11.5365 12.1378 12.1378 12.6698 12.6698 13.1206 13.1206 13.2859 13.2859 k = 0.5000-0.1985-0.7150 ( 6286 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6665 -19.6665 -16.4086 -16.4086 -16.4033 -16.4033 -13.3676 -13.3676 -13.1624 -13.1624 -13.1240 -13.1240 -13.0812 -13.0812 -6.2959 -6.2959 -4.3601 -4.3601 -4.3276 -4.3276 -1.8935 -1.8935 -1.7412 -1.7412 -1.4043 -1.4043 -0.9983 -0.9983 -0.2094 -0.2094 -0.1553 -0.1553 -0.0649 -0.0649 -0.0078 -0.0078 2.9336 2.9336 3.0835 3.0835 3.4618 3.4618 3.5660 3.5660 3.7771 3.7771 3.8633 3.8633 4.2040 4.2040 4.2997 4.2997 5.1302 5.1302 5.1974 5.1974 11.2995 11.2995 11.5180 11.5180 12.1674 12.1674 12.6466 12.6466 13.1417 13.1417 13.2614 13.2614 k = 0.5000-0.1878-0.7314 ( 6288 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6668 -19.6668 -16.4099 -16.4099 -16.4026 -16.4026 -13.3668 -13.3668 -13.1602 -13.1602 -13.1262 -13.1262 -13.0791 -13.0791 -6.2960 -6.2960 -4.3613 -4.3613 -4.3269 -4.3269 -1.9357 -1.9357 -1.7446 -1.7446 -1.3708 -1.3708 -0.9835 -0.9835 -0.2169 -0.2169 -0.1555 -0.1555 -0.0706 -0.0706 -0.0071 -0.0071 2.9274 2.9274 3.0839 3.0839 3.4504 3.4504 3.5755 3.5755 3.7873 3.7873 3.8550 3.8550 4.2132 4.2132 4.3072 4.3072 5.1348 5.1348 5.2075 5.2075 11.2774 11.2774 11.4979 11.4979 12.1964 12.1964 12.6253 12.6253 13.1514 13.1514 13.2486 13.2486 k = 0.5000-0.1771-0.7479 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6671 -19.6671 -16.4115 -16.4115 -16.4018 -16.4018 -13.3654 -13.3654 -13.1577 -13.1577 -13.1283 -13.1283 -13.0770 -13.0770 -6.2962 -6.2962 -4.3630 -4.3630 -4.3260 -4.3260 -1.9795 -1.9795 -1.7518 -1.7518 -1.3356 -1.3356 -0.9653 -0.9653 -0.2250 -0.2250 -0.1567 -0.1567 -0.0770 -0.0770 -0.0073 -0.0073 2.9229 2.9229 3.0848 3.0848 3.4410 3.4410 3.5845 3.5845 3.7963 3.7963 3.8480 3.8480 4.2234 4.2234 4.3143 4.3143 5.1412 5.1412 5.2187 5.2187 11.2528 11.2528 11.4760 11.4760 12.2249 12.2249 12.6061 12.6061 13.1444 13.1444 13.2525 13.2525 k = 0.7885-0.0516-0.4651 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6671 -19.6671 -16.4115 -16.4115 -16.4018 -16.4018 -13.3655 -13.3655 -13.1577 -13.1577 -13.1283 -13.1283 -13.0770 -13.0770 -6.2962 -6.2962 -4.3630 -4.3630 -4.3260 -4.3260 -1.9795 -1.9795 -1.7518 -1.7518 -1.3356 -1.3356 -0.9653 -0.9653 -0.2250 -0.2250 -0.1567 -0.1567 -0.0770 -0.0770 -0.0073 -0.0073 2.9229 2.9229 3.0848 3.0848 3.4410 3.4410 3.5845 3.5845 3.7963 3.7963 3.8479 3.8479 4.2234 4.2234 4.3142 4.3142 5.1413 5.1413 5.2187 5.2187 11.2528 11.2528 11.4760 11.4760 12.2249 12.2249 12.6061 12.6061 13.1444 13.1444 13.2525 13.2525 k = 0.7807-0.0444-0.4487 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6676 -19.6676 -16.4133 -16.4133 -16.4008 -16.4008 -13.3636 -13.3636 -13.1551 -13.1551 -13.1303 -13.1303 -13.0749 -13.0749 -6.2965 -6.2965 -4.3650 -4.3650 -4.3251 -4.3251 -2.0241 -2.0241 -1.7628 -1.7628 -1.2994 -1.2994 -0.9442 -0.9442 -0.2334 -0.2334 -0.1590 -0.1590 -0.0840 -0.0840 -0.0085 -0.0085 2.9201 2.9201 3.0862 3.0862 3.4336 3.4336 3.5932 3.5932 3.8042 3.8042 3.8423 3.8423 4.2347 4.2347 4.3207 4.3207 5.1495 5.1495 5.2309 5.2309 11.2259 11.2259 11.4526 11.4526 12.2527 12.2527 12.5889 12.5889 13.1263 13.1263 13.2672 13.2672 k = 0.7729-0.0371-0.4323 ( 6296 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6682 -19.6682 -16.4153 -16.4153 -16.3998 -16.3998 -13.3611 -13.3611 -13.1523 -13.1523 -13.1321 -13.1321 -13.0729 -13.0729 -6.2969 -6.2969 -4.3672 -4.3672 -4.3242 -4.3242 -2.0694 -2.0694 -1.7771 -1.7771 -1.2625 -1.2625 -0.9205 -0.9205 -0.2420 -0.2420 -0.1626 -0.1626 -0.0915 -0.0915 -0.0106 -0.0106 2.9191 2.9191 3.0883 3.0883 3.4285 3.4285 3.6015 3.6015 3.8107 3.8107 3.8381 3.8381 4.2470 4.2470 4.3265 4.3265 5.1597 5.1597 5.2440 5.2440 11.1966 11.1966 11.4275 11.4275 12.2797 12.2797 12.5738 12.5738 13.1043 13.1043 13.2852 13.2852 k = 0.7651-0.0298-0.4159 ( 6298 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6688 -19.6688 -16.4176 -16.4176 -16.3987 -16.3987 -13.3580 -13.3580 -13.1496 -13.1496 -13.1336 -13.1336 -13.0710 -13.0710 -6.2973 -6.2973 -4.3695 -4.3695 -4.3235 -4.3235 -2.1152 -2.1152 -1.7945 -1.7945 -1.2252 -1.2252 -0.8946 -0.8946 -0.2505 -0.2505 -0.1678 -0.1678 -0.0993 -0.0993 -0.0136 -0.0136 2.9198 2.9198 3.0910 3.0910 3.4257 3.4257 3.6094 3.6094 3.8158 3.8158 3.8355 3.8355 4.2601 4.2601 4.3317 4.3317 5.1717 5.1717 5.2581 5.2581 11.1653 11.1653 11.4007 11.4007 12.3059 12.3059 12.5608 12.5608 13.0818 13.0818 13.3030 13.3030 k = 0.7573-0.0225-0.3995 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6695 -19.6695 -16.4201 -16.4201 -16.3975 -16.3975 -13.3543 -13.3543 -13.1473 -13.1473 -13.1344 -13.1344 -13.0690 -13.0690 -6.2979 -6.2979 -4.3719 -4.3719 -4.3230 -4.3230 -2.1611 -2.1611 -1.8145 -1.8145 -1.1878 -1.1878 -0.8670 -0.8670 -0.2589 -0.2589 -0.1746 -0.1746 -0.1072 -0.1072 -0.0173 -0.0173 2.9223 2.9223 3.0943 3.0943 3.4253 3.4253 3.6169 3.6169 3.8193 3.8193 3.8348 3.8348 4.2741 4.2741 4.3364 4.3364 5.1856 5.1856 5.2732 5.2732 11.1320 11.1320 11.3723 11.3723 12.3314 12.3314 12.5500 12.5500 13.0599 13.0599 13.3192 13.3192 k = 0.7495-0.0153-0.3831 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6704 -19.6704 -16.4228 -16.4228 -16.3962 -16.3962 -13.3501 -13.3501 -13.1459 -13.1459 -13.1340 -13.1340 -13.0671 -13.0671 -6.2985 -6.2985 -4.3743 -4.3743 -4.3228 -4.3228 -2.2072 -2.2072 -1.8371 -1.8371 -1.1506 -1.1506 -0.8382 -0.8382 -0.2670 -0.2670 -0.1833 -0.1833 -0.1150 -0.1150 -0.0219 -0.0219 2.9265 2.9265 3.0982 3.0982 3.4274 3.4274 3.6242 3.6242 3.8213 3.8213 3.8359 3.8359 4.2886 4.2886 4.3404 4.3404 5.2014 5.2014 5.2891 5.2891 11.0969 11.0969 11.3423 11.3423 12.3560 12.3560 12.5414 12.5414 13.0394 13.0394 13.3331 13.3331 k = 0.7417-0.0080-0.3668 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6713 -19.6713 -16.4258 -16.4258 -16.3948 -16.3948 -13.3453 -13.3453 -13.1457 -13.1457 -13.1321 -13.1321 -13.0653 -13.0653 -6.2992 -6.2992 -4.3768 -4.3768 -4.3228 -4.3228 -2.2531 -2.2531 -1.8617 -1.8617 -1.1139 -1.1139 -0.8085 -0.8085 -0.2748 -0.2748 -0.1937 -0.1937 -0.1225 -0.1225 -0.0271 -0.0271 2.9323 2.9323 3.1027 3.1027 3.4319 3.4319 3.6312 3.6312 3.8226 3.8226 3.8381 3.8381 4.3037 4.3037 4.3438 4.3438 5.2190 5.2190 5.3059 5.3059 11.0603 11.0603 11.3108 11.3108 12.3796 12.3796 12.5351 12.5351 13.0203 13.0203 13.3444 13.3444 k = 0.7339-0.0007-0.3504 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6723 -19.6723 -16.4289 -16.4289 -16.3933 -16.3933 -13.3399 -13.3399 -13.1463 -13.1463 -13.1291 -13.1291 -13.0635 -13.0635 -6.3000 -6.3000 -4.3791 -4.3791 -4.3232 -4.3232 -2.2987 -2.2987 -1.8883 -1.8883 -1.0778 -1.0778 -0.7782 -0.7782 -0.2822 -0.2822 -0.2060 -0.2060 -0.1296 -0.1296 -0.0329 -0.0329 2.9397 2.9397 3.1078 3.1078 3.4387 3.4387 3.6380 3.6380 3.8241 3.8241 3.8405 3.8405 4.3190 4.3190 4.3468 4.3468 5.2383 5.2383 5.3235 5.3235 11.0222 11.0222 11.2779 11.2779 12.4022 12.4022 12.5312 12.5312 13.0029 13.0029 13.3529 13.3529 k = 0.7261 0.0065-0.3340 ( 6298 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6734 -19.6734 -16.4323 -16.4323 -16.3917 -16.3917 -13.3340 -13.3340 -13.1473 -13.1473 -13.1255 -13.1255 -13.0618 -13.0618 -6.3008 -6.3008 -4.3815 -4.3815 -4.3238 -4.3238 -2.3440 -2.3440 -1.9165 -1.9165 -1.0426 -1.0426 -0.7477 -0.7477 -0.2891 -0.2891 -0.2199 -0.2199 -0.1364 -0.1364 -0.0393 -0.0393 2.9486 2.9486 3.1134 3.1134 3.4477 3.4477 3.6446 3.6446 3.8261 3.8261 3.8429 3.8429 4.3344 4.3344 4.3494 4.3494 5.2594 5.2594 5.3418 5.3418 10.9829 10.9829 11.2435 11.2435 12.4237 12.4237 12.5296 12.5296 12.9874 12.9874 13.3586 13.3586 k = 0.7183 0.0138-0.3176 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6746 -19.6746 -16.4358 -16.4358 -16.3901 -16.3901 -13.3275 -13.3275 -13.1484 -13.1484 -13.1215 -13.1215 -13.0602 -13.0602 -6.3017 -6.3017 -4.3837 -4.3837 -4.3247 -4.3247 -2.3887 -2.3887 -1.9461 -1.9461 -1.0084 -1.0084 -0.7172 -0.7172 -0.2954 -0.2954 -0.2352 -0.2352 -0.1427 -0.1427 -0.0461 -0.0461 2.9588 2.9588 3.1196 3.1196 3.4586 3.4586 3.6513 3.6513 3.8289 3.8289 3.8451 3.8451 4.3478 4.3478 4.3538 4.3538 5.2822 5.2822 5.3608 5.3608 10.9425 10.9425 11.2077 11.2077 12.4441 12.4441 12.5305 12.5305 12.9736 12.9736 13.3616 13.3616 k = 0.7105 0.0211-0.3012 ( 6282 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6758 -19.6758 -16.4395 -16.4395 -16.3884 -16.3884 -13.3206 -13.3206 -13.1494 -13.1494 -13.1173 -13.1173 -13.0586 -13.0586 -6.3027 -6.3027 -4.3859 -4.3859 -4.3260 -4.3260 -2.4327 -2.4327 -1.9770 -1.9770 -0.9755 -0.9755 -0.6870 -0.6870 -0.3010 -0.3010 -0.2518 -0.2518 -0.1486 -0.1486 -0.0534 -0.0534 2.9702 2.9702 3.1263 3.1263 3.4713 3.4713 3.6580 3.6580 3.8326 3.8326 3.8472 3.8472 4.3520 4.3520 4.3671 4.3671 5.3064 5.3064 5.3805 5.3805 10.9014 10.9014 11.1708 11.1708 12.4632 12.4632 12.5340 12.5340 12.9617 12.9617 13.3619 13.3619 k = 0.7027 0.0284-0.2848 ( 6288 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6772 -19.6772 -16.4434 -16.4434 -16.3866 -16.3866 -13.3132 -13.3132 -13.1502 -13.1502 -13.1130 -13.1130 -13.0571 -13.0571 -6.3037 -6.3037 -4.3880 -4.3880 -4.3275 -4.3275 -2.4760 -2.4760 -2.0090 -2.0090 -0.9440 -0.9440 -0.6572 -0.6572 -0.3059 -0.3059 -0.2694 -0.2694 -0.1543 -0.1543 -0.0609 -0.0609 2.9826 2.9826 3.1334 3.1334 3.4854 3.4854 3.6648 3.6648 3.8373 3.8373 3.8490 3.8490 4.3539 4.3539 4.3823 4.3823 5.3322 5.3322 5.4007 5.4007 10.8596 10.8596 11.1326 11.1326 12.4811 12.4811 12.5401 12.5401 12.9516 12.9516 13.3595 13.3595 k = 0.6949 0.0356-0.2684 ( 6290 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6785 -19.6785 -16.4474 -16.4474 -16.3848 -16.3848 -13.3053 -13.3053 -13.1510 -13.1510 -13.1087 -13.1087 -13.0557 -13.0557 -6.3048 -6.3048 -4.3900 -4.3900 -4.3294 -4.3294 -2.5183 -2.5183 -2.0418 -2.0418 -0.9141 -0.9141 -0.6280 -0.6280 -0.3102 -0.3102 -0.2877 -0.2877 -0.1596 -0.1596 -0.0687 -0.0687 2.9959 2.9959 3.1408 3.1408 3.5006 3.5006 3.6720 3.6720 3.8428 3.8428 3.8508 3.8508 4.3557 4.3557 4.3974 4.3974 5.3592 5.3592 5.4214 5.4214 10.8174 10.8174 11.0934 11.0934 12.4977 12.4977 12.5486 12.5486 12.9434 12.9434 13.3547 13.3547 k = 0.6871 0.0429-0.2520 ( 6298 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6800 -19.6800 -16.4514 -16.4514 -16.3829 -16.3829 -13.2971 -13.2971 -13.1515 -13.1515 -13.1043 -13.1043 -13.0544 -13.0544 -6.3059 -6.3059 -4.3919 -4.3919 -4.3315 -4.3315 -2.5596 -2.5596 -2.0754 -2.0754 -0.8858 -0.8858 -0.5995 -0.5995 -0.3137 -0.3137 -0.3065 -0.3065 -0.1646 -0.1646 -0.0767 -0.0767 3.0098 3.0098 3.1485 3.1485 3.5166 3.5166 3.6794 3.6794 3.8489 3.8489 3.8530 3.8530 4.3576 4.3576 4.4122 4.4122 5.3874 5.3874 5.4426 5.4426 10.7750 10.7750 11.0533 11.0533 12.5131 12.5131 12.5595 12.5595 12.9370 12.9370 13.3476 13.3476 k = 0.6793 0.0502-0.2356 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6814 -19.6814 -16.4556 -16.4556 -16.3810 -16.3810 -13.2886 -13.2886 -13.1519 -13.1519 -13.1000 -13.1000 -13.0531 -13.0531 -6.3071 -6.3071 -4.3937 -4.3937 -4.3340 -4.3340 -2.5997 -2.5997 -2.1096 -2.1096 -0.8593 -0.8593 -0.5720 -0.5720 -0.3258 -0.3258 -0.3163 -0.3163 -0.1693 -0.1693 -0.0848 -0.0848 3.0242 3.0242 3.1563 3.1563 3.5331 3.5331 3.6873 3.6873 3.8527 3.8527 3.8584 3.8584 4.3598 4.3598 4.4266 4.4266 5.4166 5.4166 5.4641 5.4641 10.7325 10.7325 11.0125 11.0125 12.5278 12.5278 12.5723 12.5723 12.9323 12.9323 13.3382 13.3382 k = 0.6715 0.0574-0.2192 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6830 -19.6830 -16.4599 -16.4599 -16.3791 -16.3791 -13.2798 -13.2798 -13.1521 -13.1521 -13.0957 -13.0957 -13.0520 -13.0520 -6.3083 -6.3083 -4.3953 -4.3953 -4.3367 -4.3367 -2.6385 -2.6385 -2.1442 -2.1442 -0.8346 -0.8346 -0.5455 -0.5455 -0.3451 -0.3451 -0.3183 -0.3183 -0.1738 -0.1738 -0.0929 -0.0929 3.0389 3.0389 3.1641 3.1641 3.5499 3.5499 3.6956 3.6956 3.8546 3.8546 3.8668 3.8668 4.3626 4.3626 4.4405 4.4405 5.4468 5.4468 5.4859 5.4859 10.6902 10.6902 10.9710 10.9710 12.5417 12.5417 12.5868 12.5868 12.9294 12.9294 13.3268 13.3268 k = 0.6637 0.0647-0.2028 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6845 -19.6845 -16.4641 -16.4641 -16.3772 -16.3772 -13.2708 -13.2708 -13.1520 -13.1520 -13.0914 -13.0914 -13.0509 -13.0509 -6.3095 -6.3095 -4.3968 -4.3968 -4.3397 -4.3397 -2.6760 -2.6760 -2.1790 -2.1790 -0.8117 -0.8117 -0.5202 -0.5202 -0.3641 -0.3641 -0.3196 -0.3196 -0.1780 -0.1780 -0.1009 -0.1009 3.0537 3.0537 3.1719 3.1719 3.5665 3.5665 3.7043 3.7043 3.8562 3.8562 3.8764 3.8764 4.3662 4.3662 4.4539 4.4539 5.4776 5.4776 5.5079 5.5079 10.6482 10.6482 10.9292 10.9292 12.5551 12.5551 12.6029 12.6029 12.9280 12.9280 13.3137 13.3137 k = 0.6559 0.0720-0.1864 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6861 -19.6861 -16.4684 -16.4684 -16.3752 -16.3752 -13.2616 -13.2616 -13.1518 -13.1518 -13.0873 -13.0873 -13.0499 -13.0499 -6.3107 -6.3107 -4.3982 -4.3982 -4.3429 -4.3429 -2.7120 -2.7120 -2.2139 -2.2139 -0.7906 -0.7906 -0.4966 -0.4966 -0.3825 -0.3825 -0.3203 -0.3203 -0.1818 -0.1818 -0.1088 -0.1088 3.0684 3.0684 3.1794 3.1794 3.5829 3.5829 3.7133 3.7133 3.8579 3.8579 3.8868 3.8868 4.3707 4.3707 4.4667 4.4667 5.5090 5.5090 5.5300 5.5300 10.6068 10.6068 10.8873 10.8873 12.5676 12.5676 12.6205 12.6205 12.9283 12.9283 13.2988 13.2988 k = 0.6481 0.0793-0.1700 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6876 -19.6876 -16.4727 -16.4727 -16.3733 -16.3733 -13.2523 -13.2523 -13.1514 -13.1514 -13.0834 -13.0834 -13.0490 -13.0490 -6.3119 -6.3119 -4.3995 -4.3995 -4.3464 -4.3464 -2.7464 -2.7464 -2.2487 -2.2487 -0.7713 -0.7713 -0.4756 -0.4756 -0.3992 -0.3992 -0.3205 -0.3205 -0.1855 -0.1855 -0.1165 -0.1165 3.0829 3.0829 3.1867 3.1867 3.5987 3.5987 3.7226 3.7226 3.8600 3.8600 3.8979 3.8979 4.3763 4.3763 4.4789 4.4789 5.5407 5.5407 5.5522 5.5522 10.5660 10.5660 10.8453 10.8453 12.5792 12.5792 12.6398 12.6398 12.9299 12.9299 13.2825 13.2825 k = 0.6403 0.0865-0.1537 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6892 -19.6892 -16.4769 -16.4769 -16.3714 -16.3714 -13.2429 -13.2429 -13.1508 -13.1508 -13.0795 -13.0795 -13.0483 -13.0483 -6.3132 -6.3132 -4.4006 -4.4006 -4.3501 -4.3501 -2.7791 -2.7791 -2.2832 -2.2832 -0.7537 -0.7537 -0.4604 -0.4604 -0.4108 -0.4108 -0.3201 -0.3201 -0.1888 -0.1888 -0.1240 -0.1240 3.0970 3.0970 3.1937 3.1937 3.6139 3.6139 3.7320 3.7320 3.8625 3.8625 3.9093 3.9093 4.3833 4.3833 4.4904 4.4904 5.5719 5.5719 5.5748 5.5748 10.5261 10.5261 10.8036 10.8036 12.5896 12.5896 12.6607 12.6607 12.9330 12.9330 13.2651 13.2651 k = 0.6326 0.0938-0.1373 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6908 -19.6908 -16.4811 -16.4811 -16.3695 -16.3695 -13.2335 -13.2335 -13.1500 -13.1500 -13.0759 -13.0759 -13.0476 -13.0476 -6.3144 -6.3144 -4.4016 -4.4016 -4.3539 -4.3539 -2.8101 -2.8101 -2.3173 -2.3173 -0.7377 -0.7377 -0.4594 -0.4594 -0.4090 -0.4090 -0.3195 -0.3195 -0.1920 -0.1920 -0.1311 -0.1311 3.1107 3.1107 3.2001 3.2001 3.6284 3.6284 3.7413 3.7413 3.8657 3.8657 3.9207 3.9207 4.3915 4.3915 4.5012 4.5012 5.5955 5.5955 5.6048 5.6048 10.4873 10.4873 10.7623 10.7623 12.5987 12.5987 12.6831 12.6831 12.9373 12.9373 13.2466 13.2466 k = 0.6248 0.1011-0.1209 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6923 -19.6923 -16.4852 -16.4852 -16.3676 -16.3676 -13.2242 -13.2242 -13.1491 -13.1491 -13.0724 -13.0724 -13.0470 -13.0470 -6.3156 -6.3156 -4.4026 -4.4026 -4.3578 -4.3578 -2.8393 -2.8393 -2.3507 -2.3507 -0.7232 -0.7232 -0.4706 -0.4706 -0.3955 -0.3955 -0.3186 -0.3186 -0.1949 -0.1949 -0.1379 -0.1379 3.1238 3.1238 3.2060 3.2060 3.6421 3.6421 3.7501 3.7501 3.8698 3.8698 3.9320 3.9320 4.4012 4.4012 4.5113 4.5113 5.6170 5.6170 5.6363 5.6363 10.4497 10.4497 10.7218 10.7218 12.6065 12.6065 12.7068 12.7068 12.9427 12.9427 13.2275 13.2275 k = 0.6170 0.1083-0.1045 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6938 -19.6938 -16.4892 -16.4892 -16.3658 -16.3658 -13.2150 -13.2150 -13.1480 -13.1480 -13.0691 -13.0691 -13.0465 -13.0465 -6.3168 -6.3168 -4.4034 -4.4034 -4.3618 -4.3618 -2.8667 -2.8667 -2.3834 -2.3834 -0.7100 -0.7100 -0.4855 -0.4855 -0.3790 -0.3790 -0.3176 -0.3176 -0.1976 -0.1976 -0.1443 -0.1443 3.1363 3.1363 3.2113 3.2113 3.6550 3.6550 3.7583 3.7583 3.8751 3.8751 3.9427 3.9427 4.4124 4.4124 4.5207 4.5207 5.6380 5.6380 5.6674 5.6674 10.4134 10.4134 10.6822 10.6822 12.6131 12.6131 12.7315 12.7315 12.9492 12.9492 13.2080 13.2080 k = 0.6092 0.1156-0.0881 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6953 -19.6953 -16.4930 -16.4930 -16.3641 -16.3641 -13.2061 -13.2061 -13.1468 -13.1468 -13.0661 -13.0661 -13.0460 -13.0460 -6.3179 -6.3179 -4.4042 -4.4042 -4.3658 -4.3658 -2.8923 -2.8923 -2.4151 -2.4151 -0.6981 -0.6981 -0.5009 -0.5009 -0.3626 -0.3626 -0.3164 -0.3164 -0.2001 -0.2001 -0.1502 -0.1502 3.1481 3.1481 3.2160 3.2160 3.6670 3.6670 3.7654 3.7654 3.8818 3.8818 3.9526 3.9526 4.4248 4.4248 4.5294 4.5294 5.6584 5.6584 5.6980 5.6980 10.3787 10.3787 10.6438 10.6438 12.6184 12.6184 12.7568 12.7568 12.9567 12.9567 13.1883 13.1883 k = 0.6014 0.1229-0.0717 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6967 -19.6967 -16.4967 -16.4967 -16.3624 -16.3624 -13.1973 -13.1973 -13.1456 -13.1456 -13.0632 -13.0632 -13.0457 -13.0457 -6.3191 -6.3191 -4.4050 -4.4050 -4.3696 -4.3696 -2.9159 -2.9159 -2.4456 -2.4456 -0.6872 -0.6872 -0.5160 -0.5160 -0.3473 -0.3473 -0.3152 -0.3152 -0.2024 -0.2024 -0.1555 -0.1555 3.1593 3.1593 3.2200 3.2200 3.6783 3.6783 3.7714 3.7714 3.8900 3.8900 3.9616 3.9616 4.4384 4.4384 4.5374 4.5374 5.6781 5.6781 5.7276 5.7276 10.3456 10.3456 10.6068 10.6068 12.6226 12.6226 12.7823 12.7823 12.9649 12.9649 13.1688 13.1688 k = 0.5936 0.1302-0.0553 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6980 -19.6980 -16.5003 -16.5003 -16.3608 -16.3608 -13.1889 -13.1889 -13.1442 -13.1442 -13.0607 -13.0607 -13.0455 -13.0455 -6.3201 -6.3201 -4.4059 -4.4059 -4.3733 -4.3733 -2.9377 -2.9377 -2.4748 -2.4748 -0.6774 -0.6774 -0.5304 -0.5304 -0.3339 -0.3339 -0.3132 -0.3132 -0.2046 -0.2046 -0.1602 -0.1602 3.1697 3.1697 3.2234 3.2234 3.6887 3.6887 3.7762 3.7762 3.8994 3.8994 3.9696 3.9696 4.4529 4.4529 4.5447 4.5447 5.6970 5.6970 5.7561 5.7561 10.3144 10.3144 10.5715 10.5715 12.6257 12.6257 12.8075 12.8075 12.9740 12.9740 13.1499 13.1499 k = 0.5858 0.1374-0.0389 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6993 -19.6993 -16.5036 -16.5036 -16.3593 -16.3593 -13.1809 -13.1809 -13.1428 -13.1428 -13.0583 -13.0583 -13.0454 -13.0454 -6.3212 -6.3212 -4.4069 -4.4069 -4.3767 -4.3767 -2.9575 -2.9575 -2.5025 -2.5025 -0.6684 -0.6684 -0.5440 -0.5440 -0.3246 -0.3246 -0.3085 -0.3085 -0.2066 -0.2066 -0.1643 -0.1643 3.1795 3.1795 3.2262 3.2262 3.6983 3.6983 3.7799 3.7799 3.9100 3.9100 3.9764 3.9764 4.4679 4.4679 4.5514 4.5514 5.7150 5.7150 5.7834 5.7834 10.2851 10.2851 10.5381 10.5381 12.6278 12.6278 12.8318 12.8318 12.9838 12.9838 13.1319 13.1319 k = 0.5780 0.1447-0.0225 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7005 -19.7005 -16.5067 -16.5067 -16.3579 -16.3579 -13.1733 -13.1733 -13.1414 -13.1414 -13.0562 -13.0562 -13.0453 -13.0453 -6.3221 -6.3221 -4.4081 -4.4081 -4.3797 -4.3797 -2.9755 -2.9755 -2.5284 -2.5284 -0.6603 -0.6603 -0.5566 -0.5566 -0.3210 -0.3210 -0.2999 -0.2999 -0.2086 -0.2086 -0.1677 -0.1677 3.1884 3.1884 3.2284 3.2284 3.7070 3.7070 3.7827 3.7827 3.9212 3.9212 3.9822 3.9822 4.4831 4.4831 4.5574 4.5574 5.7319 5.7319 5.8091 5.8091 10.2578 10.2578 10.5068 10.5068 12.6291 12.6291 12.8547 12.8547 12.9943 12.9943 13.1152 13.1152 k = 0.5702 0.1520-0.0061 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7016 -19.7016 -16.5095 -16.5095 -16.3566 -16.3566 -13.1661 -13.1661 -13.1400 -13.1400 -13.0543 -13.0543 -13.0453 -13.0453 -6.3230 -6.3230 -4.4095 -4.4095 -4.3822 -4.3822 -2.9916 -2.9916 -2.5525 -2.5525 -0.6530 -0.6530 -0.5682 -0.5682 -0.3202 -0.3202 -0.2900 -0.2900 -0.2104 -0.2104 -0.1704 -0.1704 3.1967 3.1967 3.2301 3.2301 3.7148 3.7148 3.7849 3.7849 3.9328 3.9328 3.9870 3.9870 4.4981 4.4981 4.5629 4.5629 5.7476 5.7476 5.8331 5.8331 10.2328 10.2328 10.4777 10.4777 12.6296 12.6296 12.8752 12.8752 13.0054 13.0054 13.1003 13.1003 k = 0.5624 0.1592 0.0103 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7026 -19.7026 -16.5121 -16.5121 -16.3554 -16.3554 -13.1595 -13.1595 -13.1387 -13.1387 -13.0526 -13.0526 -13.0454 -13.0454 -6.3239 -6.3239 -4.4111 -4.4111 -4.3842 -4.3842 -3.0059 -3.0059 -2.5746 -2.5746 -0.6464 -0.6464 -0.5786 -0.5786 -0.3204 -0.3204 -0.2806 -0.2806 -0.2122 -0.2122 -0.1725 -0.1725 3.2041 3.2041 3.2313 3.2313 3.7217 3.7217 3.7867 3.7867 3.9441 3.9441 3.9909 3.9909 4.5125 4.5125 4.5678 4.5678 5.7621 5.7621 5.8552 5.8552 10.2101 10.2101 10.4512 10.4512 12.6295 12.6295 12.8929 12.8929 13.0171 13.0171 13.0876 13.0876 k = 0.5546 0.1665 0.0267 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7035 -19.7035 -16.5145 -16.5145 -16.3543 -16.3543 -13.1536 -13.1536 -13.1374 -13.1374 -13.0512 -13.0512 -13.0456 -13.0456 -6.3246 -6.3246 -4.4128 -4.4128 -4.3857 -4.3857 -3.0184 -3.0184 -2.5944 -2.5944 -0.6405 -0.6405 -0.5879 -0.5879 -0.3212 -0.3212 -0.2722 -0.2722 -0.2138 -0.2138 -0.1740 -0.1740 3.2108 3.2108 3.2322 3.2322 3.7275 3.7275 3.7883 3.7883 3.9548 3.9548 3.9942 3.9942 4.5259 4.5259 4.5724 4.5724 5.7751 5.7751 5.8752 5.8752 10.1898 10.1898 10.4273 10.4273 12.6289 12.6289 12.9070 12.9070 13.0288 13.0288 13.0777 13.0777 k = 0.5468 0.1738 0.0430 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7043 -19.7043 -16.5165 -16.5165 -16.3534 -16.3534 -13.1482 -13.1482 -13.1362 -13.1362 -13.0500 -13.0500 -13.0457 -13.0457 -6.3253 -6.3253 -4.4147 -4.4147 -4.3868 -4.3868 -3.0291 -3.0291 -2.6119 -2.6119 -0.6354 -0.6354 -0.5960 -0.5960 -0.3223 -0.3223 -0.2649 -0.2649 -0.2153 -0.2153 -0.1749 -0.1749 3.2166 3.2166 3.2328 3.2328 3.7323 3.7323 3.7899 3.7899 3.9644 3.9644 3.9969 3.9969 4.5378 4.5378 4.5766 4.5766 5.7866 5.7866 5.8929 5.8929 10.1720 10.1720 10.4063 10.4063 12.6280 12.6280 12.9174 12.9174 13.0396 13.0396 13.0716 13.0716 k = 0.5390 0.1811 0.0594 ( 6314 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7050 -19.7050 -16.5183 -16.5183 -16.3526 -16.3526 -13.1436 -13.1436 -13.1352 -13.1352 -13.0490 -13.0490 -13.0459 -13.0459 -6.3258 -6.3258 -4.4165 -4.4165 -4.3875 -4.3875 -3.0381 -3.0381 -2.6270 -2.6270 -0.6311 -0.6311 -0.6028 -0.6028 -0.3235 -0.3235 -0.2589 -0.2589 -0.2167 -0.2167 -0.1754 -0.1754 3.2217 3.2217 3.2331 3.2331 3.7360 3.7360 3.7915 3.7915 3.9726 3.9726 3.9994 3.9994 4.5478 4.5478 4.5807 4.5807 5.7966 5.7966 5.9082 5.9082 10.1568 10.1568 10.3883 10.3883 12.6269 12.6269 12.9243 12.9243 13.0470 13.0470 13.0710 13.0710 k = 0.5312 0.1883 0.0758 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7056 -19.7056 -16.5197 -16.5197 -16.3520 -16.3520 -13.1398 -13.1398 -13.1343 -13.1343 -13.0482 -13.0482 -13.0461 -13.0461 -6.3263 -6.3263 -4.4181 -4.4181 -4.3880 -4.3880 -3.0453 -3.0453 -2.6395 -2.6395 -0.6277 -0.6277 -0.6082 -0.6082 -0.3247 -0.3247 -0.2540 -0.2540 -0.2179 -0.2179 -0.1755 -0.1755 3.2258 3.2258 3.2333 3.2333 3.7388 3.7388 3.7930 3.7930 3.9791 3.9791 4.0019 4.0019 4.5557 4.5557 4.5848 4.5848 5.8048 5.8048 5.9209 5.9209 10.1442 10.1442 10.3733 10.3733 12.6257 12.6257 12.9283 12.9283 13.0495 13.0495 13.0765 13.0765 k = 0.5234 0.1956 0.0922 ( 6310 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7060 -19.7060 -16.5209 -16.5209 -16.3514 -16.3514 -13.1367 -13.1367 -13.1335 -13.1335 -13.0476 -13.0476 -13.0462 -13.0462 -6.3267 -6.3267 -4.4194 -4.4194 -4.3883 -4.3883 -3.0510 -3.0510 -2.6494 -2.6494 -0.6254 -0.6254 -0.6120 -0.6120 -0.3257 -0.3257 -0.2503 -0.2503 -0.2189 -0.2189 -0.1754 -0.1754 3.2291 3.2291 3.2334 3.2334 3.7408 3.7408 3.7944 3.7944 3.9837 3.9837 4.0043 4.0043 4.5613 4.5613 4.5885 4.5885 5.8113 5.8113 5.9309 5.9309 10.1344 10.1344 10.3616 10.3616 12.6247 12.6247 12.9301 12.9301 13.0499 13.0499 13.0840 13.0840 k = 0.5156 0.2029 0.1086 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7064 -19.7064 -16.5217 -16.5217 -16.3511 -16.3511 -13.1345 -13.1345 -13.1330 -13.1330 -13.0473 -13.0473 -13.0463 -13.0463 -6.3269 -6.3269 -4.4205 -4.4205 -4.3885 -4.3885 -3.0550 -3.0550 -2.6564 -2.6564 -0.6243 -0.6243 -0.6141 -0.6141 -0.3265 -0.3265 -0.2477 -0.2477 -0.2197 -0.2197 -0.1753 -0.1753 3.2313 3.2313 3.2335 3.2335 3.7421 3.7421 3.7956 3.7956 3.9866 3.9866 4.0065 4.0065 4.5650 4.5650 4.5917 4.5917 5.8160 5.8160 5.9381 5.9381 10.1274 10.1274 10.3531 10.3531 12.6239 12.6239 12.9308 12.9308 13.0499 13.0499 13.0906 13.0906 k = 0.5078 0.2101 0.1250 ( 6310 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7066 -19.7066 -16.5222 -16.5222 -16.3508 -16.3508 -13.1333 -13.1333 -13.1325 -13.1325 -13.0472 -13.0472 -13.0463 -13.0463 -6.3271 -6.3271 -4.4211 -4.4211 -4.3885 -4.3885 -3.0574 -3.0574 -2.6607 -2.6607 -0.6242 -0.6242 -0.6149 -0.6149 -0.3271 -0.3271 -0.2461 -0.2461 -0.2202 -0.2202 -0.1752 -0.1752 3.2325 3.2325 3.2338 3.2338 3.7428 3.7428 3.7963 3.7963 3.9881 3.9881 4.0081 4.0081 4.5671 4.5671 4.5938 4.5938 5.8188 5.8188 5.9425 5.9425 10.1231 10.1231 10.3480 10.3480 12.6233 12.6233 12.9309 12.9309 13.0500 13.0500 13.0948 13.0948 k = 0.5000 0.2174 0.1414 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7066 -19.7066 -16.5223 -16.5223 -16.3508 -16.3508 -13.1330 -13.1330 -13.1322 -13.1322 -13.0471 -13.0471 -13.0462 -13.0462 -6.3272 -6.3272 -4.4213 -4.4213 -4.3886 -4.3886 -3.0582 -3.0582 -2.6621 -2.6621 -0.6243 -0.6243 -0.6150 -0.6150 -0.3273 -0.3273 -0.2456 -0.2456 -0.2203 -0.2203 -0.1751 -0.1751 3.2328 3.2328 3.2340 3.2340 3.7430 3.7430 3.7966 3.7966 3.9885 3.9885 4.0087 4.0087 4.5677 4.5677 4.5945 4.5945 5.8198 5.8198 5.9440 5.9440 10.1217 10.1217 10.3463 10.3463 12.6231 12.6231 12.9309 12.9309 13.0500 13.0500 13.0963 13.0963 k = 0.5000 0.2174 0.1414 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7066 -19.7066 -16.5223 -16.5223 -16.3508 -16.3508 -13.1330 -13.1330 -13.1322 -13.1322 -13.0471 -13.0471 -13.0462 -13.0462 -6.3272 -6.3272 -4.4213 -4.4213 -4.3886 -4.3886 -3.0582 -3.0582 -2.6621 -2.6621 -0.6243 -0.6243 -0.6150 -0.6150 -0.3273 -0.3273 -0.2456 -0.2456 -0.2203 -0.2203 -0.1751 -0.1751 3.2328 3.2328 3.2340 3.2340 3.7430 3.7430 3.7966 3.7966 3.9885 3.9885 4.0087 4.0087 4.5677 4.5677 4.5945 4.5945 5.8198 5.8198 5.9440 5.9440 10.1217 10.1217 10.3463 10.3463 12.6231 12.6231 12.9309 12.9309 13.0500 13.0500 13.0963 13.0963 k = 0.4828 0.2099 0.1365 ( 6314 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7066 -19.7066 -16.5223 -16.5223 -16.3508 -16.3508 -13.1330 -13.1330 -13.1322 -13.1322 -13.0472 -13.0472 -13.0463 -13.0463 -6.3272 -6.3272 -4.4214 -4.4214 -4.3886 -4.3886 -3.0586 -3.0586 -2.6615 -2.6615 -0.6240 -0.6240 -0.6148 -0.6148 -0.3412 -0.3412 -0.2350 -0.2350 -0.2175 -0.2175 -0.1755 -0.1755 3.2336 3.2336 3.2348 3.2348 3.7410 3.7410 3.7938 3.7938 3.9908 3.9908 4.0115 4.0115 4.5667 4.5667 4.5935 4.5935 5.8194 5.8194 5.9444 5.9444 10.1239 10.1239 10.3474 10.3474 12.6137 12.6137 12.9315 12.9315 13.0506 13.0506 13.0846 13.0846 k = 0.4655 0.2024 0.1316 ( 6305 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7067 -19.7067 -16.5221 -16.5221 -16.3509 -16.3509 -13.1328 -13.1328 -13.1320 -13.1320 -13.0473 -13.0473 -13.0464 -13.0464 -6.3273 -6.3273 -4.4214 -4.4214 -4.3886 -4.3886 -3.0598 -3.0598 -2.6595 -2.6595 -0.6231 -0.6231 -0.6140 -0.6140 -0.3702 -0.3702 -0.2277 -0.2277 -0.1973 -0.1973 -0.1765 -0.1765 3.2362 3.2362 3.2374 3.2374 3.7350 3.7350 3.7861 3.7861 3.9972 3.9972 4.0198 4.0198 4.5637 4.5637 4.5904 4.5904 5.8183 5.8183 5.9455 5.9455 10.1303 10.1303 10.3506 10.3506 12.5856 12.5856 12.9333 12.9333 13.0504 13.0504 13.0566 13.0566 k = 0.4483 0.1949 0.1268 ( 6314 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7067 -19.7067 -16.5217 -16.5217 -16.3511 -16.3511 -13.1326 -13.1326 -13.1318 -13.1318 -13.0476 -13.0476 -13.0467 -13.0467 -6.3274 -6.3274 -4.4216 -4.4216 -4.3888 -4.3888 -3.0619 -3.0619 -2.6563 -2.6563 -0.6217 -0.6217 -0.6128 -0.6128 -0.4038 -0.4038 -0.2281 -0.2281 -0.1783 -0.1783 -0.1659 -0.1659 3.2405 3.2405 3.2417 3.2417 3.7257 3.7257 3.7745 3.7745 4.0074 4.0074 4.0324 4.0324 4.5585 4.5585 4.5852 4.5852 5.8165 5.8165 5.9474 5.9474 10.1409 10.1409 10.3560 10.3560 12.5398 12.5398 12.9364 12.9364 13.0156 13.0156 13.0561 13.0561 k = 0.4310 0.1874 0.1219 ( 6314 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7068 -19.7068 -16.5212 -16.5212 -16.3514 -16.3514 -13.1322 -13.1322 -13.1314 -13.1314 -13.0480 -13.0480 -13.0471 -13.0471 -6.3276 -6.3276 -4.4218 -4.4218 -4.3889 -4.3889 -3.0646 -3.0646 -2.6519 -2.6519 -0.6197 -0.6197 -0.6111 -0.6111 -0.4388 -0.4388 -0.2300 -0.2300 -0.1809 -0.1809 -0.1324 -0.1324 3.2464 3.2464 3.2477 3.2477 3.7140 3.7140 3.7601 3.7601 4.0204 4.0204 4.0481 4.0481 4.5514 4.5514 4.5780 4.5780 5.8140 5.8140 5.9499 5.9499 10.1556 10.1556 10.3635 10.3635 12.4782 12.4782 12.9407 12.9407 12.9764 12.9764 13.0603 13.0603 k = 0.4138 0.1799 0.1170 ( 6317 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7070 -19.7070 -16.5206 -16.5206 -16.3517 -16.3517 -13.1317 -13.1317 -13.1310 -13.1310 -13.0484 -13.0484 -13.0475 -13.0475 -6.3279 -6.3279 -4.4220 -4.4220 -4.3891 -4.3891 -3.0680 -3.0680 -2.6464 -2.6464 -0.6172 -0.6172 -0.6089 -0.6089 -0.4744 -0.4744 -0.2328 -0.2328 -0.1841 -0.1841 -0.0985 -0.0985 3.2540 3.2540 3.2553 3.2553 3.7004 3.7004 3.7439 3.7439 4.0355 4.0355 4.0659 4.0659 4.5423 4.5423 4.5688 4.5688 5.8111 5.8111 5.9529 5.9529 10.1742 10.1742 10.3731 10.3731 12.4045 12.4045 12.9388 12.9388 12.9461 12.9461 13.0658 13.0658 k = 0.3966 0.1724 0.1121 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7071 -19.7071 -16.5199 -16.5199 -16.3521 -16.3521 -13.1312 -13.1312 -13.1304 -13.1304 -13.0490 -13.0490 -13.0481 -13.0481 -6.3282 -6.3282 -4.4223 -4.4223 -4.3893 -4.3893 -3.0719 -3.0719 -2.6400 -2.6400 -0.6141 -0.6141 -0.6062 -0.6062 -0.5101 -0.5101 -0.2364 -0.2364 -0.1879 -0.1879 -0.0647 -0.0647 3.2633 3.2633 3.2647 3.2647 3.6857 3.6857 3.7266 3.7266 4.0522 4.0522 4.0851 4.0851 4.5312 4.5312 4.5576 4.5576 5.8077 5.8077 5.9564 5.9564 10.1966 10.1966 10.3849 10.3849 12.3224 12.3224 12.9030 12.9030 12.9526 12.9526 13.0725 13.0725 k = 0.3793 0.1649 0.1073 ( 6320 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7073 -19.7073 -16.5190 -16.5190 -16.3526 -16.3526 -13.1305 -13.1305 -13.1297 -13.1297 -13.0497 -13.0497 -13.0488 -13.0488 -6.3286 -6.3286 -4.4227 -4.4227 -4.3895 -4.3895 -3.0763 -3.0763 -2.6327 -2.6327 -0.6105 -0.6105 -0.6031 -0.6031 -0.5455 -0.5455 -0.2406 -0.2406 -0.1925 -0.1925 -0.0313 -0.0313 3.2742 3.2742 3.2755 3.2755 3.6703 3.6703 3.7089 3.7089 4.0698 4.0698 4.1052 4.1052 4.5183 4.5183 4.5446 4.5446 5.8040 5.8040 5.9602 5.9602 10.2223 10.2223 10.3989 10.3989 12.2353 12.2353 12.8683 12.8683 12.9601 12.9601 13.0802 13.0802 k = 0.3621 0.1574 0.1024 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7075 -19.7075 -16.5180 -16.5180 -16.3531 -16.3531 -13.1297 -13.1297 -13.1290 -13.1290 -13.0504 -13.0504 -13.0495 -13.0495 -6.3290 -6.3290 -4.4231 -4.4231 -4.3898 -4.3898 -3.0810 -3.0810 -2.6247 -2.6247 -0.6063 -0.6063 -0.5997 -0.5997 -0.5803 -0.5803 -0.2453 -0.2453 -0.1977 -0.1977 0.0014 0.0014 3.2866 3.2866 3.2880 3.2880 3.6546 3.6546 3.6910 3.6910 4.0882 4.0882 4.1257 4.1257 4.5035 4.5035 4.5297 4.5297 5.8001 5.8001 5.9643 5.9643 10.2509 10.2509 10.4152 10.4152 12.1457 12.1457 12.8338 12.8338 12.9686 12.9686 13.0889 13.0889 k = 0.3448 0.1499 0.0975 ( 6320 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7077 -19.7077 -16.5170 -16.5170 -16.3537 -16.3537 -13.1289 -13.1289 -13.1282 -13.1282 -13.0512 -13.0512 -13.0503 -13.0503 -6.3295 -6.3295 -4.4235 -4.4235 -4.3901 -4.3901 -3.0860 -3.0860 -2.6161 -2.6161 -0.6160 -0.6160 -0.6017 -0.6017 -0.5946 -0.5946 -0.2507 -0.2507 -0.2035 -0.2035 0.0334 0.0334 3.3004 3.3004 3.3019 3.3019 3.6389 3.6389 3.6733 3.6733 4.1068 4.1068 4.1463 4.1463 4.4869 4.4869 4.5130 4.5130 5.7960 5.7960 5.9686 5.9686 10.2819 10.2819 10.4341 10.4341 12.0558 12.0558 12.7987 12.7987 12.9779 12.9779 13.0986 13.0986 k = 0.3276 0.1424 0.0926 ( 6314 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7079 -19.7079 -16.5158 -16.5158 -16.3544 -16.3544 -13.1280 -13.1280 -13.1272 -13.1272 -13.0522 -13.0522 -13.0512 -13.0512 -6.3300 -6.3300 -4.4240 -4.4240 -4.3904 -4.3904 -3.0911 -3.0911 -2.6071 -2.6071 -0.6497 -0.6497 -0.5965 -0.5965 -0.5903 -0.5903 -0.2567 -0.2567 -0.2099 -0.2099 0.0646 0.0646 3.3157 3.3157 3.3173 3.3173 3.6234 3.6234 3.6560 3.6560 4.1255 4.1255 4.1667 4.1667 4.4686 4.4686 4.4947 4.4947 5.7918 5.7918 5.9730 5.9730 10.3145 10.3145 10.4559 10.4559 11.9670 11.9670 12.7628 12.7628 12.9881 12.9881 13.1090 13.1090 k = 0.3103 0.1349 0.0878 ( 6329 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7081 -19.7081 -16.5146 -16.5146 -16.3551 -16.3551 -13.1270 -13.1270 -13.1262 -13.1262 -13.0532 -13.0532 -13.0523 -13.0523 -6.3305 -6.3305 -4.4245 -4.4245 -4.3908 -4.3908 -3.0963 -3.0963 -2.5977 -2.5977 -0.6829 -0.6829 -0.5909 -0.5909 -0.5853 -0.5853 -0.2631 -0.2631 -0.2168 -0.2168 0.0947 0.0947 3.3323 3.3323 3.3339 3.3339 3.6084 3.6084 3.6393 3.6393 4.1440 4.1440 4.1869 4.1869 4.4486 4.4486 4.4747 4.4747 5.7875 5.7875 5.9775 5.9775 10.3474 10.3474 10.4812 10.4812 11.8804 11.8804 12.7258 12.7258 12.9988 12.9988 13.1201 13.1201 k = 0.2931 0.1274 0.0829 ( 6335 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7084 -19.7084 -16.5132 -16.5132 -16.3558 -16.3558 -13.1259 -13.1259 -13.1252 -13.1252 -13.0543 -13.0543 -13.0533 -13.0533 -6.3311 -6.3311 -4.4250 -4.4250 -4.3911 -4.3911 -3.1015 -3.1015 -2.5881 -2.5881 -0.7152 -0.7152 -0.5848 -0.5848 -0.5799 -0.5799 -0.2701 -0.2701 -0.2243 -0.2243 0.1239 0.1239 3.3500 3.3500 3.3517 3.3517 3.5941 3.5941 3.6234 3.6234 4.1623 4.1623 4.2064 4.2064 4.4271 4.4271 4.4534 4.4534 5.7833 5.7833 5.9819 5.9819 10.3796 10.3796 10.5108 10.5108 11.7969 11.7969 12.6877 12.6877 13.0102 13.0102 13.1318 13.1318 k = 0.2759 0.1199 0.0780 ( 6323 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7086 -19.7086 -16.5119 -16.5119 -16.3566 -16.3566 -13.1247 -13.1247 -13.1240 -13.1240 -13.0554 -13.0554 -13.0545 -13.0545 -6.3316 -6.3316 -4.4255 -4.4255 -4.3915 -4.3915 -3.1066 -3.1066 -2.5784 -2.5784 -0.7465 -0.7465 -0.5782 -0.5782 -0.5740 -0.5740 -0.2775 -0.2775 -0.2323 -0.2323 0.1519 0.1519 3.3687 3.3687 3.3706 3.3706 3.5808 3.5808 3.6086 3.6086 4.1802 4.1802 4.2252 4.2252 4.4042 4.4042 4.4308 4.4308 5.7792 5.7792 5.9863 5.9863 10.4097 10.4097 10.5452 10.5452 11.7173 11.7173 12.6484 12.6484 13.0219 13.0219 13.1439 13.1439 k = 0.2586 0.1125 0.0731 ( 6317 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7089 -19.7089 -16.5105 -16.5105 -16.3574 -16.3574 -13.1235 -13.1235 -13.1228 -13.1228 -13.0566 -13.0566 -13.0557 -13.0557 -6.3322 -6.3322 -4.4261 -4.4261 -4.3919 -4.3919 -3.1115 -3.1115 -2.5687 -2.5687 -0.7767 -0.7767 -0.5713 -0.5713 -0.5678 -0.5678 -0.2854 -0.2854 -0.2406 -0.2406 0.1788 0.1788 3.3880 3.3880 3.3901 3.3901 3.5688 3.5688 3.5952 3.5952 4.1975 4.1975 4.2430 4.2430 4.3798 4.3798 4.4073 4.4073 5.7751 5.7751 5.9906 5.9906 10.4370 10.4370 10.5845 10.5845 11.6422 11.6422 12.6083 12.6083 13.0340 13.0340 13.1564 13.1564 k = 0.2414 0.1050 0.0683 ( 6311 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7091 -19.7091 -16.5090 -16.5090 -16.3583 -16.3583 -13.1222 -13.1222 -13.1215 -13.1215 -13.0579 -13.0579 -13.0569 -13.0569 -6.3328 -6.3328 -4.4266 -4.4266 -4.3922 -4.3922 -3.1163 -3.1163 -2.5591 -2.5591 -0.8056 -0.8056 -0.5639 -0.5639 -0.5611 -0.5611 -0.2936 -0.2936 -0.2494 -0.2494 0.2043 0.2043 3.4074 3.4074 3.4098 3.4098 3.5586 3.5586 3.5836 3.5836 4.2142 4.2142 4.2590 4.2590 4.3542 4.3542 4.3834 4.3834 5.7712 5.7712 5.9948 5.9948 10.4612 10.4612 10.6280 10.6280 11.5721 11.5721 12.5673 12.5673 13.0462 13.0462 13.1690 13.1690 k = 0.2241 0.0975 0.0634 ( 6311 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7094 -19.7094 -16.5076 -16.5076 -16.3591 -16.3591 -13.1209 -13.1209 -13.1202 -13.1202 -13.0592 -13.0592 -13.0582 -13.0582 -6.3333 -6.3333 -4.4272 -4.4272 -4.3926 -4.3926 -3.1208 -3.1208 -2.5497 -2.5497 -0.8332 -0.8332 -0.5562 -0.5562 -0.5541 -0.5541 -0.3022 -0.3022 -0.2586 -0.2586 0.2285 0.2285 3.4259 3.4259 3.4290 3.4290 3.5512 3.5512 3.5745 3.5745 4.2301 4.2301 4.2721 4.2721 4.3275 4.3275 4.3604 4.3604 5.7674 5.7674 5.9988 5.9988 10.4824 10.4824 10.6750 10.6750 11.5076 11.5076 12.5258 12.5258 13.0584 13.0584 13.1816 13.1816 k = 0.2069 0.0900 0.0585 ( 6305 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7096 -19.7096 -16.5062 -16.5062 -16.3600 -16.3600 -13.1196 -13.1196 -13.1189 -13.1189 -13.0605 -13.0605 -13.0595 -13.0595 -6.3339 -6.3339 -4.4277 -4.4277 -4.3930 -4.3930 -3.1251 -3.1251 -2.5406 -2.5406 -0.8593 -0.8593 -0.5481 -0.5481 -0.5467 -0.5467 -0.3111 -0.3111 -0.2680 -0.2680 0.2513 0.2513 3.4420 3.4420 3.4463 3.4463 3.5481 3.5481 3.5693 3.5693 4.2452 4.2452 4.2785 4.2785 4.2997 4.2997 4.3422 4.3422 5.7638 5.7638 6.0026 6.0026 10.5009 10.5009 10.7243 10.7243 11.4491 11.4491 12.4840 12.4840 13.0705 13.0705 13.1942 13.1942 k = 0.1897 0.0825 0.0536 ( 6305 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7099 -19.7099 -16.5048 -16.5048 -16.3608 -16.3608 -13.1182 -13.1182 -13.1176 -13.1176 -13.0619 -13.0619 -13.0609 -13.0609 -6.3344 -6.3344 -4.4282 -4.4282 -4.3933 -4.3933 -3.1291 -3.1291 -2.5319 -2.5319 -0.8838 -0.8838 -0.5397 -0.5397 -0.5389 -0.5389 -0.3204 -0.3204 -0.2777 -0.2777 0.2725 0.2725 3.4534 3.4534 3.4599 3.4599 3.5515 3.5515 3.5697 3.5697 4.2593 4.2593 4.2707 4.2707 4.2710 4.2710 4.3363 4.3363 5.7604 5.7604 6.0062 6.0062 10.5165 10.5165 10.7750 10.7750 11.3970 11.3970 12.4422 12.4422 13.0823 13.0823 13.2064 13.2064 k = 0.1724 0.0750 0.0488 ( 6305 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7101 -19.7101 -16.5034 -16.5034 -16.3616 -16.3616 -13.1168 -13.1168 -13.1162 -13.1162 -13.0633 -13.0633 -13.0623 -13.0623 -6.3350 -6.3350 -4.4287 -4.4287 -4.3937 -4.3937 -3.1327 -3.1327 -2.5236 -2.5236 -0.9066 -0.9066 -0.5311 -0.5311 -0.5309 -0.5309 -0.3298 -0.3298 -0.2876 -0.2876 0.2921 0.2921 3.4587 3.4587 3.4679 3.4679 3.5627 3.5627 3.5774 3.5774 4.2416 4.2416 4.2497 4.2497 4.2724 4.2724 4.3417 4.3417 5.7573 5.7573 6.0095 6.0095 10.5293 10.5293 10.8261 10.8261 11.3516 11.3516 12.4008 12.4008 13.0936 13.0936 13.2182 13.2182 k = 0.1552 0.0675 0.0439 ( 6311 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7103 -19.7103 -16.5021 -16.5021 -16.3624 -16.3624 -13.1155 -13.1155 -13.1148 -13.1148 -13.0646 -13.0646 -13.0636 -13.0636 -6.3355 -6.3355 -4.4292 -4.4292 -4.3940 -4.3940 -3.1361 -3.1361 -2.5158 -2.5158 -0.9276 -0.9276 -0.5225 -0.5225 -0.5224 -0.5224 -0.3395 -0.3395 -0.2976 -0.2976 0.3101 0.3101 3.4588 3.4588 3.4704 3.4704 3.5806 3.5806 3.5924 3.5924 4.2116 4.2116 4.2231 4.2231 4.2845 4.2845 4.3510 4.3510 5.7544 5.7544 6.0126 6.0126 10.5391 10.5391 10.8767 10.8767 11.3130 11.3130 12.3601 12.3601 13.1045 13.1045 13.2295 13.2295 k = 0.1379 0.0600 0.0390 ( 6314 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7105 -19.7105 -16.5009 -16.5009 -16.3632 -16.3632 -13.1141 -13.1141 -13.1135 -13.1135 -13.0660 -13.0660 -13.0649 -13.0649 -6.3359 -6.3359 -4.4297 -4.4297 -4.3943 -4.3943 -3.1391 -3.1391 -2.5087 -2.5087 -0.9467 -0.9467 -0.5139 -0.5139 -0.5135 -0.5135 -0.3494 -0.3494 -0.3076 -0.3076 0.3264 0.3264 3.4561 3.4561 3.4690 3.4690 3.6029 3.6029 3.6127 3.6127 4.1813 4.1813 4.1944 4.1944 4.2955 4.2955 4.3609 4.3609 5.7518 5.7518 6.0154 6.0154 10.5462 10.5462 10.9259 10.9259 11.2812 11.2812 12.3207 12.3207 13.1146 13.1146 13.2400 13.2400 k = 0.1207 0.0525 0.0341 ( 6329 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7107 -19.7107 -16.4998 -16.4998 -16.3638 -16.3638 -13.1128 -13.1128 -13.1123 -13.1123 -13.0672 -13.0672 -13.0662 -13.0662 -6.3363 -6.3363 -4.4301 -4.4301 -4.3946 -4.3946 -3.1418 -3.1418 -2.5022 -2.5022 -0.9638 -0.9638 -0.5051 -0.5051 -0.5046 -0.5046 -0.3593 -0.3593 -0.3176 -0.3176 0.3409 0.3409 3.4521 3.4521 3.4657 3.4657 3.6277 3.6277 3.6362 3.6362 4.1508 4.1508 4.1648 4.1648 4.3053 4.3053 4.3704 4.3704 5.7494 5.7494 6.0179 6.0179 10.5506 10.5506 10.9728 10.9728 11.2559 11.2559 12.2831 12.2831 13.1238 13.1238 13.2496 13.2496 k = 0.1034 0.0450 0.0293 ( 6341 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7109 -19.7109 -16.4988 -16.4988 -16.3645 -16.3645 -13.1116 -13.1116 -13.1111 -13.1111 -13.0685 -13.0685 -13.0674 -13.0674 -6.3367 -6.3367 -4.4305 -4.4305 -4.3948 -4.3948 -3.1441 -3.1441 -2.4965 -2.4965 -0.9789 -0.9789 -0.4961 -0.4961 -0.4957 -0.4957 -0.3694 -0.3694 -0.3273 -0.3273 0.3535 0.3535 3.4478 3.4478 3.4617 3.4617 3.6536 3.6536 3.6613 3.6613 4.1207 4.1207 4.1352 4.1352 4.3138 4.3138 4.3790 4.3790 5.7474 5.7474 6.0200 6.0200 10.5527 10.5527 11.0163 11.0163 11.2367 11.2367 12.2479 12.2479 13.1322 13.1322 13.2583 13.2583 k = 0.0862 0.0375 0.0244 ( 6347 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7110 -19.7110 -16.4979 -16.4979 -16.3650 -16.3650 -13.1105 -13.1105 -13.1100 -13.1100 -13.0696 -13.0696 -13.0685 -13.0685 -6.3370 -6.3370 -4.4308 -4.4308 -4.3950 -4.3950 -3.1461 -3.1461 -2.4915 -2.4915 -0.9917 -0.9917 -0.4872 -0.4872 -0.4870 -0.4870 -0.3794 -0.3794 -0.3367 -0.3367 0.3643 0.3643 3.4437 3.4437 3.4578 3.4578 3.6799 3.6799 3.6870 3.6870 4.0913 4.0913 4.1062 4.1062 4.3212 4.3212 4.3864 4.3864 5.7456 5.7456 6.0219 6.0219 10.5530 10.5530 11.0553 11.0553 11.2231 11.2231 12.2159 12.2159 13.1394 13.1394 13.2658 13.2658 k = 0.0690 0.0300 0.0195 ( 6328 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7112 -19.7112 -16.4971 -16.4971 -16.3655 -16.3655 -13.1095 -13.1095 -13.1090 -13.1090 -13.0705 -13.0705 -13.0694 -13.0694 -6.3373 -6.3373 -4.4311 -4.4311 -4.3952 -4.3952 -3.1477 -3.1477 -2.4874 -2.4874 -1.0023 -1.0023 -0.4791 -0.4791 -0.4778 -0.4778 -0.3893 -0.3893 -0.3454 -0.3454 0.3733 0.3733 3.4402 3.4402 3.4542 3.4542 3.7054 3.7054 3.7121 3.7121 4.0634 4.0634 4.0786 4.0786 4.3272 4.3272 4.3926 4.3926 5.7442 5.7442 6.0235 6.0235 10.5521 10.5521 11.0884 11.0884 11.2144 11.2144 12.1879 12.1879 13.1455 13.1455 13.2722 13.2722 k = 0.0517 0.0225 0.0146 ( 6328 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7112 -19.7112 -16.4966 -16.4966 -16.3659 -16.3659 -13.1087 -13.1087 -13.1082 -13.1082 -13.0714 -13.0714 -13.0702 -13.0702 -6.3375 -6.3375 -4.4313 -4.4313 -4.3953 -4.3953 -3.1489 -3.1489 -2.4842 -2.4842 -1.0106 -1.0106 -0.4720 -0.4720 -0.4687 -0.4687 -0.3989 -0.3989 -0.3530 -0.3530 0.3803 0.3803 3.4373 3.4373 3.4513 3.4513 3.7291 3.7291 3.7352 3.7352 4.0380 4.0380 4.0536 4.0536 4.3320 4.3320 4.3975 4.3975 5.7431 5.7431 6.0247 6.0247 10.5507 10.5507 11.1144 11.1144 11.2101 11.2101 12.1648 12.1648 13.1503 13.1503 13.2772 13.2772 k = 0.0345 0.0150 0.0098 ( 6328 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7113 -19.7113 -16.4961 -16.4961 -16.3661 -16.3661 -13.1081 -13.1081 -13.1076 -13.1076 -13.0720 -13.0720 -13.0708 -13.0708 -6.3377 -6.3377 -4.4314 -4.4314 -4.3954 -4.3954 -3.1498 -3.1498 -2.4818 -2.4818 -1.0166 -1.0166 -0.4662 -0.4662 -0.4602 -0.4602 -0.4079 -0.4079 -0.3592 -0.3592 0.3853 0.3853 3.4352 3.4352 3.4492 3.4492 3.7490 3.7490 3.7547 3.7547 4.0168 4.0168 4.0328 4.0328 4.3354 4.3354 4.4010 4.4010 5.7423 5.7423 6.0256 6.0256 10.5492 10.5492 11.1322 11.1322 11.2092 11.2092 12.1474 12.1474 13.1538 13.1538 13.2808 13.2808 k = 0.0172 0.0075 0.0049 ( 6322 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7114 -19.7114 -16.4959 -16.4959 -16.3663 -16.3663 -13.1077 -13.1077 -13.1073 -13.1073 -13.0723 -13.0723 -13.0712 -13.0712 -6.3378 -6.3378 -4.4315 -4.4315 -4.3955 -4.3955 -3.1504 -3.1504 -2.4804 -2.4804 -1.0202 -1.0202 -0.4623 -0.4623 -0.4532 -0.4532 -0.4151 -0.4151 -0.3633 -0.3633 0.3883 0.3883 3.4339 3.4339 3.4478 3.4478 3.7628 3.7628 3.7681 3.7681 4.0023 4.0023 4.0187 4.0187 4.3374 4.3374 4.4031 4.4031 5.7418 5.7418 6.0261 6.0261 10.5481 10.5481 11.1421 11.1421 11.2102 11.2102 12.1366 12.1366 13.1559 13.1559 13.2830 13.2830 k = 0.0000 0.0000 0.0000 ( 6319 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7114 -19.7114 -16.4958 -16.4958 -16.3664 -16.3664 -13.1076 -13.1076 -13.1071 -13.1071 -13.0725 -13.0725 -13.0713 -13.0713 -6.3378 -6.3378 -4.4315 -4.4315 -4.3955 -4.3955 -3.1505 -3.1505 -2.4799 -2.4799 -1.0214 -1.0214 -0.4609 -0.4609 -0.4502 -0.4502 -0.4182 -0.4182 -0.3648 -0.3648 0.3893 0.3893 3.4335 3.4335 3.4474 3.4474 3.7678 3.7678 3.7729 3.7729 3.9971 3.9971 4.0136 4.0136 4.3381 4.3381 4.4038 4.4038 5.7416 5.7416 6.0263 6.0263 10.5478 10.5478 11.1452 11.1452 11.2109 11.2109 12.1330 12.1330 13.1566 13.1566 13.2838 13.2838 k = 0.0000 0.0000 0.0000 ( 6319 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7114 -19.7114 -16.4958 -16.4958 -16.3664 -16.3664 -13.1076 -13.1076 -13.1071 -13.1071 -13.0725 -13.0725 -13.0713 -13.0713 -6.3378 -6.3378 -4.4315 -4.4315 -4.3955 -4.3955 -3.1505 -3.1505 -2.4799 -2.4799 -1.0214 -1.0214 -0.4609 -0.4609 -0.4502 -0.4502 -0.4182 -0.4182 -0.3648 -0.3648 0.3893 0.3893 3.4335 3.4335 3.4474 3.4474 3.7678 3.7678 3.7729 3.7729 3.9971 3.9971 4.0136 4.0136 4.3381 4.3381 4.4038 4.4038 5.7416 5.7416 6.0263 6.0263 10.5478 10.5478 11.1452 11.1452 11.2109 11.2109 12.1330 12.1330 13.1566 13.1566 13.2838 13.2838 k = 0.0079-0.0074-0.0166 ( 6321 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7113 -19.7113 -16.4957 -16.4957 -16.3663 -16.3663 -13.1078 -13.1078 -13.1073 -13.1073 -13.0726 -13.0726 -13.0714 -13.0714 -6.3377 -6.3377 -4.4314 -4.4314 -4.3955 -4.3955 -3.1490 -3.1490 -2.4794 -2.4794 -1.0203 -1.0203 -0.4607 -0.4607 -0.4499 -0.4499 -0.4185 -0.4185 -0.3652 -0.3652 0.3887 0.3887 3.4332 3.4332 3.4471 3.4471 3.7680 3.7680 3.7730 3.7730 3.9965 3.9965 4.0132 4.0132 4.3370 4.3370 4.4027 4.4027 5.7404 5.7404 6.0252 6.0252 10.5496 10.5496 11.1473 11.1473 11.2115 11.2115 12.1339 12.1339 13.1565 13.1565 13.2837 13.2837 k = 0.0158-0.0147-0.0332 ( 6325 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7111 -19.7111 -16.4955 -16.4955 -16.3662 -16.3662 -13.1085 -13.1085 -13.1077 -13.1077 -13.0733 -13.0733 -13.0716 -13.0716 -6.3375 -6.3375 -4.4310 -4.4310 -4.3954 -4.3954 -3.1443 -3.1443 -2.4778 -2.4778 -1.0171 -1.0171 -0.4602 -0.4602 -0.4490 -0.4490 -0.4194 -0.4194 -0.3665 -0.3665 0.3866 0.3866 3.4323 3.4323 3.4463 3.4463 3.7686 3.7686 3.7735 3.7735 3.9945 3.9945 4.0121 4.0121 4.3336 4.3336 4.3994 4.3994 5.7367 5.7367 6.0219 6.0219 10.5552 10.5552 11.1536 11.1536 11.2133 11.2133 12.1366 12.1366 13.1562 13.1562 13.2835 13.2835 k = 0.0237-0.0221-0.0499 ( 6319 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7107 -19.7107 -16.4953 -16.4953 -16.3661 -16.3661 -13.1096 -13.1096 -13.1083 -13.1083 -13.0747 -13.0747 -13.0716 -13.0716 -6.3372 -6.3372 -4.4304 -4.4304 -4.3953 -4.3953 -3.1364 -3.1364 -2.4751 -2.4751 -1.0117 -1.0117 -0.4598 -0.4598 -0.4471 -0.4471 -0.4213 -0.4213 -0.3683 -0.3683 0.3832 0.3832 3.4309 3.4309 3.4449 3.4449 3.7694 3.7694 3.7743 3.7743 3.9904 3.9904 4.0111 4.0111 4.3275 4.3275 4.3944 4.3944 5.7306 5.7306 6.0165 6.0165 10.5644 10.5644 11.1641 11.1641 11.2163 11.2163 12.1411 12.1411 13.1554 13.1554 13.2836 13.2836 k = 0.0316-0.0295-0.0665 ( 6325 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7102 -19.7102 -16.4949 -16.4949 -16.3659 -16.3659 -13.1112 -13.1112 -13.1091 -13.1091 -13.0767 -13.0767 -13.0715 -13.0715 -6.3368 -6.3368 -4.4296 -4.4296 -4.3951 -4.3951 -3.1256 -3.1256 -2.4713 -2.4713 -1.0041 -1.0041 -0.4600 -0.4600 -0.4440 -0.4440 -0.4244 -0.4244 -0.3701 -0.3701 0.3784 0.3784 3.4289 3.4289 3.4429 3.4429 3.7704 3.7704 3.7757 3.7757 3.9835 3.9835 4.0109 4.0109 4.3180 4.3180 4.3886 4.3886 5.7221 5.7221 6.0089 6.0089 10.5772 10.5772 11.1785 11.1785 11.2203 11.2203 12.1475 12.1475 13.1540 13.1540 13.2841 13.2841 k = 0.0395-0.0369-0.0831 ( 6325 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7096 -19.7096 -16.4944 -16.4944 -16.3657 -16.3657 -13.1133 -13.1133 -13.1102 -13.1102 -13.0792 -13.0792 -13.0714 -13.0714 -6.3363 -6.3363 -4.4286 -4.4286 -4.3947 -4.3947 -3.1117 -3.1117 -2.4664 -2.4664 -0.9945 -0.9945 -0.4611 -0.4611 -0.4399 -0.4399 -0.4287 -0.4287 -0.3713 -0.3713 0.3724 0.3724 3.4262 3.4262 3.4403 3.4403 3.7713 3.7713 3.7777 3.7777 3.9741 3.9741 4.0114 4.0114 4.3047 4.3047 4.3826 4.3826 5.7114 5.7114 5.9994 5.9994 10.5934 10.5934 11.1968 11.1968 11.2256 11.2256 12.1558 12.1558 13.1513 13.1513 13.2856 13.2856 k = 0.0474-0.0442-0.0997 ( 6331 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7088 -19.7088 -16.4937 -16.4937 -16.3655 -16.3655 -13.1157 -13.1157 -13.1117 -13.1117 -13.0820 -13.0820 -13.0713 -13.0713 -6.3357 -6.3357 -4.4277 -4.4277 -4.3939 -4.3939 -3.0949 -3.0949 -2.4603 -2.4603 -0.9829 -0.9829 -0.4632 -0.4632 -0.4397 -0.4397 -0.4298 -0.4298 -0.3715 -0.3715 0.3652 0.3652 3.4230 3.4230 3.4371 3.4371 3.7719 3.7719 3.7805 3.7805 3.9622 3.9622 4.0125 4.0125 4.2872 4.2872 4.3769 4.3769 5.6984 5.6984 5.9878 5.9878 10.6129 10.6129 11.2185 11.2185 11.2320 11.2320 12.1661 12.1661 13.1473 13.1473 13.2884 13.2884 k = 0.0553-0.0516-0.1163 ( 6337 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7079 -19.7079 -16.4930 -16.4930 -16.3652 -16.3652 -13.1184 -13.1184 -13.1137 -13.1137 -13.0851 -13.0851 -13.0713 -13.0713 -6.3349 -6.3349 -4.4267 -4.4267 -4.3929 -4.3929 -3.0754 -3.0754 -2.4531 -2.4531 -0.9693 -0.9693 -0.4671 -0.4671 -0.4469 -0.4469 -0.4237 -0.4237 -0.3707 -0.3707 0.3568 0.3568 3.4192 3.4192 3.4333 3.4333 3.7720 3.7720 3.7842 3.7842 3.9482 3.9482 4.0141 4.0141 4.2659 4.2659 4.3716 4.3716 5.6835 5.6835 5.9743 5.9743 10.6356 10.6356 11.2385 11.2385 11.2445 11.2445 12.1785 12.1785 13.1414 13.1414 13.2928 13.2928 k = 0.0632-0.0590-0.1330 ( 6331 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7069 -19.7069 -16.4922 -16.4922 -16.3648 -16.3648 -13.1215 -13.1215 -13.1164 -13.1164 -13.0882 -13.0882 -13.0713 -13.0713 -6.3341 -6.3341 -4.4259 -4.4259 -4.3914 -4.3914 -3.0531 -3.0531 -2.4446 -2.4446 -0.9538 -0.9538 -0.4746 -0.4746 -0.4546 -0.4546 -0.4152 -0.4152 -0.3686 -0.3686 0.3473 0.3473 3.4148 3.4148 3.4289 3.4289 3.7713 3.7713 3.7887 3.7887 3.9325 3.9325 4.0161 4.0161 4.2411 4.2411 4.3666 4.3666 5.6666 5.6666 5.9590 5.9590 10.6611 10.6611 11.2472 11.2472 11.2721 11.2721 12.1931 12.1931 13.1338 13.1338 13.2992 13.2992 k = 0.0712-0.0663-0.1496 ( 6325 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7058 -19.7058 -16.4912 -16.4912 -16.3645 -16.3645 -13.1247 -13.1247 -13.1199 -13.1199 -13.0911 -13.0911 -13.0714 -13.0714 -6.3331 -6.3331 -4.4252 -4.4252 -4.3894 -4.3894 -3.0283 -3.0283 -2.4350 -2.4350 -0.9366 -0.9366 -0.4871 -0.4871 -0.4606 -0.4606 -0.4055 -0.4055 -0.3657 -0.3657 0.3368 0.3368 3.4098 3.4098 3.4240 3.4240 3.7694 3.7694 3.7940 3.7940 3.9156 3.9156 4.0184 4.0184 4.2134 4.2134 4.3617 4.3617 5.6479 5.6479 5.9420 5.9420 10.6894 10.6894 11.2564 11.2564 11.3026 11.3026 12.2100 12.2100 13.1243 13.1243 13.3074 13.3074 k = 0.0791-0.0737-0.1662 ( 6323 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7046 -19.7046 -16.4901 -16.4901 -16.3642 -16.3642 -13.1282 -13.1282 -13.1243 -13.1243 -13.0937 -13.0937 -13.0716 -13.0716 -6.3321 -6.3321 -4.4246 -4.4246 -4.3869 -4.3869 -3.0010 -3.0010 -2.4241 -2.4241 -0.9176 -0.9176 -0.5035 -0.5035 -0.4655 -0.4655 -0.3946 -0.3946 -0.3618 -0.3618 0.3253 0.3253 3.4043 3.4043 3.4184 3.4184 3.7655 3.7655 3.8000 3.8000 3.8982 3.8982 4.0209 4.0209 4.1835 4.1835 4.3568 4.3568 5.6277 5.6277 5.9234 5.9234 10.7202 10.7202 11.2665 11.2665 11.3353 11.3353 12.2295 12.2295 13.1132 13.1132 13.3175 13.3175 k = 0.0870-0.0811-0.1828 ( 6331 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7032 -19.7032 -16.4889 -16.4889 -16.3638 -16.3638 -13.1319 -13.1319 -13.1297 -13.1297 -13.0960 -13.0960 -13.0718 -13.0718 -6.3310 -6.3310 -4.4242 -4.4242 -4.3840 -4.3840 -2.9715 -2.9715 -2.4120 -2.4120 -0.8971 -0.8971 -0.5226 -0.5226 -0.4706 -0.4706 -0.3827 -0.3827 -0.3572 -0.3572 0.3130 0.3130 3.3983 3.3983 3.4124 3.4124 3.7586 3.7586 3.8068 3.8068 3.8816 3.8816 4.0237 4.0237 4.1519 4.1519 4.3518 4.3518 5.6059 5.6059 5.9033 5.9033 10.7532 10.7532 11.2772 11.2772 11.3696 11.3696 12.2516 12.2516 13.1006 13.1006 13.3293 13.3293 k = 0.0949-0.0885-0.1994 ( 6331 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7018 -19.7018 -16.4876 -16.4876 -16.3635 -16.3635 -13.1360 -13.1360 -13.1356 -13.1356 -13.0979 -13.0979 -13.0721 -13.0721 -6.3298 -6.3298 -4.4239 -4.4239 -4.3807 -4.3807 -2.9398 -2.9398 -2.3985 -2.3985 -0.8751 -0.8751 -0.5439 -0.5439 -0.4762 -0.4762 -0.3700 -0.3700 -0.3520 -0.3520 0.2999 0.2999 3.3918 3.3918 3.4058 3.4058 3.7471 3.7471 3.8141 3.8141 3.8670 3.8670 4.0264 4.0264 4.1195 4.1195 4.3465 4.3465 5.5829 5.5829 5.8819 5.8819 10.7882 10.7882 11.2887 11.2887 11.4049 11.4049 12.2765 12.2765 13.0869 13.0869 13.3426 13.3426 k = 0.1028-0.0958-0.2161 ( 6333 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7003 -19.7003 -16.4862 -16.4862 -16.3632 -16.3632 -13.1430 -13.1430 -13.1395 -13.1395 -13.0994 -13.0994 -13.0726 -13.0726 -6.3285 -6.3285 -4.4237 -4.4237 -4.3771 -4.3771 -2.9060 -2.9060 -2.3838 -2.3838 -0.8519 -0.8519 -0.5670 -0.5670 -0.4828 -0.4828 -0.3564 -0.3564 -0.3460 -0.3460 0.2861 0.2861 3.3849 3.3849 3.3989 3.3989 3.7299 3.7299 3.8219 3.8219 3.8560 3.8560 4.0285 4.0285 4.0872 4.0872 4.3410 4.3410 5.5588 5.5588 5.8591 5.8591 10.8248 10.8248 11.3007 11.3007 11.4407 11.4407 12.3044 12.3044 13.0722 13.0722 13.3574 13.3574 k = 0.1107-0.1032-0.2327 ( 6333 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6988 -19.6988 -16.4846 -16.4846 -16.3630 -16.3630 -13.1507 -13.1507 -13.1434 -13.1434 -13.1007 -13.1007 -13.0730 -13.0730 -6.3272 -6.3272 -4.4234 -4.4234 -4.3732 -4.3732 -2.8705 -2.8705 -2.3677 -2.3677 -0.8278 -0.8278 -0.5914 -0.5914 -0.4904 -0.4904 -0.3421 -0.3421 -0.3393 -0.3393 0.2717 0.2717 3.3776 3.3776 3.3918 3.3918 3.7068 3.7068 3.8292 3.8292 3.8494 3.8494 4.0269 4.0269 4.0588 4.0588 4.3351 4.3351 5.5338 5.5338 5.8352 5.8352 10.8629 10.8629 11.3132 11.3132 11.4765 11.4765 12.3355 12.3355 13.0567 13.0567 13.3737 13.3737 k = 0.1186-0.1106-0.2493 ( 6329 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6971 -19.6971 -16.4829 -16.4829 -16.3628 -16.3628 -13.1591 -13.1591 -13.1473 -13.1473 -13.1018 -13.1018 -13.0736 -13.0736 -6.3258 -6.3258 -4.4231 -4.4231 -4.3691 -4.3691 -2.8331 -2.8331 -2.3504 -2.3504 -0.8032 -0.8032 -0.6168 -0.6168 -0.4992 -0.4992 -0.3324 -0.3324 -0.3268 -0.3268 0.2567 0.2567 3.3697 3.3697 3.3846 3.3846 3.6786 3.6786 3.8336 3.8336 3.8491 3.8491 4.0090 4.0090 4.0472 4.0472 4.3289 4.3289 5.5080 5.5080 5.8104 5.8104 10.9021 10.9021 11.3261 11.3261 11.5116 11.5116 12.3697 12.3697 13.0406 13.0406 13.3912 13.3912 k = 0.1265-0.1180-0.2659 ( 6335 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6955 -19.6955 -16.4812 -16.4812 -16.3627 -16.3627 -13.1679 -13.1679 -13.1512 -13.1512 -13.1027 -13.1027 -13.0743 -13.0743 -6.3244 -6.3244 -4.4226 -4.4226 -4.3649 -4.3649 -2.7943 -2.7943 -2.3319 -2.3319 -0.7789 -0.7789 -0.6423 -0.6423 -0.5094 -0.5094 -0.3245 -0.3245 -0.3112 -0.3112 0.2413 0.2413 3.3612 3.3612 3.3776 3.3776 3.6463 3.6463 3.8336 3.8336 3.8554 3.8554 3.9795 3.9795 4.0481 4.0481 4.3224 4.3224 5.4816 5.4816 5.7846 5.7846 10.9421 10.9421 11.3393 11.3393 11.5458 11.5458 12.4071 12.4071 13.0240 13.0240 13.4100 13.4100 k = 0.1344-0.1253-0.2825 ( 6335 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9554 -33.9554 -19.6938 -19.6938 -16.4793 -16.4793 -16.3626 -16.3626 -13.1771 -13.1771 -13.1550 -13.1550 -13.1034 -13.1034 -13.0750 -13.0750 -6.3230 -6.3230 -4.4221 -4.4221 -4.3607 -4.3607 -2.7540 -2.7540 -2.3120 -2.3120 -0.7576 -0.7576 -0.6653 -0.6653 -0.5211 -0.5211 -0.3161 -0.3161 -0.2951 -0.2951 0.2255 0.2255 3.3517 3.3517 3.3713 3.3713 3.6110 3.6110 3.8323 3.8323 3.8642 3.8642 3.9488 3.9488 4.0515 4.0515 4.3156 4.3156 5.4548 5.4548 5.7580 5.7580 10.9826 10.9826 11.3528 11.3528 11.5785 11.5785 12.4475 12.4475 13.0071 13.0071 13.4300 13.4300 k = 0.1423-0.1327-0.2992 ( 6335 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9554 -33.9554 -19.6921 -19.6921 -16.4773 -16.4773 -16.3626 -16.3626 -13.1867 -13.1867 -13.1586 -13.1586 -13.1041 -13.1041 -13.0758 -13.0758 -6.3215 -6.3215 -4.4213 -4.4213 -4.3564 -4.3564 -2.7124 -2.7124 -2.2910 -2.2910 -0.7481 -0.7481 -0.6771 -0.6771 -0.5341 -0.5341 -0.3071 -0.3071 -0.2786 -0.2786 0.2094 0.2094 3.3413 3.3413 3.3658 3.3658 3.5735 3.5735 3.8307 3.8307 3.8732 3.8732 3.9195 3.9195 4.0557 4.0557 4.3085 4.3085 5.4278 5.4278 5.7307 5.7307 11.0233 11.0233 11.3663 11.3663 11.6094 11.6094 12.4905 12.4905 12.9898 12.9898 13.4507 13.4507 k = 0.1502-0.1401-0.3158 ( 6331 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9554 -33.9554 -19.6903 -19.6903 -16.4751 -16.4751 -16.3628 -16.3628 -13.1965 -13.1965 -13.1622 -13.1622 -13.1046 -13.1046 -13.0767 -13.0767 -6.3200 -6.3200 -4.4204 -4.4204 -4.3523 -4.3523 -2.6696 -2.6696 -2.2689 -2.2689 -0.7612 -0.7612 -0.6671 -0.6671 -0.5486 -0.5486 -0.2976 -0.2976 -0.2618 -0.2618 0.1930 0.1930 3.3300 3.3300 3.3612 3.3612 3.5347 3.5347 3.8286 3.8286 3.8762 3.8762 3.8981 3.8981 4.0603 4.0603 4.3011 4.3011 5.4008 5.4008 5.7029 5.7029 11.0639 11.0639 11.3800 11.3800 11.6384 11.6384 12.5357 12.5357 12.9724 12.9724 13.4702 13.4702 k = 0.1581-0.1474-0.3324 ( 6331 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9554 -33.9554 -19.6886 -19.6886 -16.4729 -16.4729 -16.3630 -16.3630 -13.2065 -13.2065 -13.1655 -13.1655 -13.1051 -13.1051 -13.0777 -13.0777 -6.3185 -6.3185 -4.4193 -4.4193 -4.3482 -4.3482 -2.6259 -2.6259 -2.2457 -2.2457 -0.7876 -0.7876 -0.6448 -0.6448 -0.5642 -0.5642 -0.2874 -0.2874 -0.2449 -0.2449 0.1764 0.1764 3.3177 3.3177 3.3576 3.3576 3.4953 3.4953 3.8248 3.8248 3.8582 3.8582 3.9006 3.9006 4.0651 4.0651 4.2935 4.2935 5.3739 5.3739 5.6746 5.6746 11.1039 11.1039 11.3935 11.3935 11.6654 11.6654 12.5824 12.5824 12.9548 12.9548 13.4813 13.4813 k = 0.1660-0.1548-0.3490 ( 6329 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9554 -33.9554 -19.6869 -19.6869 -16.4705 -16.4705 -16.3634 -16.3634 -13.2166 -13.2166 -13.1686 -13.1686 -13.1054 -13.1054 -13.0787 -13.0787 -6.3170 -6.3170 -4.4180 -4.4180 -4.3443 -4.3443 -2.5813 -2.5813 -2.2215 -2.2215 -0.8187 -0.8187 -0.6202 -0.6202 -0.5797 -0.5797 -0.2768 -0.2768 -0.2280 -0.2280 0.1597 0.1597 3.3045 3.3045 3.3551 3.3551 3.4559 3.4559 3.8150 3.8150 3.8402 3.8402 3.9101 3.9101 4.0701 4.0701 4.2858 4.2858 5.3473 5.3473 5.6460 5.6460 11.1431 11.1431 11.4070 11.4070 11.6905 11.6905 12.6298 12.6298 12.9372 12.9372 13.4724 13.4724 k = 0.1739-0.1622-0.3656 ( 6333 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9554 -33.9554 -19.6852 -19.6852 -16.4681 -16.4681 -16.3639 -16.3639 -13.2267 -13.2267 -13.1715 -13.1715 -13.1057 -13.1057 -13.0798 -13.0798 -6.3155 -6.3155 -4.4165 -4.4165 -4.3405 -4.3405 -2.5360 -2.5360 -2.1964 -2.1964 -0.8521 -0.8521 -0.6103 -0.6103 -0.5807 -0.5807 -0.2657 -0.2657 -0.2112 -0.2112 0.1429 0.1429 3.2904 3.2904 3.3535 3.3535 3.4171 3.4171 3.7954 3.7954 3.8318 3.8318 3.9205 3.9205 4.0750 4.0750 4.2780 4.2780 5.3212 5.3212 5.6172 5.6172 11.1811 11.1811 11.4203 11.4203 11.7137 11.7137 12.6769 12.6769 12.9198 12.9198 13.4512 13.4512 k = 0.1818-0.1696-0.3823 ( 6325 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9554 -33.9554 -19.6835 -19.6835 -16.4655 -16.4655 -16.3645 -16.3645 -13.2369 -13.2369 -13.1740 -13.1740 -13.1059 -13.1059 -13.0809 -13.0809 -6.3140 -6.3140 -4.4148 -4.4148 -4.3370 -4.3370 -2.4900 -2.4900 -2.1704 -2.1704 -0.8868 -0.8868 -0.6266 -0.6266 -0.5566 -0.5566 -0.2541 -0.2541 -0.1946 -0.1946 0.1261 0.1261 3.2756 3.2756 3.3523 3.3523 3.3804 3.3804 3.7726 3.7726 3.8273 3.8273 3.9309 3.9309 4.0800 4.0800 4.2703 4.2703 5.2958 5.2958 5.5882 5.5882 11.2176 11.2176 11.4333 11.4333 11.7353 11.7353 12.7223 12.7223 12.9028 12.9028 13.4282 13.4282 k = 0.1897-0.1769-0.3989 ( 6325 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9554 -33.9554 -19.6819 -19.6819 -16.4629 -16.4629 -16.3653 -16.3653 -13.2471 -13.2471 -13.1763 -13.1763 -13.1061 -13.1061 -13.0821 -13.0821 -6.3125 -6.3125 -4.4129 -4.4129 -4.3337 -4.3337 -2.4436 -2.4436 -2.1438 -2.1438 -0.9225 -0.9225 -0.6477 -0.6477 -0.5289 -0.5289 -0.2421 -0.2421 -0.1784 -0.1784 0.1092 0.1092 3.2600 3.2600 3.3384 3.3384 3.3589 3.3589 3.7500 3.7500 3.8233 3.8233 3.9411 3.9411 4.0848 4.0848 4.2626 4.2626 5.2711 5.2711 5.5593 5.5593 11.2521 11.2521 11.4459 11.4459 11.7555 11.7555 12.7645 12.7645 12.8872 12.8872 13.4069 13.4069 k = 0.1976-0.1843-0.4155 ( 6331 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6803 -19.6803 -16.4601 -16.4601 -16.3662 -16.3662 -13.2571 -13.2571 -13.1782 -13.1782 -13.1062 -13.1062 -13.0833 -13.0833 -6.3111 -6.3111 -4.4108 -4.4108 -4.3306 -4.3306 -2.3969 -2.3969 -2.1167 -2.1167 -0.9591 -0.9591 -0.6707 -0.6707 -0.5010 -0.5010 -0.2297 -0.2297 -0.1627 -0.1627 0.0925 0.0925 3.2436 3.2436 3.3060 3.3060 3.3593 3.3593 3.7284 3.7284 3.8191 3.8191 3.9509 3.9509 4.0894 4.0894 4.2553 4.2553 5.2474 5.2474 5.5305 5.5305 11.2842 11.2842 11.4582 11.4582 11.7745 11.7745 12.8001 12.8001 12.8754 12.8754 13.3883 13.3883 k = 0.2055-0.1917-0.4321 ( 6324 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6787 -19.6787 -16.4572 -16.4572 -16.3673 -16.3673 -13.2669 -13.2669 -13.1798 -13.1798 -13.1062 -13.1062 -13.0845 -13.0845 -6.3097 -6.3097 -4.4085 -4.4085 -4.3279 -4.3279 -2.3499 -2.3499 -2.0891 -2.0891 -0.9962 -0.9962 -0.6949 -0.6949 -0.4735 -0.4735 -0.2170 -0.2170 -0.1476 -0.1476 0.0760 0.0760 3.2266 3.2266 3.2741 3.2741 3.3627 3.3627 3.7080 3.7080 3.8143 3.8143 3.9602 3.9602 4.0938 4.0938 4.2484 4.2484 5.2249 5.2249 5.5020 5.5020 11.3137 11.3137 11.4701 11.4701 11.7928 11.7928 12.8192 12.8192 12.8770 12.8770 13.3728 13.3728 k = 0.2135-0.1990-0.4487 ( 6318 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6773 -19.6773 -16.4543 -16.4543 -16.3686 -16.3686 -13.2766 -13.2766 -13.1810 -13.1810 -13.1063 -13.1063 -13.0857 -13.0857 -6.3084 -6.3084 -4.4061 -4.4061 -4.3255 -4.3255 -2.3029 -2.3029 -2.0613 -2.0613 -1.0340 -1.0340 -0.7201 -0.7201 -0.4467 -0.4467 -0.2041 -0.2041 -0.1333 -0.1333 0.0597 0.0597 3.2092 3.2092 3.2444 3.2444 3.3676 3.3676 3.6890 3.6890 3.8089 3.8089 3.9688 3.9688 4.0977 4.0977 4.2421 4.2421 5.2037 5.2037 5.4739 5.4739 11.3402 11.3402 11.4814 11.4814 11.8106 11.8106 12.8160 12.8160 12.8975 12.8975 13.3606 13.3606 k = 0.2214-0.2064-0.4654 ( 6318 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6759 -19.6759 -16.4513 -16.4513 -16.3700 -16.3700 -13.2860 -13.2860 -13.1819 -13.1819 -13.1063 -13.1063 -13.0870 -13.0870 -6.3071 -6.3071 -4.4035 -4.4035 -4.3234 -4.3234 -2.2559 -2.2559 -2.0334 -2.0334 -1.0721 -1.0721 -0.7461 -0.7461 -0.4208 -0.4208 -0.1911 -0.1911 -0.1198 -0.1198 0.0436 0.0436 3.1916 3.1916 3.2173 3.2173 3.3738 3.3738 3.6713 3.6713 3.8028 3.8028 3.9765 3.9765 4.1012 4.1012 4.2367 4.2367 5.1840 5.1840 5.4462 5.4462 11.3635 11.3635 11.4923 11.4923 11.8280 11.8280 12.8044 12.8044 12.9228 12.9228 13.3516 13.3516 k = 0.2293-0.2138-0.4820 ( 6328 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6746 -19.6746 -16.4482 -16.4482 -16.3716 -16.3716 -13.2950 -13.2950 -13.1824 -13.1824 -13.1063 -13.1063 -13.0882 -13.0882 -6.3058 -6.3058 -4.4008 -4.4008 -4.3216 -4.3216 -2.2091 -2.2091 -2.0056 -2.0056 -1.1106 -1.1106 -0.7726 -0.7726 -0.3960 -0.3960 -0.1781 -0.1781 -0.1073 -0.1073 0.0280 0.0280 3.1741 3.1741 3.1926 3.1926 3.3811 3.3811 3.6551 3.6551 3.7960 3.7960 3.9832 3.9832 4.1041 4.1041 4.2322 4.2322 5.1658 5.1658 5.4192 5.4192 11.3832 11.3832 11.5025 11.5025 11.8454 11.8454 12.7914 12.7914 12.9463 12.9463 13.3457 13.3457 k = 0.2372-0.2212-0.4986 ( 6322 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6734 -19.6734 -16.4451 -16.4451 -16.3734 -16.3734 -13.3037 -13.3037 -13.1826 -13.1826 -13.1064 -13.1064 -13.0894 -13.0894 -6.3046 -6.3046 -4.3979 -4.3979 -4.3202 -4.3202 -2.1625 -2.1625 -1.9780 -1.9780 -1.1493 -1.1493 -0.7994 -0.7994 -0.3724 -0.3724 -0.1652 -0.1652 -0.0958 -0.0958 0.0129 0.0129 3.1574 3.1574 3.1699 3.1699 3.3896 3.3896 3.6402 3.6402 3.7885 3.7885 3.9886 3.9886 4.1066 4.1066 4.2290 4.2290 5.1494 5.1494 5.3929 5.3929 11.3995 11.3995 11.5122 11.5122 11.8627 11.8627 12.7788 12.7788 12.9665 12.9665 13.3428 13.3428 k = 0.2451-0.2285-0.5152 ( 6320 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6723 -19.6723 -16.4419 -16.4419 -16.3753 -16.3753 -13.3119 -13.3119 -13.1824 -13.1824 -13.1065 -13.1065 -13.0905 -13.0905 -6.3035 -6.3035 -4.3949 -4.3949 -4.3191 -4.3191 -2.1165 -2.1165 -1.9510 -1.9510 -1.1881 -1.1881 -0.8262 -0.8262 -0.3501 -0.3501 -0.1526 -0.1526 -0.0855 -0.0855 -0.0016 -0.0016 3.1418 3.1418 3.1492 3.1492 3.3990 3.3990 3.6267 3.6267 3.7805 3.7805 3.9925 3.9925 4.1088 4.1088 4.2271 4.2271 5.1348 5.1348 5.3676 5.3676 11.4121 11.4121 11.5212 11.5212 11.8801 11.8801 12.7675 12.7675 12.9832 12.9832 13.3427 13.3427 k = 0.2530-0.2359-0.5318 ( 6324 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6712 -19.6712 -16.4386 -16.4386 -16.3774 -16.3774 -13.3197 -13.3197 -13.1819 -13.1819 -13.1066 -13.1066 -13.0915 -13.0915 -6.3024 -6.3024 -4.3918 -4.3918 -4.3184 -4.3184 -2.0710 -2.0710 -1.9247 -1.9247 -1.2269 -1.2269 -0.8527 -0.8527 -0.3293 -0.3293 -0.1405 -0.1405 -0.0763 -0.0763 -0.0152 -0.0152 3.1255 3.1255 3.1323 3.1323 3.4093 3.4093 3.6146 3.6146 3.7719 3.7719 3.9946 3.9946 4.1108 4.1108 4.2265 4.2265 5.1223 5.1223 5.3432 5.3432 11.4211 11.4211 11.5296 11.5296 11.8976 11.8976 12.7577 12.7577 12.9964 12.9964 13.3453 13.3453 k = 0.2609-0.2433-0.5485 ( 6320 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6703 -19.6703 -16.4353 -16.4353 -16.3797 -16.3797 -13.3271 -13.3271 -13.1811 -13.1811 -13.1068 -13.1068 -13.0925 -13.0925 -6.3014 -6.3014 -4.3887 -4.3887 -4.3180 -4.3180 -2.0263 -2.0263 -1.8993 -1.8993 -1.2655 -1.2655 -0.8786 -0.8786 -0.3099 -0.3099 -0.1293 -0.1293 -0.0684 -0.0684 -0.0276 -0.0276 3.1069 3.1069 3.1207 3.1207 3.4203 3.4203 3.6036 3.6036 3.7630 3.7630 3.9946 3.9946 4.1132 4.1132 4.2272 4.2272 5.1119 5.1119 5.3200 5.3200 11.4268 11.4268 11.5374 11.5374 11.9149 11.9149 12.7497 12.7497 13.0066 13.0066 13.3504 13.3504 k = 0.2688-0.2507-0.5651 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6694 -19.6694 -16.4320 -16.4320 -16.3820 -16.3820 -13.3338 -13.3338 -13.1800 -13.1800 -13.1072 -13.1072 -13.0932 -13.0932 -6.3005 -6.3005 -4.3854 -4.3854 -4.3180 -4.3180 -1.9826 -1.9826 -1.8752 -1.8752 -1.3037 -1.3037 -0.9034 -0.9034 -0.2921 -0.2921 -0.1195 -0.1195 -0.0619 -0.0619 -0.0380 -0.0380 3.0882 3.0882 3.1123 3.1123 3.4318 3.4318 3.5939 3.5939 3.7539 3.7539 3.9923 3.9923 4.1161 4.1161 4.2291 4.2291 5.1036 5.1036 5.2980 5.2980 11.4293 11.4293 11.5444 11.5444 11.9320 11.9320 12.7438 12.7438 13.0140 13.0140 13.3578 13.3578 k = 0.2767-0.2580-0.5817 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6687 -19.6687 -16.4287 -16.4287 -16.3845 -16.3845 -13.3400 -13.3400 -13.1787 -13.1787 -13.1076 -13.1076 -13.0938 -13.0938 -6.2997 -6.2997 -4.3822 -4.3822 -4.3183 -4.3183 -1.9403 -1.9403 -1.8526 -1.8526 -1.3411 -1.3411 -0.9270 -0.9270 -0.2759 -0.2759 -0.1122 -0.1122 -0.0574 -0.0574 -0.0451 -0.0451 3.0698 3.0698 3.1064 3.1064 3.4436 3.4436 3.5851 3.5851 3.7450 3.7450 3.9878 3.9878 4.1200 4.1200 4.2319 4.2319 5.0977 5.0977 5.2774 5.2774 11.4288 11.4288 11.5508 11.5508 11.9488 11.9488 12.7400 12.7400 13.0188 13.0188 13.3672 13.3672 k = 0.2846-0.2654-0.5983 ( 6296 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6681 -19.6681 -16.4254 -16.4254 -16.3872 -16.3872 -13.3457 -13.3457 -13.1772 -13.1772 -13.1082 -13.1082 -13.0942 -13.0942 -6.2990 -6.2990 -4.3789 -4.3789 -4.3189 -4.3189 -1.8999 -1.8999 -1.8318 -1.8318 -1.3774 -1.3774 -0.9487 -0.9487 -0.2612 -0.2612 -0.1089 -0.1089 -0.0559 -0.0559 -0.0463 -0.0463 3.0520 3.0520 3.1025 3.1025 3.4557 3.4557 3.5770 3.5770 3.7367 3.7367 3.9811 3.9811 4.1248 4.1248 4.2357 4.2357 5.0940 5.0940 5.2582 5.2582 11.4255 11.4255 11.5566 11.5566 11.9651 11.9651 12.7386 12.7386 13.0215 13.0215 13.3784 13.3784 k = 0.2925-0.2728-0.6149 ( 6288 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6675 -19.6675 -16.4220 -16.4220 -16.3900 -16.3900 -13.3507 -13.3507 -13.1757 -13.1757 -13.1089 -13.1089 -13.0943 -13.0943 -6.2983 -6.2983 -4.3757 -4.3757 -4.3198 -4.3198 -1.8619 -1.8619 -1.8132 -1.8132 -1.4119 -1.4119 -0.9682 -0.9682 -0.2481 -0.2481 -0.1103 -0.1103 -0.0544 -0.0544 -0.0438 -0.0438 3.0347 3.0347 3.1003 3.1003 3.4677 3.4677 3.5692 3.5692 3.7295 3.7295 3.9724 3.9724 4.1307 4.1307 4.2401 4.2401 5.0928 5.0928 5.2405 5.2405 11.4197 11.4197 11.5616 11.5616 11.9807 11.9807 12.7395 12.7395 13.0221 13.0221 13.3911 13.3911 k = 0.3004-0.2801-0.6316 ( 6280 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6671 -19.6671 -16.4187 -16.4187 -16.3928 -16.3928 -13.3550 -13.3550 -13.1740 -13.1740 -13.1099 -13.1099 -13.0941 -13.0941 -6.2977 -6.2977 -4.3726 -4.3726 -4.3209 -4.3209 -1.8277 -1.8277 -1.7968 -1.7968 -1.4434 -1.4434 -0.9852 -0.9852 -0.2366 -0.2366 -0.1153 -0.1153 -0.0516 -0.0516 -0.0403 -0.0403 3.0182 3.0182 3.0995 3.0995 3.4796 3.4796 3.5614 3.5614 3.7240 3.7240 3.9619 3.9619 4.1376 4.1376 4.2452 4.2452 5.0939 5.0939 5.2244 5.2244 11.4117 11.4117 11.5660 11.5660 11.9956 11.9956 12.7429 12.7429 13.0210 13.0210 13.4045 13.4045 k = 0.3083-0.2875-0.6482 ( 6274 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6667 -19.6667 -16.4155 -16.4155 -16.3958 -16.3958 -13.3587 -13.3587 -13.1725 -13.1725 -13.1110 -13.1110 -13.0935 -13.0935 -6.2972 -6.2972 -4.3695 -4.3695 -4.3222 -4.3222 -1.7995 -1.7995 -1.7825 -1.7825 -1.4702 -1.4702 -0.9991 -0.9991 -0.2265 -0.2265 -0.1221 -0.1221 -0.0491 -0.0491 -0.0358 -0.0358 3.0024 3.0024 3.0996 3.0996 3.4911 3.4911 3.5529 3.5529 3.7209 3.7209 3.9498 3.9498 4.1454 4.1454 4.2508 4.2508 5.0973 5.0973 5.2100 5.2100 11.4016 11.4016 11.5698 11.5698 12.0096 12.0096 12.7487 12.7487 13.0184 13.0184 13.4169 13.4169 k = 0.3162-0.2949-0.6648 ( 6274 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6665 -19.6665 -16.4122 -16.4122 -16.3988 -16.3988 -13.3618 -13.3618 -13.1710 -13.1710 -13.1123 -13.1123 -13.0925 -13.0925 -6.2968 -6.2968 -4.3667 -4.3667 -4.3237 -4.3237 -1.7809 -1.7809 -1.7694 -1.7694 -1.4897 -1.4897 -1.0097 -1.0097 -0.2179 -0.2179 -0.1295 -0.1295 -0.0481 -0.0481 -0.0304 -0.0304 2.9873 2.9873 3.1003 3.1003 3.5022 3.5022 3.5432 3.5432 3.7209 3.7209 3.9363 3.9363 4.1542 4.1542 4.2569 4.2569 5.1031 5.1031 5.1971 5.1971 11.3898 11.3898 11.5729 11.5729 12.0228 12.0228 12.7569 12.7569 13.0145 13.0145 13.4221 13.4222 k = 0.3241-0.3023-0.6814 ( 6278 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6663 -19.6663 -16.4091 -16.4091 -16.4018 -16.4018 -13.3642 -13.3642 -13.1696 -13.1696 -13.1139 -13.1139 -13.0911 -13.0911 -6.2964 -6.2964 -4.3642 -4.3642 -4.3250 -4.3250 -1.7720 -1.7720 -1.7606 -1.7606 -1.4988 -1.4988 -1.0168 -1.0168 -0.2106 -0.2106 -0.1367 -0.1367 -0.0488 -0.0488 -0.0248 -0.0248 2.9732 2.9732 3.1012 3.1012 3.5125 3.5125 3.5321 3.5321 3.7244 3.7244 3.9218 3.9218 4.1637 4.1637 4.2635 4.2635 5.1111 5.1111 5.1859 5.1859 11.3763 11.3763 11.5754 11.5754 12.0350 12.0350 12.7676 12.7676 13.0094 13.0094 13.4094 13.4094 k = 0.3320-0.3096-0.6980 ( 6290 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6662 -19.6662 -16.4060 -16.4060 -16.4048 -16.4048 -13.3658 -13.3658 -13.1685 -13.1685 -13.1158 -13.1158 -13.0893 -13.0893 -6.2962 -6.2962 -4.3622 -4.3622 -4.3263 -4.3263 -1.7709 -1.7709 -1.7599 -1.7599 -1.4957 -1.4957 -1.0203 -1.0203 -0.2048 -0.2048 -0.1433 -0.1433 -0.0507 -0.0507 -0.0196 -0.0196 2.9598 2.9598 3.1019 3.1019 3.5178 3.5178 3.5236 3.5236 3.7314 3.7314 3.9063 3.9063 4.1738 4.1738 4.2706 4.2706 5.1212 5.1212 5.1763 5.1763 11.3616 11.3616 11.5773 11.5773 12.0462 12.0462 12.7805 12.7805 13.0035 13.0035 13.3832 13.3832 k = 0.3399-0.3170-0.7147 ( 6288 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6661 -19.6661 -16.4081 -16.4081 -16.4028 -16.4028 -13.3669 -13.3669 -13.1676 -13.1676 -13.1179 -13.1179 -13.0870 -13.0870 -6.2960 -6.2960 -4.3607 -4.3607 -4.3271 -4.3271 -1.7817 -1.7817 -1.7619 -1.7619 -1.4814 -1.4814 -1.0200 -1.0200 -0.2004 -0.2004 -0.1490 -0.1490 -0.0537 -0.0537 -0.0152 -0.0152 2.9475 2.9475 3.1024 3.1024 3.5038 3.5038 3.5319 3.5319 3.7421 3.7421 3.8900 3.8900 4.1843 4.1843 4.2784 4.2784 5.1333 5.1333 5.1684 5.1684 11.3456 11.3456 11.5786 11.5786 12.0565 12.0565 12.7956 12.7956 12.9968 12.9968 13.3527 13.3527 k = 0.3478-0.3244-0.7313 ( 6282 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6662 -19.6662 -16.4112 -16.4112 -16.3999 -16.3999 -13.3672 -13.3672 -13.1669 -13.1669 -13.1203 -13.1203 -13.0843 -13.0843 -6.2958 -6.2958 -4.3601 -4.3601 -4.3274 -4.3274 -1.8025 -1.8025 -1.7649 -1.7649 -1.4593 -1.4593 -1.0162 -1.0162 -0.1975 -0.1975 -0.1535 -0.1535 -0.0578 -0.0578 -0.0117 -0.0117 2.9361 2.9361 3.1024 3.1024 3.4876 3.4876 3.5401 3.5401 3.7560 3.7560 3.8732 3.8732 4.1950 4.1950 4.2870 4.2870 5.1466 5.1466 5.1627 5.1627 11.3288 11.3288 11.5795 11.5795 12.0657 12.0657 12.8126 12.8126 12.9899 12.9899 13.3210 13.3210 k = 0.3558-0.3317-0.7479 ( 6278 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6663 -19.6663 -16.4144 -16.4144 -16.3970 -16.3970 -13.3669 -13.3669 -13.1665 -13.1665 -13.1230 -13.1230 -13.0811 -13.0811 -6.2958 -6.2958 -4.3603 -4.3603 -4.3271 -4.3271 -1.8287 -1.8287 -1.7700 -1.7700 -1.4325 -1.4325 -1.0092 -1.0092 -0.1962 -0.1962 -0.1567 -0.1567 -0.0627 -0.0627 -0.0094 -0.0094 2.9257 2.9257 3.1019 3.1019 3.4700 3.4700 3.5476 3.5476 3.7727 3.7727 3.8560 3.8560 4.2056 4.2056 4.2963 4.2963 5.1537 5.1537 5.1664 5.1664 11.3112 11.3112 11.5798 11.5798 12.0739 12.0739 12.8312 12.8312 12.9830 12.9830 13.2892 13.2892 k = 0.6442-0.1143-0.6065 ( 6278 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6663 -19.6663 -16.4144 -16.4144 -16.3970 -16.3970 -13.3669 -13.3669 -13.1665 -13.1665 -13.1230 -13.1230 -13.0811 -13.0811 -6.2958 -6.2958 -4.3603 -4.3603 -4.3271 -4.3271 -1.8287 -1.8287 -1.7700 -1.7700 -1.4325 -1.4325 -1.0092 -1.0092 -0.1962 -0.1962 -0.1567 -0.1567 -0.0627 -0.0627 -0.0094 -0.0094 2.9257 2.9257 3.1019 3.1019 3.4700 3.4700 3.5476 3.5476 3.7727 3.7727 3.8560 3.8560 4.2056 4.2056 4.2963 4.2963 5.1537 5.1537 5.1664 5.1664 11.3112 11.3112 11.5798 11.5798 12.0740 12.0740 12.8312 12.8312 12.9830 12.9830 13.2892 13.2892 k = 0.6367-0.0969-0.6065 ( 6282 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6664 -19.6664 -16.4173 -16.4173 -16.3944 -16.3944 -13.3660 -13.3660 -13.1663 -13.1663 -13.1259 -13.1259 -13.0778 -13.0778 -6.2958 -6.2958 -4.3614 -4.3614 -4.3261 -4.3261 -1.8566 -1.8566 -1.7769 -1.7769 -1.4043 -1.4043 -0.9997 -0.9997 -0.1963 -0.1963 -0.1583 -0.1583 -0.0682 -0.0682 -0.0083 -0.0083 2.9166 2.9166 3.1009 3.1009 3.4520 3.4520 3.5540 3.5540 3.7906 3.7906 3.8394 3.8394 4.2154 4.2154 4.3062 4.3062 5.1514 5.1514 5.1818 5.1818 11.2938 11.2938 11.5796 11.5796 12.0809 12.0809 12.8498 12.8498 12.9774 12.9774 13.2590 13.2590 k = 0.6291-0.0794-0.6065 ( 6284 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6666 -19.6666 -16.4202 -16.4202 -16.3918 -16.3918 -13.3645 -13.3645 -13.1663 -13.1663 -13.1290 -13.1290 -13.0742 -13.0742 -6.2958 -6.2958 -4.3631 -4.3631 -4.3246 -4.3246 -1.8857 -1.8857 -1.7854 -1.7854 -1.3749 -1.3749 -0.9879 -0.9879 -0.1976 -0.1976 -0.1590 -0.1590 -0.0743 -0.0743 -0.0083 -0.0083 2.9084 2.9084 3.0995 3.0995 3.4333 3.4333 3.5598 3.5598 3.8079 3.8079 3.8251 3.8251 4.2247 4.2247 4.3170 4.3170 5.1491 5.1491 5.1995 5.1995 11.2761 11.2761 11.5791 11.5791 12.0870 12.0870 12.8677 12.8677 12.9740 12.9740 13.2294 13.2294 k = 0.6215-0.0620-0.6065 ( 6288 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6668 -19.6668 -16.4231 -16.4231 -16.3894 -16.3894 -13.3625 -13.3625 -13.1665 -13.1665 -13.1324 -13.1324 -13.0705 -13.0705 -6.2959 -6.2959 -4.3654 -4.3654 -4.3227 -4.3227 -1.9151 -1.9151 -1.7952 -1.7952 -1.3452 -1.3452 -0.9741 -0.9741 -0.1995 -0.1995 -0.1589 -0.1589 -0.0810 -0.0810 -0.0093 -0.0093 2.9011 2.9011 3.0977 3.0977 3.4140 3.4140 3.5648 3.5648 3.8026 3.8026 3.8348 3.8348 4.2333 4.2333 4.3287 4.3287 5.1477 5.1477 5.2183 5.2183 11.2583 11.2583 11.5782 11.5782 12.0923 12.0923 12.8824 12.8824 12.9756 12.9756 13.2008 13.2008 k = 0.6139-0.0445-0.6065 ( 6286 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6671 -19.6671 -16.4258 -16.4258 -16.3871 -16.3871 -13.3600 -13.3600 -13.1668 -13.1668 -13.1361 -13.1361 -13.0666 -13.0666 -6.2960 -6.2960 -4.3680 -4.3680 -4.3205 -4.3205 -1.9443 -1.9443 -1.8060 -1.8060 -1.3156 -1.3156 -0.9588 -0.9588 -0.2018 -0.2018 -0.1586 -0.1586 -0.0880 -0.0880 -0.0115 -0.0115 2.8948 2.8948 3.0958 3.0958 3.3944 3.3944 3.5692 3.5692 3.7866 3.7866 3.8561 3.8561 4.2411 4.2411 4.3411 4.3411 5.1472 5.1472 5.2381 5.2381 11.2405 11.2405 11.5770 11.5770 12.0967 12.0967 12.8906 12.8906 12.9854 12.9854 13.1733 13.1733 k = 0.6063-0.0270-0.6065 ( 6288 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6674 -19.6674 -16.4285 -16.4285 -16.3849 -16.3849 -13.3570 -13.3570 -13.1672 -13.1672 -13.1400 -13.1400 -13.0626 -13.0626 -6.2962 -6.2962 -4.3709 -4.3709 -4.3182 -4.3182 -1.9729 -1.9729 -1.8173 -1.8173 -1.2865 -1.2865 -0.9423 -0.9423 -0.2042 -0.2042 -0.1584 -0.1584 -0.0951 -0.0951 -0.0147 -0.0147 2.8892 2.8892 3.0938 3.0938 3.3744 3.3744 3.5731 3.5731 3.7703 3.7703 3.8784 3.8784 4.2481 4.2481 4.3541 4.3541 5.1476 5.1476 5.2583 5.2583 11.2229 11.2229 11.5755 11.5755 12.1002 12.1002 12.8915 12.8915 13.0041 13.0041 13.1472 13.1472 k = 0.5987-0.0096-0.6065 ( 6288 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6677 -19.6677 -16.4311 -16.4311 -16.3828 -16.3828 -13.3536 -13.3536 -13.1677 -13.1677 -13.1441 -13.1441 -13.0586 -13.0586 -6.2964 -6.2964 -4.3740 -4.3740 -4.3158 -4.3158 -2.0005 -2.0005 -1.8288 -1.8288 -1.2582 -1.2582 -0.9249 -0.9249 -0.2065 -0.2065 -0.1586 -0.1586 -0.1021 -0.1021 -0.0189 -0.0189 2.8845 2.8845 3.0918 3.0918 3.3545 3.3545 3.5764 3.5764 3.7543 3.7543 3.9010 3.9010 4.2544 4.2544 4.3674 4.3674 5.1486 5.1486 5.2789 5.2789 11.2057 11.2057 11.5738 11.5738 12.1031 12.1031 12.8874 12.8874 13.0295 13.0295 13.1229 13.1229 k = 0.5911 0.0079-0.6065 ( 6290 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6680 -19.6680 -16.4335 -16.4335 -16.3809 -16.3809 -13.3498 -13.3498 -13.1683 -13.1683 -13.1485 -13.1485 -13.0546 -13.0546 -6.2966 -6.2966 -4.3770 -4.3770 -4.3134 -4.3134 -2.0270 -2.0270 -1.8404 -1.8404 -1.2309 -1.2309 -0.9071 -0.9071 -0.2086 -0.2086 -0.1596 -0.1596 -0.1086 -0.1086 -0.0239 -0.0239 2.8806 2.8806 3.0901 3.0901 3.3345 3.3345 3.5793 3.5793 3.7387 3.7387 3.9232 3.9232 4.2600 4.2600 4.3808 4.3808 5.1503 5.1503 5.2994 5.2994 11.1890 11.1890 11.5720 11.5720 12.1052 12.1052 12.8805 12.8805 13.0578 13.0578 13.1019 13.1019 k = 0.5835 0.0253-0.6065 ( 6286 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6683 -19.6683 -16.4358 -16.4358 -16.3791 -16.3791 -13.3457 -13.3457 -13.1689 -13.1689 -13.1530 -13.1530 -13.0508 -13.0508 -6.2968 -6.2968 -4.3801 -4.3801 -4.3111 -4.3111 -2.0520 -2.0520 -1.8517 -1.8517 -1.2047 -1.2047 -0.8891 -0.8891 -0.2104 -0.2104 -0.1616 -0.1616 -0.1141 -0.1141 -0.0296 -0.0296 2.8774 2.8774 3.0887 3.0887 3.3148 3.3148 3.5817 3.5817 3.7239 3.7239 3.9448 3.9448 4.2649 4.2649 4.3940 4.3940 5.1524 5.1524 5.3197 5.3197 11.1731 11.1731 11.5700 11.5700 12.1066 12.1066 12.8722 12.8722 13.0701 13.0701 13.1018 13.1018 k = 0.5759 0.0428-0.6065 ( 6286 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6686 -19.6686 -16.4379 -16.4379 -16.3775 -16.3775 -13.3413 -13.3413 -13.1695 -13.1695 -13.1576 -13.1576 -13.0471 -13.0471 -6.2970 -6.2970 -4.3831 -4.3831 -4.3088 -4.3088 -2.0754 -2.0754 -1.8626 -1.8626 -1.1800 -1.1800 -0.8713 -0.8713 -0.2120 -0.2120 -0.1650 -0.1650 -0.1184 -0.1184 -0.0359 -0.0359 2.8748 2.8748 3.0879 3.0879 3.2953 3.2953 3.5839 3.5839 3.7098 3.7098 3.9655 3.9655 4.2693 4.2693 4.4068 4.4068 5.1549 5.1549 5.3393 5.3393 11.1579 11.1579 11.5680 11.5680 12.1074 12.1074 12.8634 12.8634 13.0545 13.0545 13.1340 13.1340 k = 0.5683 0.0603-0.6065 ( 6284 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6689 -19.6689 -16.4399 -16.4399 -16.3760 -16.3760 -13.3368 -13.3368 -13.1701 -13.1701 -13.1623 -13.1623 -13.0437 -13.0437 -6.2972 -6.2972 -4.3859 -4.3859 -4.3067 -4.3067 -2.0971 -2.0971 -1.8729 -1.8729 -1.1568 -1.1568 -0.8540 -0.8540 -0.2133 -0.2133 -0.1698 -0.1698 -0.1213 -0.1213 -0.0426 -0.0426 2.8728 2.8728 3.0876 3.0876 3.2763 3.2763 3.5858 3.5858 3.6966 3.6966 3.9849 3.9849 4.2732 4.2732 4.4189 4.4189 5.1576 5.1576 5.3582 5.3582 11.1438 11.1438 11.5659 11.5659 12.1078 12.1078 12.8545 12.8545 13.0376 13.0376 13.1715 13.1715 k = 0.5607 0.0777-0.6065 ( 6286 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6692 -19.6692 -16.4417 -16.4417 -16.3746 -16.3746 -13.3322 -13.3322 -13.1709 -13.1709 -13.1668 -13.1668 -13.0404 -13.0404 -6.2975 -6.2975 -4.3885 -4.3885 -4.3047 -4.3047 -2.1168 -2.1168 -1.8825 -1.8825 -1.1354 -1.1354 -0.8374 -0.8374 -0.2144 -0.2144 -0.1755 -0.1755 -0.1230 -0.1230 -0.0496 -0.0496 2.8713 2.8713 3.0882 3.0882 3.2578 3.2578 3.5875 3.5875 3.6844 3.6844 4.0029 4.0029 4.2766 4.2766 4.4302 4.4302 5.1604 5.1604 5.3759 5.3759 11.1308 11.1308 11.5640 11.5640 12.1077 12.1077 12.8458 12.8458 13.0220 13.0220 13.2112 13.2112 k = 0.5531 0.0952-0.6065 ( 6290 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6694 -19.6694 -16.4433 -16.4433 -16.3734 -16.3734 -13.3275 -13.3275 -13.1727 -13.1727 -13.1702 -13.1702 -13.0375 -13.0375 -6.2977 -6.2977 -4.3910 -4.3910 -4.3029 -4.3029 -2.1346 -2.1346 -1.8911 -1.8911 -1.1158 -1.1158 -0.8219 -0.8219 -0.2152 -0.2152 -0.1818 -0.1818 -0.1239 -0.1239 -0.0566 -0.0566 2.8702 2.8702 3.0896 3.0896 3.2400 3.2400 3.5891 3.5891 3.6732 3.6732 4.0192 4.0192 4.2796 4.2796 4.4405 4.4405 5.1633 5.1633 5.3922 5.3922 11.1190 11.1190 11.5620 11.5620 12.1073 12.1073 12.8375 12.8375 13.0083 13.0083 13.2524 13.2524 k = 0.5456 0.1126-0.6065 ( 6290 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6696 -19.6696 -16.4447 -16.4447 -16.3724 -16.3724 -13.3230 -13.3230 -13.1767 -13.1767 -13.1712 -13.1712 -13.0349 -13.0349 -6.2979 -6.2979 -4.3932 -4.3932 -4.3012 -4.3012 -2.1502 -2.1502 -1.8988 -1.8988 -1.0984 -1.0984 -0.8078 -0.8078 -0.2159 -0.2159 -0.1881 -0.1881 -0.1242 -0.1242 -0.0633 -0.0633 2.8695 2.8695 3.0919 3.0919 3.2229 3.2229 3.5905 3.5905 3.6632 3.6632 4.0337 4.0337 4.2822 4.2822 4.4496 4.4496 5.1660 5.1660 5.4069 5.4069 11.1086 11.1086 11.5603 11.5603 12.1067 12.1067 12.8298 12.8298 12.9965 12.9965 13.2949 13.2949 k = 0.5380 0.1301-0.6065 ( 6290 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6698 -19.6698 -16.4459 -16.4459 -16.3715 -16.3715 -13.3188 -13.3188 -13.1807 -13.1807 -13.1717 -13.1717 -13.0326 -13.0326 -6.2980 -6.2980 -4.3951 -4.3951 -4.2998 -4.2998 -2.1635 -2.1635 -1.9054 -1.9054 -1.0833 -1.0833 -0.7952 -0.7952 -0.2163 -0.2163 -0.1940 -0.1940 -0.1242 -0.1242 -0.0696 -0.0696 2.8690 2.8690 3.0952 3.0952 3.2068 3.2068 3.5919 3.5919 3.6543 3.6543 4.0462 4.0462 4.2844 4.2844 4.4576 4.4576 5.1685 5.1685 5.4197 5.4197 11.0996 11.0996 11.5587 11.5587 12.1059 12.1059 12.8231 12.8231 12.9867 12.9867 13.3381 13.3381 k = 0.5304 0.1476-0.6065 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6700 -19.6700 -16.4469 -16.4469 -16.3708 -16.3708 -13.3150 -13.3150 -13.1845 -13.1845 -13.1721 -13.1721 -13.0307 -13.0307 -6.2982 -6.2982 -4.3966 -4.3966 -4.2987 -4.2987 -2.1746 -2.1746 -1.9109 -1.9109 -1.0706 -1.0706 -0.7846 -0.7846 -0.2167 -0.2167 -0.1992 -0.1992 -0.1240 -0.1240 -0.0752 -0.0752 2.8687 2.8687 3.0996 3.0996 3.1918 3.1918 3.5932 3.5932 3.6468 3.6468 4.0565 4.0565 4.2861 4.2861 4.4642 4.4642 5.1707 5.1707 5.4305 5.4305 11.0921 11.0921 11.5574 11.5574 12.1052 12.1052 12.8173 12.8173 12.9786 12.9786 13.3815 13.3815 k = 0.5228 0.1650-0.6065 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6702 -19.6702 -16.4477 -16.4477 -16.3702 -16.3702 -13.3118 -13.3118 -13.1876 -13.1876 -13.1724 -13.1724 -13.0292 -13.0292 -6.2983 -6.2983 -4.3979 -4.3979 -4.2978 -4.2978 -2.1832 -2.1832 -1.9152 -1.9152 -1.0605 -1.0605 -0.7760 -0.7760 -0.2171 -0.2171 -0.2034 -0.2034 -0.1238 -0.1238 -0.0798 -0.0798 2.8685 2.8685 3.1048 3.1048 3.1782 3.1782 3.5944 3.5944 3.6408 3.6408 4.0647 4.0647 4.2875 4.2875 4.4694 4.4694 5.1725 5.1725 5.4391 5.4391 11.0862 11.0862 11.5563 11.5563 12.1045 12.1045 12.8126 12.8126 12.9725 12.9725 13.4242 13.4242 k = 0.5152 0.1825-0.6065 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6703 -19.6703 -16.4483 -16.4483 -16.3698 -16.3698 -13.3093 -13.3093 -13.1900 -13.1900 -13.1727 -13.1727 -13.0281 -13.0281 -6.2984 -6.2984 -4.3988 -4.3988 -4.2971 -4.2971 -2.1895 -2.1895 -1.9183 -1.9183 -1.0533 -1.0533 -0.7697 -0.7697 -0.2174 -0.2174 -0.2064 -0.2064 -0.1236 -0.1236 -0.0833 -0.0833 2.8684 2.8684 3.1105 3.1105 3.1664 3.1664 3.5954 3.5954 3.6362 3.6362 4.0706 4.0706 4.2885 4.2885 4.4731 4.4731 5.1739 5.1739 5.4453 5.4453 11.0820 11.0820 11.5555 11.5555 12.1039 12.1039 12.8092 12.8092 12.9681 12.9681 13.4641 13.4641 k = 0.5076 0.1999-0.6065 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6703 -19.6703 -16.4486 -16.4486 -16.3696 -16.3696 -13.3078 -13.3078 -13.1916 -13.1916 -13.1728 -13.1728 -13.0275 -13.0275 -6.2984 -6.2984 -4.3993 -4.3993 -4.2967 -4.2967 -2.1932 -2.1932 -1.9202 -1.9202 -1.0489 -1.0489 -0.7659 -0.7659 -0.2178 -0.2178 -0.2081 -0.2081 -0.1234 -0.1234 -0.0854 -0.0854 2.8684 2.8684 3.1156 3.1156 3.1576 3.1576 3.5961 3.5961 3.6333 3.6333 4.0741 4.0741 4.2891 4.2891 4.4754 4.4754 5.1747 5.1747 5.4491 5.4491 11.0794 11.0794 11.5550 11.5550 12.1036 12.1036 12.8072 12.8072 12.9655 12.9655 13.4965 13.4965 k = 0.5000 0.2174-0.6065 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6703 -19.6703 -16.4487 -16.4487 -16.3695 -16.3695 -13.3073 -13.3073 -13.1921 -13.1921 -13.1728 -13.1728 -13.0273 -13.0273 -6.2985 -6.2985 -4.3995 -4.3995 -4.2965 -4.2965 -2.1945 -2.1945 -1.9208 -1.9208 -1.0474 -1.0474 -0.7646 -0.7646 -0.2179 -0.2179 -0.2087 -0.2087 -0.1234 -0.1234 -0.0862 -0.0862 2.8684 2.8684 3.1179 3.1179 3.1540 3.1540 3.5963 3.5963 3.6324 3.6324 4.0753 4.0753 4.2893 4.2893 4.4762 4.4762 5.1750 5.1750 5.4504 5.4504 11.0786 11.0786 11.5549 11.5549 12.1035 12.1035 12.8065 12.8065 12.9646 12.9646 13.5104 13.5104 k = 0.5000 0.2174-0.6065 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6703 -19.6703 -16.4487 -16.4487 -16.3695 -16.3695 -13.3073 -13.3073 -13.1921 -13.1921 -13.1728 -13.1728 -13.0273 -13.0273 -6.2985 -6.2985 -4.3995 -4.3995 -4.2965 -4.2965 -2.1945 -2.1945 -1.9208 -1.9208 -1.0474 -1.0474 -0.7646 -0.7646 -0.2179 -0.2179 -0.2087 -0.2087 -0.1234 -0.1234 -0.0862 -0.0862 2.8684 2.8684 3.1179 3.1179 3.1540 3.1540 3.5963 3.5963 3.6324 3.6324 4.0753 4.0753 4.2893 4.2893 4.4762 4.4762 5.1750 5.1750 5.4504 5.4504 11.0786 11.0786 11.5549 11.5549 12.1035 12.1035 12.8065 12.8065 12.9646 12.9646 13.5104 13.5104 k = 0.5131 0.2231-0.5937 ( 6310 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6703 -19.6703 -16.4486 -16.4486 -16.3696 -16.3696 -13.3073 -13.3073 -13.1920 -13.1920 -13.1726 -13.1726 -13.0274 -13.0274 -6.2985 -6.2985 -4.3996 -4.3996 -4.2966 -4.2966 -2.1955 -2.1955 -1.9205 -1.9205 -1.0470 -1.0470 -0.7642 -0.7642 -0.2184 -0.2184 -0.2089 -0.2089 -0.1233 -0.1233 -0.0862 -0.0862 2.8690 2.8690 3.1183 3.1183 3.1542 3.1542 3.5966 3.5966 3.6333 3.6333 4.0747 4.0747 4.2888 4.2888 4.4761 4.4761 5.1751 5.1751 5.4502 5.4502 11.0782 11.0782 11.5519 11.5519 12.1069 12.1069 12.8028 12.8028 12.9597 12.9597 13.5216 13.5216 k = 0.5262 0.2288-0.5808 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6704 -19.6704 -16.4484 -16.4484 -16.3700 -16.3700 -13.3076 -13.3076 -13.1916 -13.1916 -13.1720 -13.1720 -13.0276 -13.0276 -6.2985 -6.2985 -4.3996 -4.3996 -4.2966 -4.2966 -2.1987 -2.1987 -1.9196 -1.9196 -1.0458 -1.0458 -0.7632 -0.7632 -0.2201 -0.2201 -0.2097 -0.2097 -0.1230 -0.1230 -0.0863 -0.0863 2.8708 2.8708 3.1196 3.1196 3.1548 3.1548 3.5975 3.5975 3.6362 3.6362 4.0729 4.0729 4.2874 4.2874 4.4760 4.4760 5.1756 5.1756 5.4498 5.4498 11.0771 11.0771 11.5434 11.5434 12.1167 12.1167 12.7911 12.7911 12.9475 12.9475 13.5529 13.5529 k = 0.5393 0.2345-0.5679 ( 6298 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9555 -33.9555 -19.6705 -19.6705 -16.4479 -16.4479 -16.3706 -16.3706 -13.3080 -13.3080 -13.1911 -13.1911 -13.1709 -13.1709 -13.0281 -13.0281 -6.2986 -6.2986 -4.3998 -4.3998 -4.2968 -4.2968 -2.2039 -2.2039 -1.9183 -1.9183 -1.0439 -1.0439 -0.7615 -0.7615 -0.2229 -0.2229 -0.2109 -0.2109 -0.1227 -0.1227 -0.0865 -0.0865 2.8738 2.8738 3.1216 3.1216 3.1557 3.1557 3.5989 3.5989 3.6409 3.6409 4.0699 4.0699 4.2851 4.2851 4.4758 4.4758 5.1765 5.1765 5.4491 5.4491 11.0754 11.0754 11.5299 11.5299 12.1322 12.1322 12.7703 12.7703 12.9334 12.9334 13.5982 13.5982 k = 0.5525 0.2402-0.5551 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6705 -19.6705 -16.4473 -16.4473 -16.3714 -16.3714 -13.3085 -13.3085 -13.1904 -13.1904 -13.1695 -13.1695 -13.0288 -13.0288 -6.2987 -6.2987 -4.4000 -4.4000 -4.2969 -4.2969 -2.2109 -2.2109 -1.9166 -1.9166 -1.0412 -1.0412 -0.7591 -0.7591 -0.2268 -0.2268 -0.2124 -0.2124 -0.1224 -0.1224 -0.0868 -0.0868 2.8780 2.8780 3.1246 3.1246 3.1570 3.1570 3.6008 3.6008 3.6474 3.6474 4.0658 4.0658 4.2819 4.2819 4.4753 4.4753 5.1777 5.1777 5.4480 5.4480 11.0730 11.0730 11.5125 11.5125 12.1523 12.1523 12.7402 12.7402 12.9216 12.9216 13.6331 13.6333 k = 0.5656 0.2459-0.5422 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6707 -19.6707 -16.4465 -16.4465 -16.3725 -16.3725 -13.3091 -13.3091 -13.1894 -13.1894 -13.1678 -13.1678 -13.0296 -13.0296 -6.2989 -6.2989 -4.4003 -4.4003 -4.2971 -4.2971 -2.2196 -2.2196 -1.9147 -1.9147 -1.0377 -1.0377 -0.7561 -0.7561 -0.2316 -0.2316 -0.2142 -0.2142 -0.1221 -0.1221 -0.0871 -0.0871 2.8834 2.8834 3.1285 3.1285 3.1588 3.1588 3.6031 3.6031 3.6556 3.6556 4.0606 4.0606 4.2780 4.2780 4.4746 4.4746 5.1794 5.1794 5.4467 5.4467 11.0700 11.0700 11.4922 11.4922 12.1756 12.1756 12.7030 12.7030 12.9136 12.9136 13.6373 13.6373 k = 0.5787 0.2516-0.5294 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6708 -19.6708 -16.4455 -16.4455 -16.3737 -16.3737 -13.3098 -13.3098 -13.1883 -13.1883 -13.1657 -13.1657 -13.0306 -13.0306 -6.2991 -6.2991 -4.4006 -4.4006 -4.2974 -4.2974 -2.2297 -2.2297 -1.9130 -1.9130 -1.0335 -1.0335 -0.7526 -0.7526 -0.2373 -0.2373 -0.2163 -0.2163 -0.1219 -0.1219 -0.0875 -0.0875 2.8898 2.8898 3.1332 3.1332 3.1611 3.1611 3.6058 3.6058 3.6655 3.6655 4.0543 4.0543 4.2733 4.2733 4.4736 4.4736 5.1817 5.1817 5.4452 5.4452 11.0665 11.0665 11.4698 11.4698 12.2009 12.2009 12.6617 12.6617 12.9089 12.9089 13.6348 13.6348 k = 0.5918 0.2573-0.5165 ( 6292 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6710 -19.6710 -16.4444 -16.4444 -16.3752 -16.3752 -13.3105 -13.3105 -13.1869 -13.1869 -13.1634 -13.1634 -13.0318 -13.0318 -6.2993 -6.2993 -4.4010 -4.4010 -4.2977 -4.2977 -2.2411 -2.2411 -1.9114 -1.9114 -1.0287 -1.0287 -0.7485 -0.7485 -0.2435 -0.2435 -0.2187 -0.2187 -0.1218 -0.1218 -0.0881 -0.0881 2.8972 2.8972 3.1390 3.1390 3.1638 3.1638 3.6086 3.6086 3.6768 3.6768 4.0471 4.0471 4.2681 4.2681 4.4721 4.4721 5.1846 5.1846 5.4433 5.4433 11.0627 11.0627 11.4462 11.4462 12.2266 12.2266 12.6192 12.6192 12.9066 12.9066 13.6307 13.6307 k = 0.6049 0.2630-0.5037 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6712 -19.6712 -16.4431 -16.4431 -16.3768 -16.3768 -13.3111 -13.3111 -13.1854 -13.1854 -13.1609 -13.1609 -13.0331 -13.0331 -6.2996 -6.2996 -4.4015 -4.4015 -4.2980 -4.2980 -2.2534 -2.2534 -1.9103 -1.9103 -1.0231 -1.0231 -0.7441 -0.7441 -0.2504 -0.2504 -0.2213 -0.2213 -0.1219 -0.1219 -0.0888 -0.0888 2.9056 2.9056 3.1458 3.1458 3.1672 3.1672 3.6114 3.6114 3.6896 3.6896 4.0388 4.0388 4.2624 4.2624 4.4700 4.4700 5.1882 5.1882 5.4412 5.4412 11.0587 11.0587 11.4220 11.4220 12.2508 12.2508 12.5784 12.5784 12.9060 12.9060 13.6257 13.6257 k = 0.6180 0.2687-0.4908 ( 6307 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6714 -19.6714 -16.4418 -16.4418 -16.3787 -16.3787 -13.3117 -13.3117 -13.1836 -13.1836 -13.1582 -13.1582 -13.0347 -13.0347 -6.2999 -6.2999 -4.4020 -4.4020 -4.2984 -4.2984 -2.2667 -2.2667 -1.9098 -1.9098 -1.0169 -1.0169 -0.7393 -0.7393 -0.2576 -0.2576 -0.2243 -0.2243 -0.1221 -0.1221 -0.0896 -0.0896 2.9150 2.9150 3.1535 3.1535 3.1711 3.1711 3.6141 3.6141 3.7037 3.7037 4.0297 4.0297 4.2563 4.2563 4.4672 4.4672 5.1927 5.1927 5.4389 5.4389 11.0546 11.0546 11.3976 11.3976 12.2710 12.2710 12.5423 12.5423 12.9066 12.9066 13.6201 13.6201 k = 0.6311 0.2744-0.4780 ( 6309 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6717 -19.6717 -16.4403 -16.4403 -16.3806 -16.3806 -13.3122 -13.3122 -13.1817 -13.1817 -13.1554 -13.1554 -13.0364 -13.0364 -6.3003 -6.3003 -4.4027 -4.4027 -4.2988 -4.2988 -2.2806 -2.2806 -1.9099 -1.9099 -1.0101 -1.0101 -0.7344 -0.7344 -0.2651 -0.2651 -0.2274 -0.2274 -0.1223 -0.1223 -0.0905 -0.0905 2.9251 2.9251 3.1624 3.1624 3.1757 3.1757 3.6165 3.6165 3.7190 3.7190 4.0199 4.0199 4.2500 4.2500 4.4637 4.4637 5.1980 5.1980 5.4363 5.4363 11.0505 11.0505 11.3736 11.3736 12.2831 12.2831 12.5151 12.5151 12.9082 12.9082 13.6141 13.6141 k = 0.6442 0.2801-0.4651 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6720 -19.6720 -16.4387 -16.4387 -16.3827 -16.3827 -13.3125 -13.3125 -13.1796 -13.1796 -13.1526 -13.1526 -13.0382 -13.0382 -6.3006 -6.3006 -4.4033 -4.4033 -4.2992 -4.2992 -2.2950 -2.2950 -1.9109 -1.9109 -1.0027 -1.0027 -0.7291 -0.7291 -0.2728 -0.2728 -0.2307 -0.2307 -0.1225 -0.1225 -0.0916 -0.0916 2.9361 2.9361 3.1721 3.1721 3.1812 3.1812 3.6185 3.6185 3.7354 3.7354 4.0093 4.0093 4.2436 4.2436 4.4593 4.4593 5.2043 5.2043 5.4336 5.4336 11.0467 11.0467 11.3501 11.3501 12.2827 12.2827 12.5013 12.5013 12.9106 12.9106 13.6077 13.6077 k = 0.6442 0.2801-0.4651 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6720 -19.6720 -16.4387 -16.4387 -16.3827 -16.3827 -13.3125 -13.3125 -13.1796 -13.1796 -13.1526 -13.1526 -13.0382 -13.0382 -6.3006 -6.3006 -4.4033 -4.4033 -4.2992 -4.2992 -2.2950 -2.2950 -1.9109 -1.9109 -1.0027 -1.0027 -0.7291 -0.7291 -0.2728 -0.2728 -0.2307 -0.2307 -0.1225 -0.1225 -0.0916 -0.0916 2.9361 2.9361 3.1721 3.1721 3.1812 3.1812 3.6185 3.6185 3.7354 3.7354 4.0093 4.0093 4.2436 4.2436 4.4593 4.4593 5.2043 5.2043 5.4336 5.4336 11.0467 11.0467 11.3501 11.3501 12.2827 12.2827 12.5013 12.5013 12.9106 12.9106 13.6077 13.6077 k = 0.6397 0.2782-0.4462 ( 6318 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6726 -19.6726 -16.4389 -16.4389 -16.3837 -16.3837 -13.3108 -13.3108 -13.1788 -13.1788 -13.1486 -13.1486 -13.0382 -13.0382 -6.3010 -6.3010 -4.4031 -4.4031 -4.3009 -4.3009 -2.3268 -2.3268 -1.9202 -1.9202 -0.9874 -0.9874 -0.7119 -0.7119 -0.2771 -0.2771 -0.2390 -0.2390 -0.1275 -0.1275 -0.0939 -0.0939 2.9387 2.9387 3.1815 3.1815 3.1939 3.1939 3.6246 3.6246 3.7422 3.7422 4.0045 4.0045 4.2464 4.2464 4.4633 4.4633 5.2179 5.2179 5.4377 5.4377 11.0167 11.0167 11.3191 11.3191 12.3029 12.3029 12.5075 12.5075 12.9040 12.9040 13.5948 13.5948 k = 0.6352 0.2762-0.4272 ( 6312 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6734 -19.6734 -16.4396 -16.4396 -16.3844 -16.3844 -13.3083 -13.3083 -13.1779 -13.1779 -13.1445 -13.1445 -13.0382 -13.0382 -6.3016 -6.3016 -4.4030 -4.4030 -4.3028 -4.3028 -2.3604 -2.3604 -1.9338 -1.9338 -0.9702 -0.9702 -0.6928 -0.6928 -0.2815 -0.2815 -0.2488 -0.2488 -0.1326 -0.1326 -0.0964 -0.0964 2.9430 2.9430 3.1843 3.1843 3.2163 3.2163 3.6311 3.6311 3.7491 3.7491 4.0002 4.0002 4.2493 4.2493 4.4675 4.4675 5.2337 5.2337 5.4432 5.4432 10.9848 10.9848 11.2862 11.2862 12.3218 12.3218 12.5163 12.5163 12.8983 12.8983 13.5800 13.5800 k = 0.6307 0.2742-0.4082 ( 6301 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6743 -19.6743 -16.4407 -16.4407 -16.3848 -16.3848 -13.3051 -13.3051 -13.1769 -13.1769 -13.1400 -13.1400 -13.0383 -13.0383 -6.3022 -6.3022 -4.4030 -4.4030 -4.3051 -4.3051 -2.3953 -2.3953 -1.9513 -1.9513 -0.9516 -0.9516 -0.6724 -0.6724 -0.2860 -0.2860 -0.2599 -0.2599 -0.1378 -0.1378 -0.0992 -0.0992 2.9489 2.9489 3.1872 3.1872 3.2416 3.2416 3.6380 3.6380 3.7558 3.7558 3.9962 3.9962 4.2524 4.2524 4.4717 4.4717 5.2515 5.2515 5.4502 5.4502 10.9511 10.9511 11.2516 11.2516 12.3397 12.3397 12.5273 12.5273 12.8936 12.8936 13.5633 13.5633 k = 0.6262 0.2723-0.3893 ( 6303 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6753 -19.6753 -16.4424 -16.4424 -16.3847 -16.3847 -13.3013 -13.3013 -13.1757 -13.1757 -13.1355 -13.1355 -13.0383 -13.0383 -6.3029 -6.3029 -4.4030 -4.4030 -4.3076 -4.3076 -2.4312 -2.4312 -1.9721 -1.9721 -0.9319 -0.9319 -0.6510 -0.6510 -0.2904 -0.2904 -0.2724 -0.2724 -0.1429 -0.1429 -0.1022 -0.1022 2.9563 2.9563 3.1903 3.1903 3.2691 3.2691 3.6453 3.6453 3.7625 3.7625 3.9925 3.9925 4.2561 4.2561 4.4760 4.4760 5.2714 5.2714 5.4586 5.4586 10.9158 10.9158 11.2154 11.2154 12.3570 12.3570 12.5400 12.5400 12.8899 12.8899 13.5449 13.5449 k = 0.6217 0.2703-0.3703 ( 6297 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6764 -19.6764 -16.4446 -16.4446 -16.3843 -16.3843 -13.2969 -13.2969 -13.1743 -13.1743 -13.1307 -13.1307 -13.0384 -13.0384 -6.3037 -6.3037 -4.4030 -4.4030 -4.3104 -4.3104 -2.4677 -2.4677 -1.9960 -1.9960 -0.9116 -0.9116 -0.6290 -0.6290 -0.2945 -0.2945 -0.2859 -0.2859 -0.1481 -0.1481 -0.1055 -0.1055 2.9650 2.9650 3.1935 3.1935 3.2984 3.2984 3.6530 3.6530 3.7688 3.7688 3.9893 3.9893 4.2602 4.2602 4.4803 4.4803 5.2932 5.2932 5.4684 5.4684 10.8791 10.8791 11.1779 11.1779 12.3741 12.3741 12.5540 12.5540 12.8872 12.8872 13.5250 13.5250 k = 0.6172 0.2684-0.3514 ( 6298 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6776 -19.6776 -16.4472 -16.4472 -16.3836 -16.3836 -13.2919 -13.2919 -13.1729 -13.1729 -13.1258 -13.1258 -13.0385 -13.0385 -6.3045 -6.3045 -4.4031 -4.4031 -4.3135 -4.3135 -2.5045 -2.5045 -2.0225 -2.0225 -0.8908 -0.8908 -0.6066 -0.6066 -0.3018 -0.3018 -0.2967 -0.2967 -0.1532 -0.1532 -0.1090 -0.1090 2.9751 2.9751 3.1968 3.1968 3.3291 3.3291 3.6611 3.6611 3.7747 3.7747 3.9865 3.9865 4.2651 4.2651 4.4848 4.4848 5.3167 5.3167 5.4796 5.4796 10.8413 10.8413 11.1391 11.1391 12.3914 12.3914 12.5687 12.5687 12.8856 12.8856 13.5036 13.5036 k = 0.6127 0.2664-0.3324 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6789 -19.6789 -16.4502 -16.4502 -16.3826 -16.3826 -13.2863 -13.2863 -13.1714 -13.1714 -13.1209 -13.1209 -13.0387 -13.0387 -6.3054 -6.3054 -4.4033 -4.4033 -4.3169 -4.3169 -2.5415 -2.5415 -2.0511 -2.0511 -0.8701 -0.8701 -0.5842 -0.5842 -0.3167 -0.3167 -0.3003 -0.3003 -0.1582 -0.1582 -0.1128 -0.1128 2.9862 2.9862 3.2002 3.2002 3.3606 3.3606 3.6698 3.6698 3.7802 3.7802 3.9842 3.9842 4.2708 4.2708 4.4893 4.4893 5.3419 5.3419 5.4920 5.4920 10.8025 10.8025 11.0993 11.0993 12.4092 12.4092 12.5838 12.5838 12.8851 12.8851 13.4810 13.4810 k = 0.6082 0.2644-0.3135 ( 6299 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6803 -19.6803 -16.4535 -16.4535 -16.3813 -16.3813 -13.2803 -13.2803 -13.1697 -13.1697 -13.1159 -13.1159 -13.0388 -13.0388 -6.3064 -6.3064 -4.4035 -4.4035 -4.3204 -4.3204 -2.5782 -2.5782 -2.0815 -2.0815 -0.8496 -0.8496 -0.5619 -0.5619 -0.3328 -0.3328 -0.3028 -0.3028 -0.1630 -0.1630 -0.1167 -0.1167 2.9984 2.9984 3.2036 3.2036 3.3927 3.3927 3.6791 3.6791 3.7850 3.7850 3.9823 3.9823 4.2775 4.2775 4.4939 4.4939 5.3686 5.3686 5.5057 5.5057 10.7631 10.7631 11.0586 11.0586 12.4277 12.4277 12.5989 12.5989 12.8857 12.8857 13.4573 13.4573 k = 0.6037 0.2625-0.2945 ( 6299 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6817 -19.6817 -16.4571 -16.4571 -16.3799 -16.3799 -13.2737 -13.2737 -13.1680 -13.1680 -13.1108 -13.1108 -13.0390 -13.0390 -6.3075 -6.3075 -4.4037 -4.4037 -4.3242 -4.3242 -2.6145 -2.6145 -2.1132 -2.1132 -0.8297 -0.8297 -0.5399 -0.5399 -0.3496 -0.3496 -0.3046 -0.3046 -0.1677 -0.1677 -0.1208 -0.1208 3.0114 3.0114 3.2069 3.2069 3.4248 3.4248 3.6892 3.6892 3.7892 3.7892 3.9810 3.9810 4.2852 4.2852 4.4987 4.4987 5.3965 5.3965 5.5205 5.5205 10.7231 10.7231 11.0171 11.0171 12.4470 12.4470 12.6139 12.6139 12.8875 12.8875 13.4327 13.4327 k = 0.5992 0.2605-0.2756 ( 6297 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6831 -19.6831 -16.4609 -16.4609 -16.3783 -16.3783 -13.2668 -13.2668 -13.1662 -13.1662 -13.1058 -13.1058 -13.0392 -13.0392 -6.3086 -6.3086 -4.4039 -4.4039 -4.3282 -4.3282 -2.6502 -2.6502 -2.1461 -2.1461 -0.8106 -0.8106 -0.5183 -0.5183 -0.3667 -0.3667 -0.3059 -0.3059 -0.1722 -0.1722 -0.1250 -0.1250 3.0252 3.0252 3.2102 3.2102 3.4565 3.4565 3.7000 3.7000 3.7928 3.7928 3.9801 3.9801 4.2941 4.2941 4.5035 4.5035 5.4256 5.4256 5.5365 5.5365 10.6829 10.6829 10.9751 10.9751 12.4669 12.4669 12.6287 12.6287 12.8905 12.8905 13.4074 13.4074 k = 0.5947 0.2586-0.2566 ( 6293 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6846 -19.6846 -16.4649 -16.4649 -16.3766 -16.3766 -13.2595 -13.2595 -13.1643 -13.1643 -13.1009 -13.1009 -13.0395 -13.0395 -6.3097 -6.3097 -4.4042 -4.4042 -4.3323 -4.3323 -2.6851 -2.6851 -2.1797 -2.1797 -0.7924 -0.7924 -0.4972 -0.4972 -0.3841 -0.3841 -0.3066 -0.3066 -0.1764 -0.1764 -0.1293 -0.1293 3.0394 3.0394 3.2133 3.2133 3.4873 3.4873 3.7119 3.7119 3.7957 3.7957 3.9797 3.9797 4.3041 4.3041 4.5084 4.5084 5.4554 5.4554 5.5535 5.5535 10.6427 10.6427 10.9328 10.9328 12.4874 12.4874 12.6432 12.6432 12.8945 12.8945 13.3816 13.3816 k = 0.5902 0.2566-0.2377 ( 6299 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6861 -19.6861 -16.4689 -16.4689 -16.3749 -16.3749 -13.2519 -13.2519 -13.1623 -13.1623 -13.0960 -13.0960 -13.0397 -13.0397 -6.3109 -6.3109 -4.4044 -4.4044 -4.3366 -4.3366 -2.7189 -2.7189 -2.2138 -2.2138 -0.7752 -0.7752 -0.4767 -0.4767 -0.4016 -0.4016 -0.3069 -0.3069 -0.1804 -0.1804 -0.1337 -0.1337 3.0540 3.0540 3.2162 3.2162 3.5168 3.5168 3.7247 3.7247 3.7980 3.7980 3.9798 3.9798 4.3154 4.3154 4.5133 4.5133 5.4857 5.4857 5.5715 5.5715 10.6027 10.6027 10.8903 10.8903 12.5081 12.5081 12.6577 12.6577 12.8997 12.8997 13.3555 13.3555 k = 0.5856 0.2546-0.2187 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6877 -19.6877 -16.4730 -16.4730 -16.3731 -16.3731 -13.2440 -13.2440 -13.1603 -13.1603 -13.0912 -13.0912 -13.0401 -13.0401 -6.3120 -6.3120 -4.4046 -4.4046 -4.3411 -4.3411 -2.7516 -2.7516 -2.2481 -2.2481 -0.7591 -0.7591 -0.4569 -0.4569 -0.4192 -0.4192 -0.3068 -0.3068 -0.1842 -0.1842 -0.1380 -0.1380 3.0688 3.0688 3.2189 3.2189 3.5446 3.5446 3.7386 3.7386 3.8000 3.8000 3.9803 3.9803 4.3279 4.3279 4.5184 4.5184 5.5161 5.5161 5.5905 5.5905 10.5631 10.5631 10.8479 10.8479 12.5286 12.5286 12.6723 12.6723 12.9058 12.9058 13.3291 13.3291 k = 0.5811 0.2527-0.1998 ( 6302 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6892 -19.6892 -16.4771 -16.4771 -16.3712 -16.3712 -13.2360 -13.2360 -13.1583 -13.1583 -13.0865 -13.0865 -13.0404 -13.0404 -6.3132 -6.3132 -4.4049 -4.4049 -4.3456 -4.3456 -2.7829 -2.7829 -2.2824 -2.2824 -0.7441 -0.7441 -0.4378 -0.4378 -0.4363 -0.4363 -0.3064 -0.3064 -0.1877 -0.1877 -0.1423 -0.1423 3.0836 3.0836 3.2213 3.2213 3.5703 3.5703 3.7531 3.7531 3.8019 3.8019 3.9811 3.9811 4.3417 4.3417 4.5234 4.5234 5.5463 5.5463 5.6106 5.6106 10.5241 10.5241 10.8058 10.8058 12.5483 12.5483 12.6876 12.6876 12.9130 12.9130 13.3028 13.3028 k = 0.5766 0.2507-0.1808 ( 6296 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6908 -19.6908 -16.4812 -16.4812 -16.3694 -16.3694 -13.2278 -13.2278 -13.1562 -13.1562 -13.0821 -13.0821 -13.0407 -13.0407 -6.3144 -6.3144 -4.4051 -4.4051 -4.3502 -4.3502 -2.8129 -2.8129 -2.3163 -2.3163 -0.7303 -0.7303 -0.4536 -0.4536 -0.4191 -0.4191 -0.3059 -0.3059 -0.1910 -0.1910 -0.1465 -0.1465 3.0982 3.0982 3.2235 3.2235 3.5938 3.5938 3.7674 3.7674 3.8049 3.8049 3.9822 3.9822 4.3565 4.3565 4.5285 4.5285 5.5757 5.5757 5.6320 5.6320 10.4860 10.4860 10.7642 10.7642 12.5665 12.5665 12.7039 12.7039 12.9209 12.9209 13.2768 13.2768 k = 0.5721 0.2488-0.1619 ( 6299 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6923 -19.6923 -16.4853 -16.4853 -16.3676 -16.3676 -13.2196 -13.2196 -13.1541 -13.1541 -13.0778 -13.0778 -13.0411 -13.0411 -6.3156 -6.3156 -4.4053 -4.4053 -4.3549 -4.3549 -2.8413 -2.8413 -2.3498 -2.3498 -0.7175 -0.7175 -0.4704 -0.4704 -0.4015 -0.4015 -0.3052 -0.3052 -0.1941 -0.1941 -0.1506 -0.1506 3.1125 3.1125 3.2255 3.2255 3.6151 3.6151 3.7793 3.7793 3.8109 3.8109 3.9835 3.9835 4.3724 4.3724 4.5335 4.5335 5.6036 5.6036 5.6549 5.6549 10.4489 10.4489 10.7233 10.7233 12.5826 12.5826 12.7219 12.7219 12.9296 12.9296 13.2511 13.2511 k = 0.5676 0.2468-0.1429 ( 6303 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6938 -19.6938 -16.4892 -16.4892 -16.3658 -16.3658 -13.2113 -13.2113 -13.1521 -13.1521 -13.0738 -13.0738 -13.0415 -13.0415 -6.3168 -6.3168 -4.4056 -4.4056 -4.3594 -4.3594 -2.8680 -2.8680 -2.3825 -2.3825 -0.7057 -0.7057 -0.4866 -0.4866 -0.3847 -0.3847 -0.3046 -0.3046 -0.1969 -0.1969 -0.1544 -0.1544 3.1264 3.1264 3.2272 3.2272 3.6342 3.6342 3.7859 3.7859 3.8225 3.8225 3.9849 3.9849 4.3892 4.3892 4.5384 4.5384 5.6296 5.6296 5.6793 5.6793 10.4130 10.4130 10.6835 10.6835 12.5961 12.5961 12.7416 12.7416 12.9390 12.9390 13.2261 13.2261 k = 0.5631 0.2448-0.1239 ( 6298 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6952 -19.6952 -16.4930 -16.4930 -16.3641 -16.3641 -13.2031 -13.2031 -13.1500 -13.1500 -13.0700 -13.0700 -13.0420 -13.0420 -6.3179 -6.3179 -4.4059 -4.4059 -4.3639 -4.3639 -2.8931 -2.8931 -2.4143 -2.4143 -0.6949 -0.6949 -0.5022 -0.5022 -0.3691 -0.3691 -0.3038 -0.3038 -0.1996 -0.1996 -0.1581 -0.1581 3.1397 3.1397 3.2286 3.2286 3.6513 3.6513 3.7885 3.7885 3.8384 3.8384 3.9864 3.9864 4.4067 4.4067 4.5433 4.5433 5.6535 5.6535 5.7050 5.7050 10.3786 10.3786 10.6449 10.6449 12.6069 12.6069 12.7631 12.7631 12.9489 12.9489 13.2018 13.2018 k = 0.5586 0.2429-0.1050 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.6966 -19.6966 -16.4967 -16.4967 -16.3624 -16.3624 -13.1951 -13.1951 -13.1480 -13.1480 -13.0665 -13.0665 -13.0424 -13.0424 -6.3191 -6.3191 -4.4063 -4.4063 -4.3683 -4.3683 -2.9164 -2.9164 -2.4449 -2.4449 -0.6849 -0.6849 -0.5172 -0.5172 -0.3547 -0.3547 -0.3028 -0.3028 -0.2020 -0.2020 -0.1615 -0.1615 3.1523 3.1523 3.2298 3.2298 3.6665 3.6665 3.7891 3.7891 3.8561 3.8561 3.9879 3.9879 4.4246 4.4246 4.5480 4.5480 5.6753 5.6753 5.7316 5.7316 10.3457 10.3457 10.6077 10.6077 12.6151 12.6151 12.7858 12.7858 12.9593 12.9593 13.1787 13.1787 k = 0.5541 0.2409-0.0860 ( 6312 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6980 -19.6980 -16.5002 -16.5002 -16.3608 -16.3608 -13.1872 -13.1872 -13.1461 -13.1461 -13.0632 -13.0632 -13.0429 -13.0429 -6.3201 -6.3201 -4.4068 -4.4068 -4.3723 -4.3723 -2.9379 -2.9379 -2.4742 -2.4742 -0.6758 -0.6758 -0.5314 -0.5314 -0.3422 -0.3422 -0.3012 -0.3012 -0.2043 -0.2043 -0.1646 -0.1646 3.1641 3.1641 3.2308 3.2308 3.6802 3.6802 3.7891 3.7891 3.8741 3.8741 3.9894 3.9894 4.4426 4.4426 4.5526 4.5526 5.6954 5.6954 5.7583 5.7583 10.3145 10.3145 10.5723 10.5723 12.6211 12.6211 12.8092 12.8092 12.9700 12.9700 13.1569 13.1569 k = 0.5496 0.2390-0.0671 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6993 -19.6993 -16.5035 -16.5035 -16.3593 -16.3593 -13.1797 -13.1797 -13.1442 -13.1442 -13.0603 -13.0603 -13.0433 -13.0433 -6.3212 -6.3212 -4.4075 -4.4075 -4.3760 -4.3760 -2.9576 -2.9576 -2.5020 -2.5020 -0.6673 -0.6673 -0.5447 -0.5447 -0.3322 -0.3322 -0.2984 -0.2984 -0.2065 -0.2065 -0.1673 -0.1673 3.1751 3.1751 3.2316 3.2316 3.6923 3.6923 3.7888 3.7888 3.8918 3.8918 3.9909 3.9909 4.4606 4.4606 4.5571 4.5571 5.7141 5.7141 5.7844 5.7844 10.2853 10.2853 10.5387 10.5387 12.6251 12.6251 12.8324 12.8324 12.9811 12.9811 13.1366 13.1366 k = 0.5451 0.2370-0.0481 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7005 -19.7005 -16.5066 -16.5066 -16.3579 -16.3579 -13.1724 -13.1724 -13.1424 -13.1424 -13.0577 -13.0577 -13.0438 -13.0438 -6.3221 -6.3221 -4.4085 -4.4085 -4.3792 -4.3792 -2.9755 -2.9755 -2.5280 -2.5280 -0.6596 -0.6596 -0.5571 -0.5571 -0.3256 -0.3256 -0.2935 -0.2935 -0.2085 -0.2085 -0.1697 -0.1697 3.1852 3.1852 3.2322 3.2322 3.7030 3.7030 3.7885 3.7885 3.9088 3.9088 3.9924 3.9924 4.4781 4.4781 4.5614 4.5614 5.7313 5.7313 5.8096 5.8096 10.2581 10.2581 10.5072 10.5072 12.6275 12.6275 12.8547 12.8547 12.9926 12.9926 13.1183 13.1183 k = 0.5406 0.2350-0.0292 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7016 -19.7016 -16.5095 -16.5095 -16.3566 -16.3566 -13.1656 -13.1656 -13.1407 -13.1407 -13.0554 -13.0554 -13.0443 -13.0443 -6.3230 -6.3230 -4.4097 -4.4097 -4.3819 -4.3819 -2.9916 -2.9916 -2.5522 -2.5522 -0.6525 -0.6525 -0.5685 -0.5685 -0.3224 -0.3224 -0.2867 -0.2867 -0.2104 -0.2104 -0.1717 -0.1717 3.1944 3.1944 3.2326 3.2326 3.7123 3.7123 3.7884 3.7884 3.9245 3.9245 3.9938 3.9938 4.4948 4.4948 4.5655 4.5655 5.7473 5.7473 5.8332 5.8332 10.2330 10.2330 10.4781 10.4781 12.6288 12.6288 12.8750 12.8750 13.0045 13.0045 13.1021 13.1021 k = 0.5361 0.2331-0.0102 ( 6301 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7026 -19.7026 -16.5121 -16.5121 -16.3554 -16.3554 -13.1592 -13.1592 -13.1391 -13.1391 -13.0533 -13.0533 -13.0447 -13.0447 -6.3239 -6.3239 -4.4112 -4.4112 -4.3841 -4.3841 -3.0058 -3.0058 -2.5743 -2.5743 -0.6461 -0.6461 -0.5788 -0.5788 -0.3214 -0.3214 -0.2790 -0.2790 -0.2122 -0.2122 -0.1732 -0.1732 3.2026 3.2026 3.2330 3.2330 3.7202 3.7202 3.7887 3.7887 3.9390 3.9390 3.9952 3.9952 4.5105 4.5105 4.5694 4.5694 5.7619 5.7619 5.8552 5.8552 10.2103 10.2103 10.4515 10.4515 12.6291 12.6291 12.8926 12.8926 13.0166 13.0166 13.0886 13.0886 k = 0.5316 0.2311 0.0087 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7035 -19.7035 -16.5144 -16.5144 -16.3544 -16.3544 -13.1533 -13.1533 -13.1377 -13.1377 -13.0516 -13.0516 -13.0451 -13.0451 -6.3246 -6.3246 -4.4129 -4.4129 -4.3856 -4.3856 -3.0183 -3.0183 -2.5942 -2.5942 -0.6404 -0.6404 -0.5881 -0.5881 -0.3216 -0.3216 -0.2715 -0.2715 -0.2138 -0.2138 -0.1743 -0.1743 3.2099 3.2099 3.2332 3.2332 3.7267 3.7267 3.7893 3.7893 3.9518 3.9518 3.9967 3.9967 4.5247 4.5247 4.5733 4.5733 5.7749 5.7749 5.8751 5.8751 10.1899 10.1899 10.4276 10.4276 12.6287 12.6287 12.9068 12.9068 13.0287 13.0287 13.0782 13.0782 k = 0.5270 0.2292 0.0277 ( 6310 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7043 -19.7043 -16.5165 -16.5165 -16.3534 -16.3534 -13.1481 -13.1481 -13.1364 -13.1364 -13.0502 -13.0502 -13.0455 -13.0455 -6.3253 -6.3253 -4.4147 -4.4147 -4.3868 -4.3868 -3.0290 -3.0290 -2.6118 -2.6118 -0.6353 -0.6353 -0.5961 -0.5961 -0.3224 -0.3224 -0.2647 -0.2647 -0.2153 -0.2153 -0.1751 -0.1751 3.2161 3.2161 3.2333 3.2333 3.7319 3.7319 3.7903 3.7903 3.9629 3.9629 3.9982 3.9982 4.5372 4.5372 4.5771 4.5771 5.7865 5.7865 5.8928 5.8928 10.1721 10.1721 10.4065 10.4065 12.6279 12.6279 12.9173 12.9173 13.0396 13.0396 13.0717 13.0717 k = 0.5225 0.2272 0.0466 ( 6307 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7050 -19.7050 -16.5183 -16.5183 -16.3526 -16.3526 -13.1435 -13.1435 -13.1353 -13.1353 -13.0491 -13.0491 -13.0458 -13.0458 -6.3258 -6.3258 -4.4165 -4.4165 -4.3875 -4.3875 -3.0380 -3.0380 -2.6269 -2.6269 -0.6311 -0.6311 -0.6028 -0.6028 -0.3235 -0.3235 -0.2588 -0.2588 -0.2167 -0.2167 -0.1754 -0.1754 3.2214 3.2214 3.2334 3.2334 3.7359 3.7359 3.7916 3.7916 3.9720 3.9720 4.0000 4.0000 4.5475 4.5475 4.5809 4.5809 5.7965 5.7965 5.9081 5.9081 10.1569 10.1569 10.3884 10.3884 12.6268 12.6268 12.9242 12.9242 13.0471 13.0471 13.0710 13.0710 k = 0.5180 0.2252 0.0656 ( 6310 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7056 -19.7056 -16.5197 -16.5197 -16.3520 -16.3520 -13.1397 -13.1397 -13.1343 -13.1343 -13.0482 -13.0482 -13.0461 -13.0461 -6.3263 -6.3263 -4.4181 -4.4181 -4.3880 -4.3880 -3.0453 -3.0453 -2.6395 -2.6395 -0.6277 -0.6277 -0.6082 -0.6082 -0.3247 -0.3247 -0.2540 -0.2540 -0.2179 -0.2179 -0.1755 -0.1755 3.2257 3.2257 3.2334 3.2334 3.7388 3.7388 3.7931 3.7931 3.9789 3.9789 4.0021 4.0021 4.5556 4.5556 4.5848 4.5848 5.8048 5.8048 5.9208 5.9208 10.1443 10.1443 10.3734 10.3734 12.6257 12.6257 12.9282 12.9282 13.0496 13.0496 13.0764 13.0764 k = 0.5135 0.2233 0.0845 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7060 -19.7060 -16.5209 -16.5209 -16.3514 -16.3514 -13.1367 -13.1367 -13.1336 -13.1336 -13.0476 -13.0476 -13.0462 -13.0462 -6.3267 -6.3267 -4.4194 -4.4194 -4.3883 -4.3883 -3.0510 -3.0510 -2.6493 -2.6493 -0.6254 -0.6254 -0.6120 -0.6120 -0.3257 -0.3257 -0.2503 -0.2503 -0.2189 -0.2189 -0.1754 -0.1754 3.2290 3.2290 3.2334 3.2334 3.7408 3.7408 3.7944 3.7944 3.9837 3.9837 4.0044 4.0044 4.5613 4.5613 4.5885 4.5885 5.8113 5.8113 5.9309 5.9309 10.1344 10.1344 10.3616 10.3616 12.6247 12.6247 12.9301 12.9301 13.0499 13.0499 13.0840 13.0840 k = 0.5090 0.2213 0.1035 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7064 -19.7064 -16.5217 -16.5217 -16.3511 -16.3511 -13.1345 -13.1345 -13.1330 -13.1330 -13.0473 -13.0473 -13.0463 -13.0463 -6.3269 -6.3269 -4.4205 -4.4205 -4.3885 -4.3885 -3.0550 -3.0550 -2.6564 -2.6564 -0.6243 -0.6243 -0.6141 -0.6141 -0.3265 -0.3265 -0.2477 -0.2477 -0.2197 -0.2197 -0.1753 -0.1753 3.2313 3.2313 3.2335 3.2335 3.7421 3.7421 3.7956 3.7956 3.9865 3.9865 4.0065 4.0065 4.5650 4.5650 4.5917 4.5917 5.8160 5.8160 5.9381 5.9381 10.1274 10.1274 10.3532 10.3532 12.6239 12.6239 12.9308 12.9308 13.0499 13.0499 13.0905 13.0905 k = 0.5045 0.2194 0.1224 ( 6310 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.7066 -19.7066 -16.5222 -16.5222 -16.3508 -16.3508 -13.1333 -13.1333 -13.1325 -13.1325 -13.0472 -13.0472 -13.0463 -13.0463 -6.3271 -6.3271 -4.4211 -4.4211 -4.3885 -4.3885 -3.0574 -3.0574 -2.6607 -2.6607 -0.6242 -0.6242 -0.6149 -0.6149 -0.3271 -0.3271 -0.2461 -0.2461 -0.2202 -0.2202 -0.1752 -0.1752 3.2325 3.2325 3.2337 3.2337 3.7428 3.7428 3.7963 3.7963 3.9881 3.9881 4.0081 4.0081 4.5671 4.5671 4.5938 4.5938 5.8188 5.8188 5.9425 5.9425 10.1231 10.1231 10.3481 10.3481 12.6233 12.6233 12.9309 12.9309 13.0500 13.0500 13.0948 13.0948 k = 0.5000 0.2174 0.1414 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9615 -33.9615 -33.9554 -33.9554 -19.7066 -19.7066 -16.5223 -16.5223 -16.3508 -16.3508 -13.1330 -13.1330 -13.1322 -13.1322 -13.0471 -13.0471 -13.0462 -13.0462 -6.3272 -6.3272 -4.4213 -4.4213 -4.3886 -4.3886 -3.0582 -3.0582 -2.6621 -2.6621 -0.6243 -0.6243 -0.6150 -0.6150 -0.3273 -0.3273 -0.2456 -0.2456 -0.2203 -0.2203 -0.1751 -0.1751 3.2328 3.2328 3.2340 3.2340 3.7430 3.7430 3.7966 3.7966 3.9885 3.9885 4.0087 4.0087 4.5677 4.5677 4.5945 4.5945 5.8198 5.8198 5.9440 5.9440 10.1217 10.1217 10.3463 10.3463 12.6231 12.6231 12.9309 12.9309 13.0500 13.0500 13.0963 13.0963 k = 0.5000-0.4663-0.3033 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4122 -16.4122 -16.4057 -16.4057 -13.3206 -13.3206 -13.1529 -13.1529 -13.1156 -13.1156 -13.1049 -13.1049 -6.3054 -6.3054 -4.4266 -4.4266 -4.2893 -4.2893 -2.1059 -2.1059 -1.9866 -1.9866 -1.0362 -1.0362 -0.8144 -0.8144 -0.3443 -0.3443 -0.2246 -0.2246 -0.0849 -0.0849 -0.0646 -0.0646 3.1218 3.1218 3.2628 3.2628 3.2830 3.2830 3.6084 3.6084 3.8980 3.8980 3.9685 3.9685 4.0482 4.0482 4.1838 4.1838 5.2217 5.2217 5.3391 5.3391 11.3027 11.3027 11.5819 11.5819 11.6365 11.6365 12.7156 12.7156 13.1561 13.1561 13.6068 13.6068 k = 0.5144-0.4554-0.2962 ( 6293 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4124 -16.4124 -16.4055 -16.4055 -13.3206 -13.3206 -13.1529 -13.1529 -13.1171 -13.1171 -13.1034 -13.1034 -6.3054 -6.3054 -4.4265 -4.4265 -4.2893 -4.2893 -2.1075 -2.1075 -1.9853 -1.9853 -1.0361 -1.0361 -0.8141 -0.8141 -0.3441 -0.3441 -0.2245 -0.2245 -0.0850 -0.0850 -0.0648 -0.0648 3.1215 3.1215 3.2620 3.2620 3.2825 3.2825 3.6077 3.6077 3.8981 3.8981 3.9705 3.9705 4.0453 4.0453 4.1868 4.1868 5.2214 5.2214 5.3396 5.3396 11.3029 11.3029 11.5720 11.5720 11.6460 11.6460 12.7140 12.7140 13.1545 13.1545 13.6069 13.6069 k = 0.5288-0.4445-0.2891 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4130 -16.4130 -16.4050 -16.4050 -13.3206 -13.3206 -13.1529 -13.1529 -13.1204 -13.1204 -13.1000 -13.1000 -6.3053 -6.3053 -4.4262 -4.4262 -4.2894 -4.2894 -2.1122 -2.1122 -1.9814 -1.9814 -1.0357 -1.0357 -0.8133 -0.8133 -0.3435 -0.3435 -0.2244 -0.2244 -0.0851 -0.0851 -0.0655 -0.0655 3.1203 3.1203 3.2597 3.2597 3.2811 3.2811 3.6054 3.6054 3.8985 3.8985 3.9763 3.9763 4.0376 4.0376 4.1950 4.1950 5.2206 5.2206 5.3410 5.3410 11.3036 11.3036 11.5513 11.5513 11.6656 11.6656 12.7093 12.7093 13.1500 13.1500 13.6070 13.6070 k = 0.5433-0.4336-0.2820 ( 6291 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4138 -16.4138 -16.4042 -16.4042 -13.3206 -13.3206 -13.1528 -13.1528 -13.1242 -13.1242 -13.0962 -13.0962 -6.3052 -6.3052 -4.4257 -4.4257 -4.2896 -4.2896 -2.1194 -2.1194 -1.9757 -1.9757 -1.0351 -1.0351 -0.8119 -0.8119 -0.3425 -0.3425 -0.2243 -0.2243 -0.0853 -0.0853 -0.0665 -0.0665 3.1183 3.1183 3.2559 3.2559 3.2789 3.2789 3.6021 3.6021 3.8992 3.8992 3.9854 3.9854 4.0264 4.0264 4.2070 4.2070 5.2193 5.2193 5.3433 5.3433 11.3047 11.3047 11.5268 11.5268 11.6884 11.6884 12.7017 12.7017 13.1426 13.1426 13.6072 13.6072 k = 0.5577-0.4228-0.2750 ( 6293 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4148 -16.4148 -16.4033 -16.4033 -13.3206 -13.3206 -13.1527 -13.1527 -13.1282 -13.1282 -13.0921 -13.0921 -6.3051 -6.3051 -4.4250 -4.4250 -4.2899 -4.2899 -2.1284 -2.1284 -1.9688 -1.9688 -1.0343 -1.0343 -0.8100 -0.8100 -0.3411 -0.3411 -0.2241 -0.2241 -0.0856 -0.0856 -0.0679 -0.0679 3.1156 3.1156 3.2505 3.2505 3.2758 3.2758 3.5983 3.5983 3.9001 3.9001 3.9969 3.9969 4.0136 4.0136 4.2216 4.2216 5.2176 5.2176 5.3464 5.3464 11.3062 11.3062 11.5004 11.5004 11.7128 11.7128 12.6916 12.6916 13.1328 13.1328 13.6076 13.6076 k = 0.5721-0.4119-0.2679 ( 6291 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4159 -16.4159 -16.4023 -16.4023 -13.3205 -13.3205 -13.1526 -13.1526 -13.1322 -13.1322 -13.0880 -13.0880 -6.3049 -6.3049 -4.4242 -4.4242 -4.2902 -4.2902 -2.1386 -2.1386 -1.9611 -1.9611 -1.0333 -1.0333 -0.8075 -0.8075 -0.3393 -0.3393 -0.2239 -0.2239 -0.0859 -0.0859 -0.0696 -0.0696 3.1120 3.1120 3.2436 3.2436 3.2720 3.2720 3.5944 3.5944 3.9011 3.9011 3.9972 3.9972 4.0132 4.0132 4.2376 4.2376 5.2156 5.2156 5.3502 5.3502 11.3079 11.3079 11.4725 11.4725 11.7385 11.7385 12.6797 12.6797 13.1209 13.1209 13.6080 13.6080 k = 0.5865-0.4010-0.2608 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4171 -16.4171 -16.4012 -16.4012 -13.3205 -13.3205 -13.1525 -13.1525 -13.1362 -13.1362 -13.0840 -13.0840 -6.3047 -6.3047 -4.4231 -4.4231 -4.2906 -4.2906 -2.1497 -2.1497 -1.9532 -1.9532 -1.0320 -1.0320 -0.8046 -0.8046 -0.3372 -0.3372 -0.2236 -0.2236 -0.0863 -0.0863 -0.0718 -0.0718 3.1075 3.1075 3.2355 3.2355 3.2674 3.2674 3.5911 3.5911 3.9019 3.9019 3.9835 3.9835 4.0285 4.0285 4.2546 4.2546 5.2134 5.2134 5.3545 5.3545 11.3100 11.3100 11.4433 11.4433 11.7657 11.7657 12.6663 12.6663 13.1074 13.1074 13.6086 13.6086 k = 0.6010-0.3902-0.2538 ( 6296 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4183 -16.4183 -16.4001 -16.4001 -13.3204 -13.3204 -13.1523 -13.1523 -13.1401 -13.1401 -13.0799 -13.0799 -6.3044 -6.3044 -4.4220 -4.4220 -4.2911 -4.2911 -2.1613 -2.1613 -1.9453 -1.9453 -1.0306 -1.0306 -0.8012 -0.8012 -0.3346 -0.3346 -0.2234 -0.2234 -0.0868 -0.0868 -0.0742 -0.0742 3.1019 3.1019 3.2263 3.2263 3.2622 3.2622 3.5886 3.5886 3.9018 3.9018 3.9701 3.9701 4.0455 4.0455 4.2720 4.2720 5.2112 5.2112 5.3593 5.3593 11.3122 11.3122 11.4132 11.4132 11.7945 11.7945 12.6519 12.6519 13.0926 13.0926 13.6091 13.6091 k = 0.6154-0.3793-0.2467 ( 6293 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4197 -16.4197 -16.3990 -16.3990 -13.3203 -13.3203 -13.1522 -13.1522 -13.1440 -13.1440 -13.0759 -13.0759 -6.3041 -6.3041 -4.4207 -4.4207 -4.2916 -4.2916 -2.1732 -2.1732 -1.9378 -1.9378 -1.0290 -1.0290 -0.7973 -0.7973 -0.3317 -0.3317 -0.2232 -0.2232 -0.0873 -0.0873 -0.0769 -0.0769 3.0952 3.0952 3.2166 3.2166 3.2564 3.2564 3.5872 3.5872 3.8995 3.8995 3.9591 3.9591 4.0633 4.0633 4.2896 4.2896 5.2089 5.2089 5.3645 5.3645 11.3143 11.3143 11.3824 11.3824 11.8251 11.8251 12.6370 12.6370 13.0769 13.0769 13.6098 13.6098 k = 0.6298-0.3684-0.2396 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4210 -16.4210 -16.3978 -16.3978 -13.3202 -13.3202 -13.1521 -13.1521 -13.1477 -13.1477 -13.0720 -13.0720 -6.3038 -6.3038 -4.4193 -4.4193 -4.2921 -4.2921 -2.1852 -2.1852 -1.9308 -1.9308 -1.0272 -1.0272 -0.7931 -0.7931 -0.3284 -0.3284 -0.2230 -0.2230 -0.0879 -0.0879 -0.0798 -0.0798 3.0870 3.0870 3.2069 3.2069 3.2502 3.2502 3.5869 3.5869 3.8938 3.8938 3.9519 3.9519 4.0814 4.0814 4.3072 4.3072 5.2068 5.2068 5.3700 5.3700 11.3159 11.3159 11.3517 11.3517 11.8575 11.8575 12.6217 12.6217 13.0605 13.0605 13.6104 13.6104 k = 0.6442-0.3576-0.2326 ( 6300 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6715 -19.6715 -16.4225 -16.4225 -16.3966 -16.3966 -13.3199 -13.3199 -13.1523 -13.1523 -13.1510 -13.1510 -13.0682 -13.0682 -6.3035 -6.3035 -4.4178 -4.4178 -4.2927 -4.2927 -2.1971 -2.1971 -1.9244 -1.9244 -1.0253 -1.0253 -0.7884 -0.7884 -0.3247 -0.3247 -0.2229 -0.2229 -0.0887 -0.0887 -0.0829 -0.0829 3.0772 3.0772 3.1977 3.1977 3.2437 3.2437 3.5876 3.5876 3.8839 3.8839 3.9493 3.9493 4.0996 4.0996 4.3245 4.3245 5.2048 5.2048 5.3757 5.3757 11.3106 11.3106 11.3278 11.3278 11.8918 11.8918 12.6063 12.6063 13.0439 13.0439 13.6110 13.6110 k = 0.6587-0.3467-0.2255 ( 6294 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6715 -19.6715 -16.4240 -16.4240 -16.3953 -16.3953 -13.3197 -13.3197 -13.1551 -13.1551 -13.1516 -13.1516 -13.0645 -13.0645 -6.3032 -6.3032 -4.4162 -4.4162 -4.2934 -4.2934 -2.2088 -2.2088 -1.9187 -1.9187 -1.0233 -1.0233 -0.7834 -0.7834 -0.3206 -0.3206 -0.2229 -0.2229 -0.0899 -0.0899 -0.0857 -0.0857 3.0657 3.0657 3.1895 3.1895 3.2369 3.2369 3.5892 3.5892 3.8711 3.8711 3.9503 3.9503 4.1175 4.1175 4.3415 4.3415 5.2031 5.2031 5.3815 5.3815 11.2837 11.2837 11.3254 11.3254 11.9281 11.9281 12.5909 12.5909 13.0272 13.0272 13.6115 13.6115 k = 0.6731-0.3358-0.2184 ( 6299 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6715 -19.6715 -16.4255 -16.4255 -16.3940 -16.3940 -13.3193 -13.3193 -13.1584 -13.1584 -13.1516 -13.1516 -13.0610 -13.0610 -6.3028 -6.3028 -4.4146 -4.4146 -4.2940 -4.2940 -2.2203 -2.2203 -1.9139 -1.9139 -1.0212 -1.0212 -0.7781 -0.7781 -0.3162 -0.3162 -0.2231 -0.2231 -0.0921 -0.0921 -0.0876 -0.0876 3.0526 3.0526 3.1827 3.1827 3.2299 3.2299 3.5917 3.5917 3.8565 3.8565 3.9536 3.9536 4.1350 4.1350 4.3579 4.3579 5.2016 5.2016 5.3874 5.3874 11.2528 11.2528 11.3274 11.3274 11.9663 11.9663 12.5757 12.5757 13.0108 13.0108 13.6119 13.6119 k = 0.6875-0.3249-0.2113 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6715 -19.6715 -16.4270 -16.4270 -16.3926 -16.3926 -13.3189 -13.3189 -13.1617 -13.1617 -13.1516 -13.1516 -13.0575 -13.0575 -6.3025 -6.3025 -4.4130 -4.4130 -4.2947 -4.2947 -2.2314 -2.2314 -1.9100 -1.9100 -1.0191 -1.0191 -0.7724 -0.7724 -0.3116 -0.3116 -0.2233 -0.2233 -0.0953 -0.0953 -0.0887 -0.0887 3.0381 3.0381 3.1774 3.1774 3.2229 3.2229 3.5947 3.5947 3.8411 3.8411 3.9583 3.9583 4.1519 4.1519 4.3738 4.3738 5.2005 5.2005 5.3933 5.3933 11.2221 11.2221 11.3299 11.3299 12.0062 12.0062 12.5607 12.5607 12.9950 12.9950 13.6122 13.6122 k = 0.7019-0.3141-0.2043 ( 6308 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6716 -19.6716 -16.4286 -16.4286 -16.3913 -16.3913 -13.3184 -13.3184 -13.1648 -13.1648 -13.1516 -13.1516 -13.0543 -13.0543 -6.3022 -6.3022 -4.4114 -4.4114 -4.2953 -4.2953 -2.2421 -2.2421 -1.9070 -1.9070 -1.0168 -1.0168 -0.7666 -0.7666 -0.3065 -0.3065 -0.2238 -0.2238 -0.0990 -0.0990 -0.0893 -0.0893 3.0227 3.0227 3.1736 3.1736 3.2160 3.2160 3.5981 3.5981 3.8253 3.8253 3.9641 3.9641 4.1681 4.1681 4.3889 4.3889 5.1998 5.1998 5.3993 5.3993 11.1921 11.1921 11.3326 11.3326 12.0476 12.0476 12.5461 12.5461 12.9798 12.9798 13.6123 13.6123 k = 0.7164-0.3032-0.1972 ( 6305 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6716 -19.6716 -16.4303 -16.4303 -16.3899 -16.3899 -13.3177 -13.3177 -13.1677 -13.1677 -13.1516 -13.1516 -13.0511 -13.0511 -6.3019 -6.3019 -4.4098 -4.4098 -4.2960 -4.2960 -2.2523 -2.2523 -1.9050 -1.9050 -1.0145 -1.0145 -0.7606 -0.7606 -0.3013 -0.3013 -0.2244 -0.2244 -0.1029 -0.1029 -0.0899 -0.0899 3.0069 3.0069 3.1711 3.1711 3.2092 3.2092 3.6018 3.6018 3.8096 3.8096 3.9706 3.9706 4.1834 4.1834 4.4032 4.4032 5.1995 5.1995 5.4052 5.4052 11.1634 11.1634 11.3354 11.3354 12.0901 12.0901 12.5321 12.5321 12.9655 12.9655 13.6121 13.6121 k = 0.7308-0.2923-0.1901 ( 6306 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6716 -19.6716 -16.4319 -16.4319 -16.3885 -16.3885 -13.3170 -13.3170 -13.1704 -13.1704 -13.1517 -13.1517 -13.0482 -13.0482 -6.3016 -6.3016 -4.4083 -4.4083 -4.2967 -4.2967 -2.2621 -2.2621 -1.9041 -1.9041 -1.0122 -1.0122 -0.7544 -0.7544 -0.2958 -0.2958 -0.2252 -0.2252 -0.1068 -0.1068 -0.0903 -0.0903 2.9911 2.9911 3.1697 3.1697 3.2027 3.2027 3.6055 3.6055 3.7939 3.7939 3.9776 3.9776 4.1976 4.1976 4.4165 4.4165 5.1996 5.1996 5.4110 5.4110 11.1361 11.1361 11.3383 11.3383 12.1332 12.1332 12.5191 12.5191 12.9523 12.9523 13.6118 13.6118 k = 0.7452-0.2815-0.1831 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6717 -19.6717 -16.4336 -16.4336 -16.3871 -16.3871 -13.3161 -13.3161 -13.1730 -13.1730 -13.1518 -13.1518 -13.0454 -13.0454 -6.3013 -6.3013 -4.4069 -4.4069 -4.2973 -4.2973 -2.2712 -2.2712 -1.9042 -1.9042 -1.0099 -1.0099 -0.7482 -0.7482 -0.2901 -0.2901 -0.2263 -0.2263 -0.1109 -0.1109 -0.0907 -0.0907 2.9758 2.9758 3.1693 3.1693 3.1965 3.1965 3.6091 3.6091 3.7786 3.7786 3.9851 3.9851 4.2109 4.2109 4.4289 4.4289 5.2002 5.2002 5.4168 5.4168 11.1105 11.1105 11.3411 11.3411 12.1759 12.1759 12.5078 12.5078 12.9402 12.9402 13.6112 13.6112 k = 0.7596-0.2706-0.1760 ( 6310 PWs) bands (ev): -67.2962 -67.2962 -34.2463 -34.2463 -33.9616 -33.9616 -33.9555 -33.9555 -19.6718 -19.6718 -16.4353 -16.4353 -16.3856 -16.3856 -13.3151 -13.3151 -13.1754 -13.1754 -13.1520 -13.1520 -13.0428 -13.0428 -6.3010 -6.3010 -4.4056 -4.4056 -4.2980 -4.2980 -2.2798 -2.2798 -1.9054 -1.9054 -1.0075 -1.0075 -0.7419 -0.7419 -0.2843 -0.2843 -0.2275 -0.2275 -0.1149 -0.1149 -0.0910 -0.0910 2.9613 2.9613 3.1697 3.1697 3.1908 3.1908 3.6126 3.6126 3.7637 3.7637 3.9929 3.9929 4.2230 4.2230 4.4402 4.4402 5.2011 5.2011 5.4225 5.4225 11.0870 11.0870 11.3441 11.3441 12.2169 12.2169 12.4994 12.4994 12.9292 12.9292 13.6103 13.6103 k = 0.7741-0.2597-0.1689 ( 6309 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9555 -33.9555 -19.6719 -19.6719 -16.4370 -16.4370 -16.3842 -16.3842 -13.3139 -13.3139 -13.1776 -13.1776 -13.1523 -13.1523 -13.0404 -13.0404 -6.3008 -6.3008 -4.4044 -4.4044 -4.2986 -4.2986 -2.2877 -2.2877 -1.9076 -1.9076 -1.0051 -1.0051 -0.7355 -0.7355 -0.2785 -0.2785 -0.2290 -0.2290 -0.1188 -0.1188 -0.0913 -0.0913 2.9479 2.9479 3.1707 3.1707 3.1856 3.1856 3.6157 3.6157 3.7492 3.7492 4.0009 4.0009 4.2339 4.2339 4.4503 4.4503 5.2025 5.2025 5.4281 5.4281 11.0657 11.0657 11.3470 11.3470 12.2537 12.2537 12.4961 12.4961 12.9193 12.9193 13.6091 13.6091 k = 0.7885-0.2489-0.1619 ( 6304 PWs) bands (ev): -67.2962 -67.2962 -34.2462 -34.2462 -33.9616 -33.9616 -33.9554 -33.9554 -19.6720 -19.6720 -16.4387 -16.4387 -16.3827 -16.3827 -13.3126 -13.3126 -13.1796 -13.1796 -13.1526 -13.1526 -13.0381 -13.0381 -6.3006 -6.3006 -4.4033 -4.4033 -4.2992 -4.2992 -2.2949 -2.2949 -1.9109 -1.9109 -1.0028 -1.0028 -0.7292 -0.7292 -0.2728 -0.2728 -0.2307 -0.2307 -0.1225 -0.1225 -0.0916 -0.0916 2.9360 2.9360 3.1721 3.1721 3.1812 3.1812 3.6185 3.6185 3.7354 3.7354 4.0093 4.0093 4.2436 4.2436 4.4593 4.4593 5.2043 5.2043 5.4337 5.4337 11.0467 11.0467 11.3501 11.3501 12.2827 12.2827 12.5013 12.5013 12.9106 12.9106 13.6077 13.6077 Writing output data file BaMgxCO3x2.save init_run : 0.62s CPU 1.01s WALL ( 1 calls) electrons : 459.47s CPU 465.24s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.10s WALL ( 1 calls) potinit : 0.04s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 459.46s CPU 465.23s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.06s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.10s WALL ( 267 calls) cegterg : 435.62s CPU 439.58s WALL ( 691 calls) Called by sum_band: Called by *egterg: h_psi : 259.38s CPU 261.83s WALL ( 12250 calls) s_psi : 9.64s CPU 9.88s WALL ( 12250 calls) g_psi : 0.60s CPU 0.58s WALL ( 11292 calls) cdiaghg : 135.23s CPU 136.81s WALL ( 11559 calls) cegterg:over : 18.53s CPU 18.48s WALL ( 11292 calls) cegterg:upda : 16.84s CPU 17.12s WALL ( 11292 calls) cegterg:last : 7.98s CPU 8.03s WALL ( 1489 calls) cdiaghg:chol : 7.82s CPU 7.93s WALL ( 11559 calls) cdiaghg:inve : 5.48s CPU 5.68s WALL ( 11559 calls) cdiaghg:para : 9.81s CPU 9.65s WALL ( 23118 calls) Called by h_psi: h_psi:vloc : 236.06s CPU 238.28s WALL ( 12250 calls) h_psi:vnl : 22.72s CPU 22.89s WALL ( 12250 calls) add_vuspsi : 10.76s CPU 10.72s WALL ( 12250 calls) General routines calbec : 11.90s CPU 12.13s WALL ( 12250 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 217.98s CPU 219.91s WALL ( 1305316 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.23s CPU 0.37s WALL ( 534 calls) Parallel routines fft_scatter : 67.13s CPU 67.31s WALL ( 1305339 calls) PWSCF : 8m 4.61s CPU 8m42.69s WALL This run was terminated on: 16:25: 9 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=