Program PWSCF v.5.1.1 starts on 27Aug2015 at 4: 7: 4 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./RuC.save/ file Ru.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 19 11 3 404 173 29 Max 20 12 4 411 184 33 Sum 955 559 163 19603 8609 1459 bravais-lattice index = 14 lattice parameter (alat) = 6.1569 a.u. unit-cell volume = 165.0292 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 2 number of electrons = 20.00 number of Kohn-Sham states= 28 kinetic-energy cutoff = 53.0000 Ry charge density cutoff = 368.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.156850 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Ru read from file: /home/autes/Pseudo/Ru.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 0c52cdb75a9e7ce306835bb52173403e Pseudo is Ultrasoft + core correction, Zval = 16.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1233 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for C read from file: /home/autes/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 Ru 16.00 101.07000 Ru( 1.00) C 4.00 12.01070 C( 1.00) 6 Sym. Ops. (no 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 = 2 120 deg rotation - cryst. axis [0,0,1] cryst. s( 2) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 2) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 3) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 3) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 5) = ( 0.5000000 0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s( 6) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_3v (3m) there are 6 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3s_v -3s_v G_4 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6 1.00 -1.00 -1.00 1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3s_v -3s_v G_4 0.00 0.00 0.00 0.00 0.00 0.00 G_5 0.00 0.00 0.00 0.00 1.00 -1.00 G_6 0.00 0.00 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 2C3 2 3 3s_v 4 5 -6 3s_v 6 -4 -5 -E -1 -2C3 -2 -3 Cartesian axes number of k points= 455 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021978 k( 2) = ( 0.0072464 -0.0041837 0.0059166), wk = 0.0021978 k( 3) = ( 0.0144928 -0.0083674 0.0118333), wk = 0.0021978 k( 4) = ( 0.0217391 -0.0125511 0.0177499), wk = 0.0021978 k( 5) = ( 0.0289855 -0.0167348 0.0236666), wk = 0.0021978 k( 6) = ( 0.0362319 -0.0209185 0.0295832), wk = 0.0021978 k( 7) = ( 0.0434783 -0.0251022 0.0354999), wk = 0.0021978 k( 8) = ( 0.0507246 -0.0292859 0.0414165), wk = 0.0021978 k( 9) = ( 0.0579710 -0.0334696 0.0473331), wk = 0.0021978 k( 10) = ( 0.0652174 -0.0376533 0.0532498), wk = 0.0021978 k( 11) = ( 0.0724638 -0.0418370 0.0591664), wk = 0.0021978 k( 12) = ( 0.0797101 -0.0460207 0.0650831), wk = 0.0021978 k( 13) = ( 0.0869565 -0.0502044 0.0709997), wk = 0.0021978 k( 14) = ( 0.0942029 -0.0543881 0.0769163), wk = 0.0021978 k( 15) = ( 0.1014493 -0.0585718 0.0828330), wk = 0.0021978 k( 16) = ( 0.1086957 -0.0627555 0.0887496), wk = 0.0021978 k( 17) = ( 0.1159420 -0.0669392 0.0946663), wk = 0.0021978 k( 18) = ( 0.1231884 -0.0711229 0.1005829), wk = 0.0021978 k( 19) = ( 0.1304348 -0.0753066 0.1064996), wk = 0.0021978 k( 20) = ( 0.1376812 -0.0794903 0.1124162), wk = 0.0021978 k( 21) = ( 0.1449275 -0.0836740 0.1183328), wk = 0.0021978 k( 22) = ( 0.1521739 -0.0878576 0.1242495), wk = 0.0021978 k( 23) = ( 0.1594203 -0.0920413 0.1301661), wk = 0.0021978 k( 24) = ( 0.1666667 -0.0962250 0.1360828), wk = 0.0021978 k( 25) = ( 0.1739130 -0.1004087 0.1419994), wk = 0.0021978 k( 26) = ( 0.1811594 -0.1045924 0.1479160), wk = 0.0021978 k( 27) = ( 0.1884058 -0.1087761 0.1538327), wk = 0.0021978 k( 28) = ( 0.1956522 -0.1129598 0.1597493), wk = 0.0021978 k( 29) = ( 0.2028986 -0.1171435 0.1656660), wk = 0.0021978 k( 30) = ( 0.2101449 -0.1213272 0.1715826), wk = 0.0021978 k( 31) = ( 0.2173913 -0.1255109 0.1774993), wk = 0.0021978 k( 32) = ( 0.2246377 -0.1296946 0.1834159), wk = 0.0021978 k( 33) = ( 0.2318841 -0.1338783 0.1893325), wk = 0.0021978 k( 34) = ( 0.2391304 -0.1380620 0.1952492), wk = 0.0021978 k( 35) = ( 0.2463768 -0.1422457 0.2011658), wk = 0.0021978 k( 36) = ( 0.2536232 -0.1464294 0.2070825), wk = 0.0021978 k( 37) = ( 0.2608696 -0.1506131 0.2129991), wk = 0.0021978 k( 38) = ( 0.2681159 -0.1547968 0.2189157), wk = 0.0021978 k( 39) = ( 0.2753623 -0.1589805 0.2248324), wk = 0.0021978 k( 40) = ( 0.2826087 -0.1631642 0.2307490), wk = 0.0021978 k( 41) = ( 0.2898551 -0.1673479 0.2366657), wk = 0.0021978 k( 42) = ( 0.2971014 -0.1715316 0.2425823), wk = 0.0021978 k( 43) = ( 0.3043478 -0.1757153 0.2484990), wk = 0.0021978 k( 44) = ( 0.3115942 -0.1798990 0.2544156), wk = 0.0021978 k( 45) = ( 0.3188406 -0.1840827 0.2603322), wk = 0.0021978 k( 46) = ( 0.3260870 -0.1882664 0.2662489), wk = 0.0021978 k( 47) = ( 0.3333333 -0.1924501 0.2721655), wk = 0.0021978 k( 48) = ( 0.3405797 -0.1966338 0.2780822), wk = 0.0021978 k( 49) = ( 0.3478261 -0.2008175 0.2839988), wk = 0.0021978 k( 50) = ( 0.3550725 -0.2050012 0.2899154), wk = 0.0021978 k( 51) = ( 0.3623188 -0.2091849 0.2958321), wk = 0.0021978 k( 52) = ( 0.3695652 -0.2133686 0.3017487), wk = 0.0021978 k( 53) = ( 0.3768116 -0.2175523 0.3076654), wk = 0.0021978 k( 54) = ( 0.3840580 -0.2217360 0.3135820), wk = 0.0021978 k( 55) = ( 0.3913044 -0.2259197 0.3194987), wk = 0.0021978 k( 56) = ( 0.3985507 -0.2301034 0.3254153), wk = 0.0021978 k( 57) = ( 0.4057971 -0.2342871 0.3313319), wk = 0.0021978 k( 58) = ( 0.4130435 -0.2384708 0.3372486), wk = 0.0021978 k( 59) = ( 0.4202899 -0.2426545 0.3431652), wk = 0.0021978 k( 60) = ( 0.4275362 -0.2468382 0.3490819), wk = 0.0021978 k( 61) = ( 0.4347826 -0.2510219 0.3549985), wk = 0.0021978 k( 62) = ( 0.4420290 -0.2552056 0.3609152), wk = 0.0021978 k( 63) = ( 0.4492754 -0.2593893 0.3668318), wk = 0.0021978 k( 64) = ( 0.4565217 -0.2635729 0.3727484), wk = 0.0021978 k( 65) = ( 0.4637681 -0.2677566 0.3786651), wk = 0.0021978 k( 66) = ( 0.4710145 -0.2719403 0.3845817), wk = 0.0021978 k( 67) = ( 0.4782609 -0.2761240 0.3904984), wk = 0.0021978 k( 68) = ( 0.4855073 -0.2803077 0.3964150), wk = 0.0021978 k( 69) = ( 0.4927536 -0.2844914 0.4023316), wk = 0.0021978 k( 70) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0021978 k( 71) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0021978 k( 72) = ( 0.5000000 -0.2804273 0.4140804), wk = 0.0021978 k( 73) = ( 0.5000000 -0.2721794 0.4199125), wk = 0.0021978 k( 74) = ( 0.5000000 -0.2639316 0.4257446), wk = 0.0021978 k( 75) = ( 0.5000000 -0.2556837 0.4315768), wk = 0.0021978 k( 76) = ( 0.5000000 -0.2474358 0.4374089), wk = 0.0021978 k( 77) = ( 0.5000000 -0.2391880 0.4432410), wk = 0.0021978 k( 78) = ( 0.5000000 -0.2309401 0.4490731), wk = 0.0021978 k( 79) = ( 0.5000000 -0.2226922 0.4549052), wk = 0.0021978 k( 80) = ( 0.5000000 -0.2144444 0.4607374), wk = 0.0021978 k( 81) = ( 0.5000000 -0.2061965 0.4665695), wk = 0.0021978 k( 82) = ( 0.5000000 -0.1979487 0.4724016), wk = 0.0021978 k( 83) = ( 0.5000000 -0.1897008 0.4782337), wk = 0.0021978 k( 84) = ( 0.5000000 -0.1814529 0.4840658), wk = 0.0021978 k( 85) = ( 0.5000000 -0.1732051 0.4898979), wk = 0.0021978 k( 86) = ( 0.5000000 -0.1649572 0.4957301), wk = 0.0021978 k( 87) = ( 0.5000000 -0.1567094 0.5015622), wk = 0.0021978 k( 88) = ( 0.5000000 -0.1484615 0.5073943), wk = 0.0021978 k( 89) = ( 0.5000000 -0.1402136 0.5132264), wk = 0.0021978 k( 90) = ( 0.5000000 -0.1319658 0.5190585), wk = 0.0021978 k( 91) = ( 0.5000000 -0.1237179 0.5248907), wk = 0.0021978 k( 92) = ( 0.5000000 -0.1154701 0.5307228), wk = 0.0021978 k( 93) = ( 0.5000000 -0.1072222 0.5365549), wk = 0.0021978 k( 94) = ( 0.5000000 -0.0989743 0.5423870), wk = 0.0021978 k( 95) = ( 0.5000000 -0.0907265 0.5482191), wk = 0.0021978 k( 96) = ( 0.5000000 -0.0824786 0.5540513), wk = 0.0021978 k( 97) = ( 0.5000000 -0.0742307 0.5598834), wk = 0.0021978 k( 98) = ( 0.5000000 -0.0659829 0.5657155), wk = 0.0021978 k( 99) = ( 0.5000000 -0.0577350 0.5715476), wk = 0.0021978 k( 100) = ( 0.5000000 -0.0494872 0.5773797), wk = 0.0021978 k( 101) = ( 0.5000000 -0.0412393 0.5832118), wk = 0.0021978 k( 102) = ( 0.5000000 -0.0329914 0.5890440), wk = 0.0021978 k( 103) = ( 0.5000000 -0.0247436 0.5948761), wk = 0.0021978 k( 104) = ( 0.5000000 -0.0164957 0.6007082), wk = 0.0021978 k( 105) = ( 0.5000000 -0.0082479 0.6065403), wk = 0.0021978 k( 106) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0021978 k( 107) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0021978 k( 108) = ( 0.4950000 0.0086603 0.6123724), wk = 0.0021978 k( 109) = ( 0.4900000 0.0173205 0.6123724), wk = 0.0021978 k( 110) = ( 0.4850000 0.0259808 0.6123724), wk = 0.0021978 k( 111) = ( 0.4800000 0.0346410 0.6123724), wk = 0.0021978 k( 112) = ( 0.4750000 0.0433013 0.6123724), wk = 0.0021978 k( 113) = ( 0.4700000 0.0519615 0.6123724), wk = 0.0021978 k( 114) = ( 0.4650000 0.0606218 0.6123724), wk = 0.0021978 k( 115) = ( 0.4600000 0.0692820 0.6123724), wk = 0.0021978 k( 116) = ( 0.4550000 0.0779423 0.6123724), wk = 0.0021978 k( 117) = ( 0.4500000 0.0866025 0.6123724), wk = 0.0021978 k( 118) = ( 0.4450000 0.0952628 0.6123724), wk = 0.0021978 k( 119) = ( 0.4400000 0.1039230 0.6123724), wk = 0.0021978 k( 120) = ( 0.4350000 0.1125833 0.6123724), wk = 0.0021978 k( 121) = ( 0.4300000 0.1212436 0.6123724), wk = 0.0021978 k( 122) = ( 0.4250000 0.1299038 0.6123724), wk = 0.0021978 k( 123) = ( 0.4200000 0.1385641 0.6123724), wk = 0.0021978 k( 124) = ( 0.4150000 0.1472243 0.6123724), wk = 0.0021978 k( 125) = ( 0.4100000 0.1558846 0.6123724), wk = 0.0021978 k( 126) = ( 0.4050000 0.1645448 0.6123724), wk = 0.0021978 k( 127) = ( 0.4000000 0.1732051 0.6123724), wk = 0.0021978 k( 128) = ( 0.3950000 0.1818653 0.6123724), wk = 0.0021978 k( 129) = ( 0.3900000 0.1905256 0.6123724), wk = 0.0021978 k( 130) = ( 0.3850000 0.1991858 0.6123724), wk = 0.0021978 k( 131) = ( 0.3800000 0.2078461 0.6123724), wk = 0.0021978 k( 132) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0021978 k( 133) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0021978 k( 134) = ( 0.3698630 0.2135405 0.6039838), wk = 0.0021978 k( 135) = ( 0.3647260 0.2105747 0.5955951), wk = 0.0021978 k( 136) = ( 0.3595890 0.2076088 0.5872064), wk = 0.0021978 k( 137) = ( 0.3544521 0.2046430 0.5788178), wk = 0.0021978 k( 138) = ( 0.3493151 0.2016771 0.5704291), wk = 0.0021978 k( 139) = ( 0.3441781 0.1987113 0.5620405), wk = 0.0021978 k( 140) = ( 0.3390411 0.1957455 0.5536518), wk = 0.0021978 k( 141) = ( 0.3339041 0.1927796 0.5452631), wk = 0.0021978 k( 142) = ( 0.3287671 0.1898138 0.5368745), wk = 0.0021978 k( 143) = ( 0.3236301 0.1868479 0.5284858), wk = 0.0021978 k( 144) = ( 0.3184932 0.1838821 0.5200971), wk = 0.0021978 k( 145) = ( 0.3133562 0.1809163 0.5117085), wk = 0.0021978 k( 146) = ( 0.3082192 0.1779504 0.5033198), wk = 0.0021978 k( 147) = ( 0.3030822 0.1749846 0.4949311), wk = 0.0021978 k( 148) = ( 0.2979452 0.1720187 0.4865425), wk = 0.0021978 k( 149) = ( 0.2928082 0.1690529 0.4781538), wk = 0.0021978 k( 150) = ( 0.2876712 0.1660871 0.4697652), wk = 0.0021978 k( 151) = ( 0.2825342 0.1631212 0.4613765), wk = 0.0021978 k( 152) = ( 0.2773973 0.1601554 0.4529878), wk = 0.0021978 k( 153) = ( 0.2722603 0.1571895 0.4445992), wk = 0.0021978 k( 154) = ( 0.2671233 0.1542237 0.4362105), wk = 0.0021978 k( 155) = ( 0.2619863 0.1512579 0.4278218), wk = 0.0021978 k( 156) = ( 0.2568493 0.1482920 0.4194332), wk = 0.0021978 k( 157) = ( 0.2517123 0.1453262 0.4110445), wk = 0.0021978 k( 158) = ( 0.2465753 0.1423603 0.4026558), wk = 0.0021978 k( 159) = ( 0.2414384 0.1393945 0.3942672), wk = 0.0021978 k( 160) = ( 0.2363014 0.1364287 0.3858785), wk = 0.0021978 k( 161) = ( 0.2311644 0.1334628 0.3774899), wk = 0.0021978 k( 162) = ( 0.2260274 0.1304970 0.3691012), wk = 0.0021978 k( 163) = ( 0.2208904 0.1275311 0.3607125), wk = 0.0021978 k( 164) = ( 0.2157534 0.1245653 0.3523239), wk = 0.0021978 k( 165) = ( 0.2106164 0.1215995 0.3439352), wk = 0.0021978 k( 166) = ( 0.2054795 0.1186336 0.3355465), wk = 0.0021978 k( 167) = ( 0.2003425 0.1156678 0.3271579), wk = 0.0021978 k( 168) = ( 0.1952055 0.1127019 0.3187692), wk = 0.0021978 k( 169) = ( 0.1900685 0.1097361 0.3103806), wk = 0.0021978 k( 170) = ( 0.1849315 0.1067703 0.3019919), wk = 0.0021978 k( 171) = ( 0.1797945 0.1038044 0.2936032), wk = 0.0021978 k( 172) = ( 0.1746575 0.1008386 0.2852146), wk = 0.0021978 k( 173) = ( 0.1695205 0.0978727 0.2768259), wk = 0.0021978 k( 174) = ( 0.1643836 0.0949069 0.2684372), wk = 0.0021978 k( 175) = ( 0.1592466 0.0919411 0.2600486), wk = 0.0021978 k( 176) = ( 0.1541096 0.0889752 0.2516599), wk = 0.0021978 k( 177) = ( 0.1489726 0.0860094 0.2432712), wk = 0.0021978 k( 178) = ( 0.1438356 0.0830435 0.2348826), wk = 0.0021978 k( 179) = ( 0.1386986 0.0800777 0.2264939), wk = 0.0021978 k( 180) = ( 0.1335616 0.0771118 0.2181053), wk = 0.0021978 k( 181) = ( 0.1284247 0.0741460 0.2097166), wk = 0.0021978 k( 182) = ( 0.1232877 0.0711802 0.2013279), wk = 0.0021978 k( 183) = ( 0.1181507 0.0682143 0.1929393), wk = 0.0021978 k( 184) = ( 0.1130137 0.0652485 0.1845506), wk = 0.0021978 k( 185) = ( 0.1078767 0.0622826 0.1761619), wk = 0.0021978 k( 186) = ( 0.1027397 0.0593168 0.1677733), wk = 0.0021978 k( 187) = ( 0.0976027 0.0563510 0.1593846), wk = 0.0021978 k( 188) = ( 0.0924657 0.0533851 0.1509959), wk = 0.0021978 k( 189) = ( 0.0873288 0.0504193 0.1426073), wk = 0.0021978 k( 190) = ( 0.0821918 0.0474534 0.1342186), wk = 0.0021978 k( 191) = ( 0.0770548 0.0444876 0.1258300), wk = 0.0021978 k( 192) = ( 0.0719178 0.0415218 0.1174413), wk = 0.0021978 k( 193) = ( 0.0667808 0.0385559 0.1090526), wk = 0.0021978 k( 194) = ( 0.0616438 0.0355901 0.1006640), wk = 0.0021978 k( 195) = ( 0.0565068 0.0326242 0.0922753), wk = 0.0021978 k( 196) = ( 0.0513699 0.0296584 0.0838866), wk = 0.0021978 k( 197) = ( 0.0462329 0.0266926 0.0754980), wk = 0.0021978 k( 198) = ( 0.0410959 0.0237267 0.0671093), wk = 0.0021978 k( 199) = ( 0.0359589 0.0207609 0.0587207), wk = 0.0021978 k( 200) = ( 0.0308219 0.0177950 0.0503320), wk = 0.0021978 k( 201) = ( 0.0256849 0.0148292 0.0419433), wk = 0.0021978 k( 202) = ( 0.0205479 0.0118634 0.0335546), wk = 0.0021978 k( 203) = ( 0.0154110 0.0088975 0.0251660), wk = 0.0021978 k( 204) = ( 0.0102740 0.0059317 0.0167773), wk = 0.0021978 k( 205) = ( 0.0051370 0.0029658 0.0083887), wk = 0.0021978 k( 206) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021978 k( 207) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021978 k( 208) = ( 0.0083333 0.0048113 0.0034021), wk = 0.0021978 k( 209) = ( 0.0166667 0.0096225 0.0068041), wk = 0.0021978 k( 210) = ( 0.0250000 0.0144338 0.0102062), wk = 0.0021978 k( 211) = ( 0.0333333 0.0192450 0.0136083), wk = 0.0021978 k( 212) = ( 0.0416667 0.0240563 0.0170103), wk = 0.0021978 k( 213) = ( 0.0500000 0.0288675 0.0204124), wk = 0.0021978 k( 214) = ( 0.0583333 0.0336788 0.0238145), wk = 0.0021978 k( 215) = ( 0.0666667 0.0384900 0.0272166), wk = 0.0021978 k( 216) = ( 0.0750000 0.0433013 0.0306186), wk = 0.0021978 k( 217) = ( 0.0833333 0.0481125 0.0340207), wk = 0.0021978 k( 218) = ( 0.0916667 0.0529238 0.0374228), wk = 0.0021978 k( 219) = ( 0.1000000 0.0577350 0.0408248), wk = 0.0021978 k( 220) = ( 0.1083333 0.0625463 0.0442269), wk = 0.0021978 k( 221) = ( 0.1166667 0.0673575 0.0476290), wk = 0.0021978 k( 222) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0021978 k( 223) = ( 0.1333333 0.0769800 0.0544331), wk = 0.0021978 k( 224) = ( 0.1416667 0.0817913 0.0578352), wk = 0.0021978 k( 225) = ( 0.1500000 0.0866025 0.0612372), wk = 0.0021978 k( 226) = ( 0.1583333 0.0914138 0.0646393), wk = 0.0021978 k( 227) = ( 0.1666667 0.0962250 0.0680414), wk = 0.0021978 k( 228) = ( 0.1750000 0.1010363 0.0714435), wk = 0.0021978 k( 229) = ( 0.1833333 0.1058475 0.0748455), wk = 0.0021978 k( 230) = ( 0.1916667 0.1106588 0.0782476), wk = 0.0021978 k( 231) = ( 0.2000000 0.1154701 0.0816497), wk = 0.0021978 k( 232) = ( 0.2083333 0.1202813 0.0850517), wk = 0.0021978 k( 233) = ( 0.2166667 0.1250926 0.0884538), wk = 0.0021978 k( 234) = ( 0.2250000 0.1299038 0.0918559), wk = 0.0021978 k( 235) = ( 0.2333333 0.1347151 0.0952579), wk = 0.0021978 k( 236) = ( 0.2416667 0.1395263 0.0986600), wk = 0.0021978 k( 237) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0021978 k( 238) = ( 0.2583333 0.1491488 0.1054641), wk = 0.0021978 k( 239) = ( 0.2666667 0.1539601 0.1088662), wk = 0.0021978 k( 240) = ( 0.2750000 0.1587713 0.1122683), wk = 0.0021978 k( 241) = ( 0.2833333 0.1635826 0.1156703), wk = 0.0021978 k( 242) = ( 0.2916667 0.1683938 0.1190724), wk = 0.0021978 k( 243) = ( 0.3000000 0.1732051 0.1224745), wk = 0.0021978 k( 244) = ( 0.3083333 0.1780163 0.1258766), wk = 0.0021978 k( 245) = ( 0.3166667 0.1828276 0.1292786), wk = 0.0021978 k( 246) = ( 0.3250000 0.1876388 0.1326807), wk = 0.0021978 k( 247) = ( 0.3333333 0.1924501 0.1360828), wk = 0.0021978 k( 248) = ( 0.3416667 0.1972613 0.1394848), wk = 0.0021978 k( 249) = ( 0.3500000 0.2020726 0.1428869), wk = 0.0021978 k( 250) = ( 0.3583333 0.2068838 0.1462890), wk = 0.0021978 k( 251) = ( 0.3666667 0.2116951 0.1496910), wk = 0.0021978 k( 252) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0021978 k( 253) = ( 0.3833333 0.2213176 0.1564952), wk = 0.0021978 k( 254) = ( 0.3916667 0.2261289 0.1598972), wk = 0.0021978 k( 255) = ( 0.4000000 0.2309401 0.1632993), wk = 0.0021978 k( 256) = ( 0.4083333 0.2357514 0.1667014), wk = 0.0021978 k( 257) = ( 0.4166667 0.2405626 0.1701035), wk = 0.0021978 k( 258) = ( 0.4250000 0.2453739 0.1735055), wk = 0.0021978 k( 259) = ( 0.4333333 0.2501851 0.1769076), wk = 0.0021978 k( 260) = ( 0.4416667 0.2549964 0.1803097), wk = 0.0021978 k( 261) = ( 0.4500000 0.2598076 0.1837117), wk = 0.0021978 k( 262) = ( 0.4583333 0.2646189 0.1871138), wk = 0.0021978 k( 263) = ( 0.4666667 0.2694301 0.1905159), wk = 0.0021978 k( 264) = ( 0.4750000 0.2742414 0.1939179), wk = 0.0021978 k( 265) = ( 0.4833333 0.2790526 0.1973200), wk = 0.0021978 k( 266) = ( 0.4916667 0.2838639 0.2007221), wk = 0.0021978 k( 267) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0021978 k( 268) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0021978 k( 269) = ( 0.5029762 0.2800836 0.2089842), wk = 0.0021978 k( 270) = ( 0.5059524 0.2714921 0.2138443), wk = 0.0021978 k( 271) = ( 0.5089286 0.2629006 0.2187044), wk = 0.0021978 k( 272) = ( 0.5119048 0.2543091 0.2235645), wk = 0.0021978 k( 273) = ( 0.5148810 0.2457175 0.2284246), wk = 0.0021978 k( 274) = ( 0.5178571 0.2371260 0.2332847), wk = 0.0021978 k( 275) = ( 0.5208333 0.2285345 0.2381448), wk = 0.0021978 k( 276) = ( 0.5238095 0.2199430 0.2430049), wk = 0.0021978 k( 277) = ( 0.5267857 0.2113514 0.2478650), wk = 0.0021978 k( 278) = ( 0.5297619 0.2027599 0.2527251), wk = 0.0021978 k( 279) = ( 0.5327381 0.1941684 0.2575852), wk = 0.0021978 k( 280) = ( 0.5357143 0.1855769 0.2624453), wk = 0.0021978 k( 281) = ( 0.5386905 0.1769854 0.2673054), wk = 0.0021978 k( 282) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0021978 k( 283) = ( 0.5446429 0.1598023 0.2770256), wk = 0.0021978 k( 284) = ( 0.5476190 0.1512108 0.2818857), wk = 0.0021978 k( 285) = ( 0.5505952 0.1426193 0.2867458), wk = 0.0021978 k( 286) = ( 0.5535714 0.1340277 0.2916059), wk = 0.0021978 k( 287) = ( 0.5565476 0.1254362 0.2964660), wk = 0.0021978 k( 288) = ( 0.5595238 0.1168447 0.3013261), wk = 0.0021978 k( 289) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0021978 k( 290) = ( 0.5654762 0.0996617 0.3110463), wk = 0.0021978 k( 291) = ( 0.5684524 0.0910701 0.3159064), wk = 0.0021978 k( 292) = ( 0.5714286 0.0824786 0.3207665), wk = 0.0021978 k( 293) = ( 0.5744048 0.0738871 0.3256266), wk = 0.0021978 k( 294) = ( 0.5773810 0.0652956 0.3304867), wk = 0.0021978 k( 295) = ( 0.5803571 0.0567040 0.3353468), wk = 0.0021978 k( 296) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0021978 k( 297) = ( 0.5863095 0.0395210 0.3450670), wk = 0.0021978 k( 298) = ( 0.5892857 0.0309295 0.3499271), wk = 0.0021978 k( 299) = ( 0.5922619 0.0223380 0.3547872), wk = 0.0021978 k( 300) = ( 0.5952381 0.0137464 0.3596473), wk = 0.0021978 k( 301) = ( 0.5982143 0.0051549 0.3645074), wk = 0.0021978 k( 302) = ( 0.6011905 -0.0034366 0.3693675), wk = 0.0021978 k( 303) = ( 0.6041667 -0.0120281 0.3742276), wk = 0.0021978 k( 304) = ( 0.6071429 -0.0206196 0.3790877), wk = 0.0021978 k( 305) = ( 0.6101190 -0.0292112 0.3839478), wk = 0.0021978 k( 306) = ( 0.6130952 -0.0378027 0.3888079), wk = 0.0021978 k( 307) = ( 0.6160714 -0.0463942 0.3936680), wk = 0.0021978 k( 308) = ( 0.6190476 -0.0549857 0.3985281), wk = 0.0021978 k( 309) = ( 0.6220238 -0.0635773 0.4033882), wk = 0.0021978 k( 310) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0021978 k( 311) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0021978 k( 312) = ( 0.6200000 -0.0692820 0.4164133), wk = 0.0021978 k( 313) = ( 0.6150000 -0.0663953 0.4245782), wk = 0.0021978 k( 314) = ( 0.6100000 -0.0635085 0.4327432), wk = 0.0021978 k( 315) = ( 0.6050000 -0.0606218 0.4409082), wk = 0.0021978 k( 316) = ( 0.6000000 -0.0577350 0.4490731), wk = 0.0021978 k( 317) = ( 0.5950000 -0.0548483 0.4572381), wk = 0.0021978 k( 318) = ( 0.5900000 -0.0519615 0.4654031), wk = 0.0021978 k( 319) = ( 0.5850000 -0.0490748 0.4735680), wk = 0.0021978 k( 320) = ( 0.5800000 -0.0461880 0.4817330), wk = 0.0021978 k( 321) = ( 0.5750000 -0.0433013 0.4898979), wk = 0.0021978 k( 322) = ( 0.5700000 -0.0404145 0.4980629), wk = 0.0021978 k( 323) = ( 0.5650000 -0.0375278 0.5062279), wk = 0.0021978 k( 324) = ( 0.5600000 -0.0346410 0.5143928), wk = 0.0021978 k( 325) = ( 0.5550000 -0.0317543 0.5225578), wk = 0.0021978 k( 326) = ( 0.5500000 -0.0288675 0.5307228), wk = 0.0021978 k( 327) = ( 0.5450000 -0.0259808 0.5388877), wk = 0.0021978 k( 328) = ( 0.5400000 -0.0230940 0.5470527), wk = 0.0021978 k( 329) = ( 0.5350000 -0.0202073 0.5552177), wk = 0.0021978 k( 330) = ( 0.5300000 -0.0173205 0.5633826), wk = 0.0021978 k( 331) = ( 0.5250000 -0.0144338 0.5715476), wk = 0.0021978 k( 332) = ( 0.5200000 -0.0115470 0.5797126), wk = 0.0021978 k( 333) = ( 0.5150000 -0.0086603 0.5878775), wk = 0.0021978 k( 334) = ( 0.5100000 -0.0057735 0.5960425), wk = 0.0021978 k( 335) = ( 0.5050000 -0.0028868 0.6042075), wk = 0.0021978 k( 336) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0021978 k( 337) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0021978 k( 338) = ( 0.5000000 0.0058913 0.6040408), wk = 0.0021978 k( 339) = ( 0.5000000 0.0117827 0.5957092), wk = 0.0021978 k( 340) = ( 0.5000000 0.0176740 0.5873776), wk = 0.0021978 k( 341) = ( 0.5000000 0.0235653 0.5790460), wk = 0.0021978 k( 342) = ( 0.5000000 0.0294566 0.5707145), wk = 0.0021978 k( 343) = ( 0.5000000 0.0353480 0.5623829), wk = 0.0021978 k( 344) = ( 0.5000000 0.0412393 0.5540512), wk = 0.0021978 k( 345) = ( 0.5000000 0.0471306 0.5457196), wk = 0.0021978 k( 346) = ( 0.5000000 0.0530220 0.5373881), wk = 0.0021978 k( 347) = ( 0.5000000 0.0589133 0.5290565), wk = 0.0021978 k( 348) = ( 0.5000000 0.0648046 0.5207249), wk = 0.0021978 k( 349) = ( 0.5000000 0.0706960 0.5123933), wk = 0.0021978 k( 350) = ( 0.5000000 0.0765873 0.5040617), wk = 0.0021978 k( 351) = ( 0.5000000 0.0824786 0.4957301), wk = 0.0021978 k( 352) = ( 0.5000000 0.0883699 0.4873985), wk = 0.0021978 k( 353) = ( 0.5000000 0.0942613 0.4790669), wk = 0.0021978 k( 354) = ( 0.5000000 0.1001526 0.4707353), wk = 0.0021978 k( 355) = ( 0.5000000 0.1060439 0.4624037), wk = 0.0021978 k( 356) = ( 0.5000000 0.1119353 0.4540721), wk = 0.0021978 k( 357) = ( 0.5000000 0.1178266 0.4457405), wk = 0.0021978 k( 358) = ( 0.5000000 0.1237179 0.4374089), wk = 0.0021978 k( 359) = ( 0.5000000 0.1296092 0.4290773), wk = 0.0021978 k( 360) = ( 0.5000000 0.1355006 0.4207457), wk = 0.0021978 k( 361) = ( 0.5000000 0.1413919 0.4124141), wk = 0.0021978 k( 362) = ( 0.5000000 0.1472832 0.4040825), wk = 0.0021978 k( 363) = ( 0.5000000 0.1531746 0.3957509), wk = 0.0021978 k( 364) = ( 0.5000000 0.1590659 0.3874193), wk = 0.0021978 k( 365) = ( 0.5000000 0.1649572 0.3790877), wk = 0.0021978 k( 366) = ( 0.5000000 0.1708485 0.3707561), wk = 0.0021978 k( 367) = ( 0.5000000 0.1767399 0.3624245), wk = 0.0021978 k( 368) = ( 0.5000000 0.1826312 0.3540929), wk = 0.0021978 k( 369) = ( 0.5000000 0.1885225 0.3457613), wk = 0.0021978 k( 370) = ( 0.5000000 0.1944139 0.3374297), wk = 0.0021978 k( 371) = ( 0.5000000 0.2003052 0.3290981), wk = 0.0021978 k( 372) = ( 0.5000000 0.2061965 0.3207665), wk = 0.0021978 k( 373) = ( 0.5000000 0.2120879 0.3124349), wk = 0.0021978 k( 374) = ( 0.5000000 0.2179792 0.3041033), wk = 0.0021978 k( 375) = ( 0.5000000 0.2238705 0.2957717), wk = 0.0021978 k( 376) = ( 0.5000000 0.2297618 0.2874401), wk = 0.0021978 k( 377) = ( 0.5000000 0.2356532 0.2791085), wk = 0.0021978 k( 378) = ( 0.5000000 0.2415445 0.2707769), wk = 0.0021978 k( 379) = ( 0.5000000 0.2474358 0.2624453), wk = 0.0021978 k( 380) = ( 0.5000000 0.2533272 0.2541137), wk = 0.0021978 k( 381) = ( 0.5000000 0.2592185 0.2457821), wk = 0.0021978 k( 382) = ( 0.5000000 0.2651098 0.2374505), wk = 0.0021978 k( 383) = ( 0.5000000 0.2710011 0.2291189), wk = 0.0021978 k( 384) = ( 0.5000000 0.2768925 0.2207873), wk = 0.0021978 k( 385) = ( 0.5000000 0.2827838 0.2124557), wk = 0.0021978 k( 386) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0021978 k( 387) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0021978 k( 388) = ( 0.4970238 0.2869568 0.2138443), wk = 0.0021978 k( 389) = ( 0.4940476 0.2852385 0.2235645), wk = 0.0021978 k( 390) = ( 0.4910714 0.2835202 0.2332847), wk = 0.0021978 k( 391) = ( 0.4880952 0.2818019 0.2430049), wk = 0.0021978 k( 392) = ( 0.4851190 0.2800836 0.2527251), wk = 0.0021978 k( 393) = ( 0.4821429 0.2783653 0.2624453), wk = 0.0021978 k( 394) = ( 0.4791667 0.2766470 0.2721655), wk = 0.0021978 k( 395) = ( 0.4761905 0.2749287 0.2818857), wk = 0.0021978 k( 396) = ( 0.4732143 0.2732104 0.2916059), wk = 0.0021978 k( 397) = ( 0.4702381 0.2714921 0.3013261), wk = 0.0021978 k( 398) = ( 0.4672619 0.2697738 0.3110463), wk = 0.0021978 k( 399) = ( 0.4642857 0.2680555 0.3207665), wk = 0.0021978 k( 400) = ( 0.4613095 0.2663372 0.3304867), wk = 0.0021978 k( 401) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0021978 k( 402) = ( 0.4553571 0.2629006 0.3499271), wk = 0.0021978 k( 403) = ( 0.4523810 0.2611823 0.3596473), wk = 0.0021978 k( 404) = ( 0.4494048 0.2594640 0.3693675), wk = 0.0021978 k( 405) = ( 0.4464286 0.2577457 0.3790877), wk = 0.0021978 k( 406) = ( 0.4434524 0.2560274 0.3888079), wk = 0.0021978 k( 407) = ( 0.4404762 0.2543090 0.3985281), wk = 0.0021978 k( 408) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0021978 k( 409) = ( 0.4345238 0.2508724 0.4179685), wk = 0.0021978 k( 410) = ( 0.4315476 0.2491541 0.4276887), wk = 0.0021978 k( 411) = ( 0.4285714 0.2474358 0.4374089), wk = 0.0021978 k( 412) = ( 0.4255952 0.2457175 0.4471291), wk = 0.0021978 k( 413) = ( 0.4226190 0.2439992 0.4568493), wk = 0.0021978 k( 414) = ( 0.4196429 0.2422809 0.4665695), wk = 0.0021978 k( 415) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0021978 k( 416) = ( 0.4136905 0.2388443 0.4860099), wk = 0.0021978 k( 417) = ( 0.4107143 0.2371260 0.4957301), wk = 0.0021978 k( 418) = ( 0.4077381 0.2354077 0.5054503), wk = 0.0021978 k( 419) = ( 0.4047619 0.2336894 0.5151705), wk = 0.0021978 k( 420) = ( 0.4017857 0.2319711 0.5248907), wk = 0.0021978 k( 421) = ( 0.3988095 0.2302528 0.5346109), wk = 0.0021978 k( 422) = ( 0.3958333 0.2285345 0.5443311), wk = 0.0021978 k( 423) = ( 0.3928571 0.2268162 0.5540512), wk = 0.0021978 k( 424) = ( 0.3898810 0.2250979 0.5637715), wk = 0.0021978 k( 425) = ( 0.3869048 0.2233796 0.5734917), wk = 0.0021978 k( 426) = ( 0.3839286 0.2216613 0.5832118), wk = 0.0021978 k( 427) = ( 0.3809524 0.2199430 0.5929320), wk = 0.0021978 k( 428) = ( 0.3779762 0.2182247 0.6026522), wk = 0.0021978 k( 429) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0021978 k( 430) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0021978 k( 431) = ( 0.6200000 -0.0808290 0.4082483), wk = 0.0021978 k( 432) = ( 0.6150000 -0.0894893 0.4082483), wk = 0.0021978 k( 433) = ( 0.6100000 -0.0981495 0.4082483), wk = 0.0021978 k( 434) = ( 0.6050000 -0.1068098 0.4082483), wk = 0.0021978 k( 435) = ( 0.6000000 -0.1154701 0.4082483), wk = 0.0021978 k( 436) = ( 0.5950000 -0.1241303 0.4082483), wk = 0.0021978 k( 437) = ( 0.5900000 -0.1327906 0.4082483), wk = 0.0021978 k( 438) = ( 0.5850000 -0.1414508 0.4082483), wk = 0.0021978 k( 439) = ( 0.5800000 -0.1501111 0.4082483), wk = 0.0021978 k( 440) = ( 0.5750000 -0.1587713 0.4082483), wk = 0.0021978 k( 441) = ( 0.5700000 -0.1674316 0.4082483), wk = 0.0021978 k( 442) = ( 0.5650000 -0.1760918 0.4082483), wk = 0.0021978 k( 443) = ( 0.5600000 -0.1847521 0.4082483), wk = 0.0021978 k( 444) = ( 0.5550000 -0.1934123 0.4082483), wk = 0.0021978 k( 445) = ( 0.5500000 -0.2020726 0.4082483), wk = 0.0021978 k( 446) = ( 0.5450000 -0.2107328 0.4082483), wk = 0.0021978 k( 447) = ( 0.5400000 -0.2193931 0.4082483), wk = 0.0021978 k( 448) = ( 0.5350000 -0.2280534 0.4082483), wk = 0.0021978 k( 449) = ( 0.5300000 -0.2367136 0.4082483), wk = 0.0021978 k( 450) = ( 0.5250000 -0.2453739 0.4082483), wk = 0.0021978 k( 451) = ( 0.5200000 -0.2540341 0.4082483), wk = 0.0021978 k( 452) = ( 0.5150000 -0.2626944 0.4082483), wk = 0.0021978 k( 453) = ( 0.5100000 -0.2713546 0.4082483), wk = 0.0021978 k( 454) = ( 0.5050000 -0.2800149 0.4082483), wk = 0.0021978 k( 455) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0021978 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021978 k( 2) = ( 0.0072464 -0.0000000 0.0072464), wk = 0.0021978 k( 3) = ( 0.0144928 0.0000000 0.0144928), wk = 0.0021978 k( 4) = ( 0.0217391 0.0000000 0.0217391), wk = 0.0021978 k( 5) = ( 0.0289855 0.0000000 0.0289855), wk = 0.0021978 k( 6) = ( 0.0362319 0.0000000 0.0362319), wk = 0.0021978 k( 7) = ( 0.0434783 0.0000000 0.0434783), wk = 0.0021978 k( 8) = ( 0.0507246 0.0000000 0.0507246), wk = 0.0021978 k( 9) = ( 0.0579710 0.0000000 0.0579710), wk = 0.0021978 k( 10) = ( 0.0652174 0.0000000 0.0652174), wk = 0.0021978 k( 11) = ( 0.0724638 -0.0000000 0.0724638), wk = 0.0021978 k( 12) = ( 0.0797101 0.0000000 0.0797101), wk = 0.0021978 k( 13) = ( 0.0869565 0.0000000 0.0869565), wk = 0.0021978 k( 14) = ( 0.0942029 0.0000000 0.0942029), wk = 0.0021978 k( 15) = ( 0.1014493 0.0000000 0.1014493), wk = 0.0021978 k( 16) = ( 0.1086957 -0.0000000 0.1086957), wk = 0.0021978 k( 17) = ( 0.1159420 0.0000000 0.1159420), wk = 0.0021978 k( 18) = ( 0.1231884 -0.0000000 0.1231884), wk = 0.0021978 k( 19) = ( 0.1304348 0.0000000 0.1304348), wk = 0.0021978 k( 20) = ( 0.1376812 0.0000000 0.1376812), wk = 0.0021978 k( 21) = ( 0.1449275 -0.0000000 0.1449275), wk = 0.0021978 k( 22) = ( 0.1521739 -0.0000000 0.1521739), wk = 0.0021978 k( 23) = ( 0.1594203 0.0000000 0.1594203), wk = 0.0021978 k( 24) = ( 0.1666667 0.0000000 0.1666667), wk = 0.0021978 k( 25) = ( 0.1739130 0.0000000 0.1739130), wk = 0.0021978 k( 26) = ( 0.1811594 0.0000000 0.1811594), wk = 0.0021978 k( 27) = ( 0.1884058 0.0000000 0.1884058), wk = 0.0021978 k( 28) = ( 0.1956522 0.0000000 0.1956522), wk = 0.0021978 k( 29) = ( 0.2028986 0.0000000 0.2028986), wk = 0.0021978 k( 30) = ( 0.2101449 0.0000000 0.2101449), wk = 0.0021978 k( 31) = ( 0.2173913 -0.0000000 0.2173913), wk = 0.0021978 k( 32) = ( 0.2246377 0.0000000 0.2246377), wk = 0.0021978 k( 33) = ( 0.2318841 0.0000000 0.2318841), wk = 0.0021978 k( 34) = ( 0.2391304 0.0000000 0.2391304), wk = 0.0021978 k( 35) = ( 0.2463768 0.0000000 0.2463768), wk = 0.0021978 k( 36) = ( 0.2536232 0.0000000 0.2536232), wk = 0.0021978 k( 37) = ( 0.2608696 0.0000000 0.2608696), wk = 0.0021978 k( 38) = ( 0.2681159 0.0000000 0.2681159), wk = 0.0021978 k( 39) = ( 0.2753623 0.0000000 0.2753623), wk = 0.0021978 k( 40) = ( 0.2826087 0.0000000 0.2826087), wk = 0.0021978 k( 41) = ( 0.2898551 0.0000000 0.2898551), wk = 0.0021978 k( 42) = ( 0.2971014 0.0000000 0.2971014), wk = 0.0021978 k( 43) = ( 0.3043478 0.0000000 0.3043478), wk = 0.0021978 k( 44) = ( 0.3115942 -0.0000000 0.3115942), wk = 0.0021978 k( 45) = ( 0.3188406 0.0000000 0.3188406), wk = 0.0021978 k( 46) = ( 0.3260870 0.0000000 0.3260870), wk = 0.0021978 k( 47) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0021978 k( 48) = ( 0.3405797 0.0000000 0.3405797), wk = 0.0021978 k( 49) = ( 0.3478261 0.0000000 0.3478261), wk = 0.0021978 k( 50) = ( 0.3550725 0.0000000 0.3550725), wk = 0.0021978 k( 51) = ( 0.3623188 0.0000000 0.3623188), wk = 0.0021978 k( 52) = ( 0.3695652 0.0000000 0.3695652), wk = 0.0021978 k( 53) = ( 0.3768116 0.0000000 0.3768116), wk = 0.0021978 k( 54) = ( 0.3840580 0.0000000 0.3840580), wk = 0.0021978 k( 55) = ( 0.3913044 0.0000000 0.3913044), wk = 0.0021978 k( 56) = ( 0.3985507 0.0000000 0.3985507), wk = 0.0021978 k( 57) = ( 0.4057971 0.0000000 0.4057971), wk = 0.0021978 k( 58) = ( 0.4130435 0.0000000 0.4130435), wk = 0.0021978 k( 59) = ( 0.4202899 0.0000000 0.4202899), wk = 0.0021978 k( 60) = ( 0.4275362 -0.0000000 0.4275362), wk = 0.0021978 k( 61) = ( 0.4347826 0.0000000 0.4347826), wk = 0.0021978 k( 62) = ( 0.4420290 0.0000000 0.4420290), wk = 0.0021978 k( 63) = ( 0.4492754 0.0000000 0.4492754), wk = 0.0021978 k( 64) = ( 0.4565217 0.0000000 0.4565217), wk = 0.0021978 k( 65) = ( 0.4637681 0.0000000 0.4637681), wk = 0.0021978 k( 66) = ( 0.4710145 0.0000000 0.4710145), wk = 0.0021978 k( 67) = ( 0.4782609 0.0000000 0.4782609), wk = 0.0021978 k( 68) = ( 0.4855073 0.0000000 0.4855073), wk = 0.0021978 k( 69) = ( 0.4927536 0.0000000 0.4927536), wk = 0.0021978 k( 70) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0021978 k( 71) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0021978 k( 72) = ( 0.5000000 0.0071429 0.5071429), wk = 0.0021978 k( 73) = ( 0.5000000 0.0142857 0.5142857), wk = 0.0021978 k( 74) = ( 0.5000000 0.0214286 0.5214286), wk = 0.0021978 k( 75) = ( 0.5000000 0.0285714 0.5285714), wk = 0.0021978 k( 76) = ( 0.5000000 0.0357143 0.5357143), wk = 0.0021978 k( 77) = ( 0.5000000 0.0428571 0.5428571), wk = 0.0021978 k( 78) = ( 0.5000000 0.0500000 0.5500000), wk = 0.0021978 k( 79) = ( 0.5000000 0.0571429 0.5571429), wk = 0.0021978 k( 80) = ( 0.5000000 0.0642857 0.5642857), wk = 0.0021978 k( 81) = ( 0.5000000 0.0714286 0.5714286), wk = 0.0021978 k( 82) = ( 0.5000000 0.0785714 0.5785714), wk = 0.0021978 k( 83) = ( 0.5000000 0.0857143 0.5857143), wk = 0.0021978 k( 84) = ( 0.5000000 0.0928571 0.5928571), wk = 0.0021978 k( 85) = ( 0.5000000 0.1000000 0.6000000), wk = 0.0021978 k( 86) = ( 0.5000000 0.1071429 0.6071429), wk = 0.0021978 k( 87) = ( 0.5000000 0.1142857 0.6142857), wk = 0.0021978 k( 88) = ( 0.5000000 0.1214286 0.6214286), wk = 0.0021978 k( 89) = ( 0.5000000 0.1285714 0.6285714), wk = 0.0021978 k( 90) = ( 0.5000000 0.1357143 0.6357143), wk = 0.0021978 k( 91) = ( 0.5000000 0.1428571 0.6428571), wk = 0.0021978 k( 92) = ( 0.5000000 0.1500000 0.6500000), wk = 0.0021978 k( 93) = ( 0.5000000 0.1571429 0.6571429), wk = 0.0021978 k( 94) = ( 0.5000000 0.1642857 0.6642857), wk = 0.0021978 k( 95) = ( 0.5000000 0.1714286 0.6714286), wk = 0.0021978 k( 96) = ( 0.5000000 0.1785714 0.6785714), wk = 0.0021978 k( 97) = ( 0.5000000 0.1857143 0.6857143), wk = 0.0021978 k( 98) = ( 0.5000000 0.1928571 0.6928571), wk = 0.0021978 k( 99) = ( 0.5000000 0.2000000 0.7000000), wk = 0.0021978 k( 100) = ( 0.5000000 0.2071429 0.7071429), wk = 0.0021978 k( 101) = ( 0.5000000 0.2142857 0.7142857), wk = 0.0021978 k( 102) = ( 0.5000000 0.2214286 0.7214286), wk = 0.0021978 k( 103) = ( 0.5000000 0.2285714 0.7285714), wk = 0.0021978 k( 104) = ( 0.5000000 0.2357143 0.7357143), wk = 0.0021978 k( 105) = ( 0.5000000 0.2428571 0.7428571), wk = 0.0021978 k( 106) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0021978 k( 107) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0021978 k( 108) = ( 0.4950000 0.2550000 0.7500000), wk = 0.0021978 k( 109) = ( 0.4900000 0.2600000 0.7500000), wk = 0.0021978 k( 110) = ( 0.4850000 0.2650000 0.7500000), wk = 0.0021978 k( 111) = ( 0.4800000 0.2700000 0.7500000), wk = 0.0021978 k( 112) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0021978 k( 113) = ( 0.4700000 0.2800000 0.7500000), wk = 0.0021978 k( 114) = ( 0.4650000 0.2850000 0.7500000), wk = 0.0021978 k( 115) = ( 0.4600000 0.2900000 0.7500000), wk = 0.0021978 k( 116) = ( 0.4550000 0.2950000 0.7500000), wk = 0.0021978 k( 117) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0021978 k( 118) = ( 0.4450000 0.3050000 0.7500000), wk = 0.0021978 k( 119) = ( 0.4400000 0.3100000 0.7500000), wk = 0.0021978 k( 120) = ( 0.4350000 0.3150000 0.7500000), wk = 0.0021978 k( 121) = ( 0.4300000 0.3200000 0.7500000), wk = 0.0021978 k( 122) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0021978 k( 123) = ( 0.4200000 0.3300000 0.7500000), wk = 0.0021978 k( 124) = ( 0.4150000 0.3350000 0.7500000), wk = 0.0021978 k( 125) = ( 0.4100000 0.3400000 0.7500000), wk = 0.0021978 k( 126) = ( 0.4050000 0.3450000 0.7500000), wk = 0.0021978 k( 127) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0021978 k( 128) = ( 0.3950000 0.3550000 0.7500000), wk = 0.0021978 k( 129) = ( 0.3900000 0.3600000 0.7500000), wk = 0.0021978 k( 130) = ( 0.3850000 0.3650000 0.7500000), wk = 0.0021978 k( 131) = ( 0.3800000 0.3700000 0.7500000), wk = 0.0021978 k( 132) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0021978 k( 133) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0021978 k( 134) = ( 0.3698630 0.3698630 0.7397260), wk = 0.0021978 k( 135) = ( 0.3647260 0.3647260 0.7294521), wk = 0.0021978 k( 136) = ( 0.3595890 0.3595890 0.7191781), wk = 0.0021978 k( 137) = ( 0.3544521 0.3544521 0.7089041), wk = 0.0021978 k( 138) = ( 0.3493151 0.3493151 0.6986301), wk = 0.0021978 k( 139) = ( 0.3441781 0.3441781 0.6883562), wk = 0.0021978 k( 140) = ( 0.3390411 0.3390411 0.6780822), wk = 0.0021978 k( 141) = ( 0.3339041 0.3339041 0.6678082), wk = 0.0021978 k( 142) = ( 0.3287671 0.3287671 0.6575343), wk = 0.0021978 k( 143) = ( 0.3236301 0.3236301 0.6472603), wk = 0.0021978 k( 144) = ( 0.3184932 0.3184932 0.6369863), wk = 0.0021978 k( 145) = ( 0.3133562 0.3133562 0.6267123), wk = 0.0021978 k( 146) = ( 0.3082192 0.3082192 0.6164384), wk = 0.0021978 k( 147) = ( 0.3030822 0.3030822 0.6061644), wk = 0.0021978 k( 148) = ( 0.2979452 0.2979452 0.5958904), wk = 0.0021978 k( 149) = ( 0.2928082 0.2928082 0.5856164), wk = 0.0021978 k( 150) = ( 0.2876712 0.2876712 0.5753425), wk = 0.0021978 k( 151) = ( 0.2825342 0.2825342 0.5650685), wk = 0.0021978 k( 152) = ( 0.2773973 0.2773973 0.5547945), wk = 0.0021978 k( 153) = ( 0.2722603 0.2722603 0.5445206), wk = 0.0021978 k( 154) = ( 0.2671233 0.2671233 0.5342466), wk = 0.0021978 k( 155) = ( 0.2619863 0.2619863 0.5239726), wk = 0.0021978 k( 156) = ( 0.2568493 0.2568493 0.5136986), wk = 0.0021978 k( 157) = ( 0.2517123 0.2517123 0.5034247), wk = 0.0021978 k( 158) = ( 0.2465753 0.2465753 0.4931507), wk = 0.0021978 k( 159) = ( 0.2414384 0.2414384 0.4828767), wk = 0.0021978 k( 160) = ( 0.2363014 0.2363014 0.4726027), wk = 0.0021978 k( 161) = ( 0.2311644 0.2311644 0.4623288), wk = 0.0021978 k( 162) = ( 0.2260274 0.2260274 0.4520548), wk = 0.0021978 k( 163) = ( 0.2208904 0.2208904 0.4417808), wk = 0.0021978 k( 164) = ( 0.2157534 0.2157534 0.4315068), wk = 0.0021978 k( 165) = ( 0.2106164 0.2106164 0.4212329), wk = 0.0021978 k( 166) = ( 0.2054795 0.2054795 0.4109589), wk = 0.0021978 k( 167) = ( 0.2003425 0.2003425 0.4006849), wk = 0.0021978 k( 168) = ( 0.1952055 0.1952055 0.3904110), wk = 0.0021978 k( 169) = ( 0.1900685 0.1900685 0.3801370), wk = 0.0021978 k( 170) = ( 0.1849315 0.1849315 0.3698630), wk = 0.0021978 k( 171) = ( 0.1797945 0.1797945 0.3595890), wk = 0.0021978 k( 172) = ( 0.1746575 0.1746575 0.3493151), wk = 0.0021978 k( 173) = ( 0.1695205 0.1695205 0.3390411), wk = 0.0021978 k( 174) = ( 0.1643836 0.1643836 0.3287671), wk = 0.0021978 k( 175) = ( 0.1592466 0.1592466 0.3184932), wk = 0.0021978 k( 176) = ( 0.1541096 0.1541096 0.3082192), wk = 0.0021978 k( 177) = ( 0.1489726 0.1489726 0.2979452), wk = 0.0021978 k( 178) = ( 0.1438356 0.1438356 0.2876712), wk = 0.0021978 k( 179) = ( 0.1386986 0.1386986 0.2773973), wk = 0.0021978 k( 180) = ( 0.1335616 0.1335616 0.2671233), wk = 0.0021978 k( 181) = ( 0.1284247 0.1284247 0.2568493), wk = 0.0021978 k( 182) = ( 0.1232877 0.1232877 0.2465753), wk = 0.0021978 k( 183) = ( 0.1181507 0.1181507 0.2363014), wk = 0.0021978 k( 184) = ( 0.1130137 0.1130137 0.2260274), wk = 0.0021978 k( 185) = ( 0.1078767 0.1078767 0.2157534), wk = 0.0021978 k( 186) = ( 0.1027397 0.1027397 0.2054795), wk = 0.0021978 k( 187) = ( 0.0976027 0.0976027 0.1952055), wk = 0.0021978 k( 188) = ( 0.0924657 0.0924658 0.1849315), wk = 0.0021978 k( 189) = ( 0.0873288 0.0873288 0.1746575), wk = 0.0021978 k( 190) = ( 0.0821918 0.0821918 0.1643836), wk = 0.0021978 k( 191) = ( 0.0770548 0.0770548 0.1541096), wk = 0.0021978 k( 192) = ( 0.0719178 0.0719178 0.1438356), wk = 0.0021978 k( 193) = ( 0.0667808 0.0667808 0.1335616), wk = 0.0021978 k( 194) = ( 0.0616438 0.0616438 0.1232877), wk = 0.0021978 k( 195) = ( 0.0565068 0.0565068 0.1130137), wk = 0.0021978 k( 196) = ( 0.0513699 0.0513699 0.1027397), wk = 0.0021978 k( 197) = ( 0.0462329 0.0462329 0.0924657), wk = 0.0021978 k( 198) = ( 0.0410959 0.0410959 0.0821918), wk = 0.0021978 k( 199) = ( 0.0359589 0.0359589 0.0719178), wk = 0.0021978 k( 200) = ( 0.0308219 0.0308219 0.0616438), wk = 0.0021978 k( 201) = ( 0.0256849 0.0256849 0.0513699), wk = 0.0021978 k( 202) = ( 0.0205479 0.0205480 0.0410959), wk = 0.0021978 k( 203) = ( 0.0154110 0.0154110 0.0308219), wk = 0.0021978 k( 204) = ( 0.0102740 0.0102740 0.0205480), wk = 0.0021978 k( 205) = ( 0.0051370 0.0051370 0.0102740), wk = 0.0021978 k( 206) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021978 k( 207) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021978 k( 208) = ( 0.0083333 0.0083333 0.0083333), wk = 0.0021978 k( 209) = ( 0.0166667 0.0166667 0.0166667), wk = 0.0021978 k( 210) = ( 0.0250000 0.0250000 0.0250000), wk = 0.0021978 k( 211) = ( 0.0333333 0.0333333 0.0333333), wk = 0.0021978 k( 212) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0021978 k( 213) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0021978 k( 214) = ( 0.0583333 0.0583333 0.0583333), wk = 0.0021978 k( 215) = ( 0.0666667 0.0666667 0.0666667), wk = 0.0021978 k( 216) = ( 0.0750000 0.0750000 0.0750000), wk = 0.0021978 k( 217) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0021978 k( 218) = ( 0.0916667 0.0916667 0.0916667), wk = 0.0021978 k( 219) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0021978 k( 220) = ( 0.1083333 0.1083333 0.1083333), wk = 0.0021978 k( 221) = ( 0.1166667 0.1166667 0.1166667), wk = 0.0021978 k( 222) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0021978 k( 223) = ( 0.1333333 0.1333333 0.1333333), wk = 0.0021978 k( 224) = ( 0.1416667 0.1416667 0.1416667), wk = 0.0021978 k( 225) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0021978 k( 226) = ( 0.1583333 0.1583333 0.1583333), wk = 0.0021978 k( 227) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0021978 k( 228) = ( 0.1750000 0.1750000 0.1750000), wk = 0.0021978 k( 229) = ( 0.1833333 0.1833333 0.1833333), wk = 0.0021978 k( 230) = ( 0.1916667 0.1916667 0.1916667), wk = 0.0021978 k( 231) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0021978 k( 232) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0021978 k( 233) = ( 0.2166667 0.2166667 0.2166667), wk = 0.0021978 k( 234) = ( 0.2250000 0.2250000 0.2250000), wk = 0.0021978 k( 235) = ( 0.2333333 0.2333333 0.2333333), wk = 0.0021978 k( 236) = ( 0.2416667 0.2416667 0.2416667), wk = 0.0021978 k( 237) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0021978 k( 238) = ( 0.2583333 0.2583333 0.2583333), wk = 0.0021978 k( 239) = ( 0.2666667 0.2666667 0.2666667), wk = 0.0021978 k( 240) = ( 0.2750000 0.2750000 0.2750000), wk = 0.0021978 k( 241) = ( 0.2833333 0.2833333 0.2833333), wk = 0.0021978 k( 242) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0021978 k( 243) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0021978 k( 244) = ( 0.3083333 0.3083333 0.3083333), wk = 0.0021978 k( 245) = ( 0.3166667 0.3166667 0.3166667), wk = 0.0021978 k( 246) = ( 0.3250000 0.3250000 0.3250000), wk = 0.0021978 k( 247) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0021978 k( 248) = ( 0.3416667 0.3416667 0.3416667), wk = 0.0021978 k( 249) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0021978 k( 250) = ( 0.3583333 0.3583333 0.3583333), wk = 0.0021978 k( 251) = ( 0.3666667 0.3666667 0.3666667), wk = 0.0021978 k( 252) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0021978 k( 253) = ( 0.3833333 0.3833333 0.3833333), wk = 0.0021978 k( 254) = ( 0.3916667 0.3916667 0.3916667), wk = 0.0021978 k( 255) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0021978 k( 256) = ( 0.4083333 0.4083333 0.4083333), wk = 0.0021978 k( 257) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0021978 k( 258) = ( 0.4250000 0.4250000 0.4250000), wk = 0.0021978 k( 259) = ( 0.4333333 0.4333333 0.4333333), wk = 0.0021978 k( 260) = ( 0.4416667 0.4416667 0.4416667), wk = 0.0021978 k( 261) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0021978 k( 262) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0021978 k( 263) = ( 0.4666667 0.4666667 0.4666667), wk = 0.0021978 k( 264) = ( 0.4750000 0.4750000 0.4750000), wk = 0.0021978 k( 265) = ( 0.4833333 0.4833333 0.4833333), wk = 0.0021978 k( 266) = ( 0.4916667 0.4916667 0.4916667), wk = 0.0021978 k( 267) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0021978 k( 268) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0021978 k( 269) = ( 0.5029762 0.4940476 0.5029762), wk = 0.0021978 k( 270) = ( 0.5059524 0.4880952 0.5059524), wk = 0.0021978 k( 271) = ( 0.5089286 0.4821429 0.5089286), wk = 0.0021978 k( 272) = ( 0.5119048 0.4761905 0.5119048), wk = 0.0021978 k( 273) = ( 0.5148810 0.4702381 0.5148810), wk = 0.0021978 k( 274) = ( 0.5178571 0.4642857 0.5178571), wk = 0.0021978 k( 275) = ( 0.5208333 0.4583333 0.5208333), wk = 0.0021978 k( 276) = ( 0.5238095 0.4523810 0.5238095), wk = 0.0021978 k( 277) = ( 0.5267857 0.4464286 0.5267857), wk = 0.0021978 k( 278) = ( 0.5297619 0.4404762 0.5297619), wk = 0.0021978 k( 279) = ( 0.5327381 0.4345238 0.5327381), wk = 0.0021978 k( 280) = ( 0.5357143 0.4285714 0.5357143), wk = 0.0021978 k( 281) = ( 0.5386905 0.4226190 0.5386905), wk = 0.0021978 k( 282) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0021978 k( 283) = ( 0.5446429 0.4107143 0.5446429), wk = 0.0021978 k( 284) = ( 0.5476190 0.4047619 0.5476190), wk = 0.0021978 k( 285) = ( 0.5505952 0.3988095 0.5505952), wk = 0.0021978 k( 286) = ( 0.5535714 0.3928571 0.5535714), wk = 0.0021978 k( 287) = ( 0.5565476 0.3869048 0.5565476), wk = 0.0021978 k( 288) = ( 0.5595238 0.3809524 0.5595238), wk = 0.0021978 k( 289) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0021978 k( 290) = ( 0.5654762 0.3690476 0.5654762), wk = 0.0021978 k( 291) = ( 0.5684524 0.3630952 0.5684524), wk = 0.0021978 k( 292) = ( 0.5714286 0.3571429 0.5714286), wk = 0.0021978 k( 293) = ( 0.5744048 0.3511905 0.5744048), wk = 0.0021978 k( 294) = ( 0.5773810 0.3452381 0.5773810), wk = 0.0021978 k( 295) = ( 0.5803571 0.3392857 0.5803571), wk = 0.0021978 k( 296) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0021978 k( 297) = ( 0.5863095 0.3273810 0.5863095), wk = 0.0021978 k( 298) = ( 0.5892857 0.3214286 0.5892857), wk = 0.0021978 k( 299) = ( 0.5922619 0.3154762 0.5922619), wk = 0.0021978 k( 300) = ( 0.5952381 0.3095238 0.5952381), wk = 0.0021978 k( 301) = ( 0.5982143 0.3035714 0.5982143), wk = 0.0021978 k( 302) = ( 0.6011905 0.2976190 0.6011905), wk = 0.0021978 k( 303) = ( 0.6041667 0.2916667 0.6041667), wk = 0.0021978 k( 304) = ( 0.6071429 0.2857143 0.6071429), wk = 0.0021978 k( 305) = ( 0.6101190 0.2797619 0.6101190), wk = 0.0021978 k( 306) = ( 0.6130952 0.2738095 0.6130952), wk = 0.0021978 k( 307) = ( 0.6160714 0.2678571 0.6160714), wk = 0.0021978 k( 308) = ( 0.6190476 0.2619048 0.6190476), wk = 0.0021978 k( 309) = ( 0.6220238 0.2559524 0.6220238), wk = 0.0021978 k( 310) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0021978 k( 311) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0021978 k( 312) = ( 0.6200000 0.2500000 0.6300000), wk = 0.0021978 k( 313) = ( 0.6150000 0.2500000 0.6350000), wk = 0.0021978 k( 314) = ( 0.6100000 0.2500000 0.6400000), wk = 0.0021978 k( 315) = ( 0.6050000 0.2500000 0.6450000), wk = 0.0021978 k( 316) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0021978 k( 317) = ( 0.5950000 0.2500000 0.6550000), wk = 0.0021978 k( 318) = ( 0.5900000 0.2500000 0.6600000), wk = 0.0021978 k( 319) = ( 0.5850000 0.2500000 0.6650000), wk = 0.0021978 k( 320) = ( 0.5800000 0.2500000 0.6700000), wk = 0.0021978 k( 321) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0021978 k( 322) = ( 0.5700000 0.2500000 0.6800000), wk = 0.0021978 k( 323) = ( 0.5650000 0.2500000 0.6850000), wk = 0.0021978 k( 324) = ( 0.5600000 0.2500000 0.6900000), wk = 0.0021978 k( 325) = ( 0.5550000 0.2500000 0.6950000), wk = 0.0021978 k( 326) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0021978 k( 327) = ( 0.5450000 0.2500000 0.7050000), wk = 0.0021978 k( 328) = ( 0.5400000 0.2500000 0.7100000), wk = 0.0021978 k( 329) = ( 0.5350000 0.2500000 0.7150000), wk = 0.0021978 k( 330) = ( 0.5300000 0.2500000 0.7200000), wk = 0.0021978 k( 331) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0021978 k( 332) = ( 0.5200000 0.2500000 0.7300000), wk = 0.0021978 k( 333) = ( 0.5150000 0.2500000 0.7350000), wk = 0.0021978 k( 334) = ( 0.5100000 0.2500000 0.7400000), wk = 0.0021978 k( 335) = ( 0.5050000 0.2500000 0.7450000), wk = 0.0021978 k( 336) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0021978 k( 337) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0021978 k( 338) = ( 0.5000000 0.2551020 0.7448980), wk = 0.0021978 k( 339) = ( 0.5000000 0.2602041 0.7397959), wk = 0.0021978 k( 340) = ( 0.5000000 0.2653061 0.7346939), wk = 0.0021978 k( 341) = ( 0.5000000 0.2704082 0.7295918), wk = 0.0021978 k( 342) = ( 0.5000000 0.2755102 0.7244898), wk = 0.0021978 k( 343) = ( 0.5000000 0.2806122 0.7193878), wk = 0.0021978 k( 344) = ( 0.5000000 0.2857143 0.7142857), wk = 0.0021978 k( 345) = ( 0.5000000 0.2908163 0.7091837), wk = 0.0021978 k( 346) = ( 0.5000000 0.2959184 0.7040816), wk = 0.0021978 k( 347) = ( 0.5000000 0.3010204 0.6989796), wk = 0.0021978 k( 348) = ( 0.5000000 0.3061224 0.6938776), wk = 0.0021978 k( 349) = ( 0.5000000 0.3112245 0.6887755), wk = 0.0021978 k( 350) = ( 0.5000000 0.3163265 0.6836735), wk = 0.0021978 k( 351) = ( 0.5000000 0.3214286 0.6785714), wk = 0.0021978 k( 352) = ( 0.5000000 0.3265306 0.6734694), wk = 0.0021978 k( 353) = ( 0.5000000 0.3316327 0.6683674), wk = 0.0021978 k( 354) = ( 0.5000000 0.3367347 0.6632653), wk = 0.0021978 k( 355) = ( 0.5000000 0.3418367 0.6581633), wk = 0.0021978 k( 356) = ( 0.5000000 0.3469388 0.6530612), wk = 0.0021978 k( 357) = ( 0.5000000 0.3520408 0.6479592), wk = 0.0021978 k( 358) = ( 0.5000000 0.3571429 0.6428571), wk = 0.0021978 k( 359) = ( 0.5000000 0.3622449 0.6377551), wk = 0.0021978 k( 360) = ( 0.5000000 0.3673469 0.6326531), wk = 0.0021978 k( 361) = ( 0.5000000 0.3724490 0.6275510), wk = 0.0021978 k( 362) = ( 0.5000000 0.3775510 0.6224490), wk = 0.0021978 k( 363) = ( 0.5000000 0.3826531 0.6173469), wk = 0.0021978 k( 364) = ( 0.5000000 0.3877551 0.6122449), wk = 0.0021978 k( 365) = ( 0.5000000 0.3928571 0.6071429), wk = 0.0021978 k( 366) = ( 0.5000000 0.3979592 0.6020408), wk = 0.0021978 k( 367) = ( 0.5000000 0.4030612 0.5969388), wk = 0.0021978 k( 368) = ( 0.5000000 0.4081633 0.5918367), wk = 0.0021978 k( 369) = ( 0.5000000 0.4132653 0.5867347), wk = 0.0021978 k( 370) = ( 0.5000000 0.4183674 0.5816326), wk = 0.0021978 k( 371) = ( 0.5000000 0.4234694 0.5765306), wk = 0.0021978 k( 372) = ( 0.5000000 0.4285714 0.5714286), wk = 0.0021978 k( 373) = ( 0.5000000 0.4336735 0.5663265), wk = 0.0021978 k( 374) = ( 0.5000000 0.4387755 0.5612245), wk = 0.0021978 k( 375) = ( 0.5000000 0.4438776 0.5561225), wk = 0.0021978 k( 376) = ( 0.5000000 0.4489796 0.5510204), wk = 0.0021978 k( 377) = ( 0.5000000 0.4540816 0.5459184), wk = 0.0021978 k( 378) = ( 0.5000000 0.4591837 0.5408163), wk = 0.0021978 k( 379) = ( 0.5000000 0.4642857 0.5357143), wk = 0.0021978 k( 380) = ( 0.5000000 0.4693878 0.5306122), wk = 0.0021978 k( 381) = ( 0.5000000 0.4744898 0.5255102), wk = 0.0021978 k( 382) = ( 0.5000000 0.4795918 0.5204082), wk = 0.0021978 k( 383) = ( 0.5000000 0.4846939 0.5153061), wk = 0.0021978 k( 384) = ( 0.5000000 0.4897959 0.5102041), wk = 0.0021978 k( 385) = ( 0.5000000 0.4948980 0.5051020), wk = 0.0021978 k( 386) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0021978 k( 387) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0021978 k( 388) = ( 0.4970238 0.4970238 0.5059524), wk = 0.0021978 k( 389) = ( 0.4940476 0.4940476 0.5119048), wk = 0.0021978 k( 390) = ( 0.4910714 0.4910714 0.5178571), wk = 0.0021978 k( 391) = ( 0.4880952 0.4880952 0.5238095), wk = 0.0021978 k( 392) = ( 0.4851190 0.4851190 0.5297619), wk = 0.0021978 k( 393) = ( 0.4821429 0.4821429 0.5357143), wk = 0.0021978 k( 394) = ( 0.4791667 0.4791667 0.5416667), wk = 0.0021978 k( 395) = ( 0.4761905 0.4761905 0.5476191), wk = 0.0021978 k( 396) = ( 0.4732143 0.4732143 0.5535714), wk = 0.0021978 k( 397) = ( 0.4702381 0.4702381 0.5595238), wk = 0.0021978 k( 398) = ( 0.4672619 0.4672619 0.5654762), wk = 0.0021978 k( 399) = ( 0.4642857 0.4642857 0.5714286), wk = 0.0021978 k( 400) = ( 0.4613095 0.4613095 0.5773810), wk = 0.0021978 k( 401) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0021978 k( 402) = ( 0.4553571 0.4553571 0.5892857), wk = 0.0021978 k( 403) = ( 0.4523810 0.4523810 0.5952381), wk = 0.0021978 k( 404) = ( 0.4494048 0.4494048 0.6011905), wk = 0.0021978 k( 405) = ( 0.4464286 0.4464286 0.6071429), wk = 0.0021978 k( 406) = ( 0.4434524 0.4434524 0.6130952), wk = 0.0021978 k( 407) = ( 0.4404762 0.4404762 0.6190476), wk = 0.0021978 k( 408) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0021978 k( 409) = ( 0.4345238 0.4345238 0.6309524), wk = 0.0021978 k( 410) = ( 0.4315476 0.4315476 0.6369048), wk = 0.0021978 k( 411) = ( 0.4285714 0.4285714 0.6428571), wk = 0.0021978 k( 412) = ( 0.4255952 0.4255952 0.6488095), wk = 0.0021978 k( 413) = ( 0.4226190 0.4226190 0.6547619), wk = 0.0021978 k( 414) = ( 0.4196429 0.4196429 0.6607143), wk = 0.0021978 k( 415) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0021978 k( 416) = ( 0.4136905 0.4136905 0.6726190), wk = 0.0021978 k( 417) = ( 0.4107143 0.4107143 0.6785714), wk = 0.0021978 k( 418) = ( 0.4077381 0.4077381 0.6845238), wk = 0.0021978 k( 419) = ( 0.4047619 0.4047619 0.6904762), wk = 0.0021978 k( 420) = ( 0.4017857 0.4017857 0.6964286), wk = 0.0021978 k( 421) = ( 0.3988095 0.3988095 0.7023810), wk = 0.0021978 k( 422) = ( 0.3958333 0.3958333 0.7083333), wk = 0.0021978 k( 423) = ( 0.3928571 0.3928571 0.7142857), wk = 0.0021978 k( 424) = ( 0.3898810 0.3898810 0.7202381), wk = 0.0021978 k( 425) = ( 0.3869048 0.3869048 0.7261905), wk = 0.0021978 k( 426) = ( 0.3839286 0.3839286 0.7321429), wk = 0.0021978 k( 427) = ( 0.3809524 0.3809524 0.7380952), wk = 0.0021978 k( 428) = ( 0.3779762 0.3779762 0.7440476), wk = 0.0021978 k( 429) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0021978 k( 430) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0021978 k( 431) = ( 0.6200000 0.2400000 0.6200000), wk = 0.0021978 k( 432) = ( 0.6150000 0.2300000 0.6150000), wk = 0.0021978 k( 433) = ( 0.6100000 0.2200000 0.6100000), wk = 0.0021978 k( 434) = ( 0.6050000 0.2100000 0.6050000), wk = 0.0021978 k( 435) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0021978 k( 436) = ( 0.5950000 0.1900000 0.5950000), wk = 0.0021978 k( 437) = ( 0.5900000 0.1800000 0.5900000), wk = 0.0021978 k( 438) = ( 0.5850000 0.1700000 0.5850000), wk = 0.0021978 k( 439) = ( 0.5800000 0.1600000 0.5800000), wk = 0.0021978 k( 440) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0021978 k( 441) = ( 0.5700000 0.1400000 0.5700000), wk = 0.0021978 k( 442) = ( 0.5650000 0.1300000 0.5650000), wk = 0.0021978 k( 443) = ( 0.5600000 0.1200000 0.5600000), wk = 0.0021978 k( 444) = ( 0.5550000 0.1100000 0.5550000), wk = 0.0021978 k( 445) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0021978 k( 446) = ( 0.5450000 0.0900000 0.5450000), wk = 0.0021978 k( 447) = ( 0.5400000 0.0800000 0.5400000), wk = 0.0021978 k( 448) = ( 0.5350000 0.0700000 0.5350000), wk = 0.0021978 k( 449) = ( 0.5300000 0.0600000 0.5300000), wk = 0.0021978 k( 450) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0021978 k( 451) = ( 0.5200000 0.0400000 0.5200000), wk = 0.0021978 k( 452) = ( 0.5150000 0.0300000 0.5150000), wk = 0.0021978 k( 453) = ( 0.5100000 0.0200000 0.5100000), wk = 0.0021978 k( 454) = ( 0.5050000 0.0100000 0.5050000), wk = 0.0021978 k( 455) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0021978 Dense grid: 19603 G-vectors FFT dimensions: ( 40, 40, 40) Smooth grid: 8609 G-vectors FFT dimensions: ( 30, 30, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.02 Mb ( 54, 28) NL pseudopotentials 0.02 Mb ( 27, 48) Each V/rho on FFT grid 0.02 Mb ( 1600) Each G-vector array 0.00 Mb ( 410) G-vector shells 0.00 Mb ( 172) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.09 Mb ( 54, 112) Each subspace H/S matrix 0.19 Mb ( 112, 112) Each matrix 0.04 Mb ( 48, 2, 28) Check: negative/imaginary core charge= -0.000009 0.000000 The potential is recalculated from file : ./RuC.save/charge-density.dat Starting wfc are 28 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 40.5 secs Computing kpt #: 2 total cpu time spent up to now is 40.8 secs Computing kpt #: 3 total cpu time spent up to now is 41.0 secs Computing kpt #: 4 total cpu time spent up to now is 41.2 secs Computing kpt #: 5 total cpu time spent up to now is 41.4 secs Computing kpt #: 6 total cpu time spent up to now is 41.6 secs Computing kpt #: 7 total cpu time spent up to now is 41.9 secs Computing kpt #: 8 total cpu time spent up to now is 42.1 secs Computing kpt #: 9 total cpu time spent up to now is 42.3 secs Computing kpt #: 10 total cpu time spent up to now is 42.5 secs Computing kpt #: 11 total cpu time spent up to now is 42.7 secs Computing kpt #: 12 total cpu time spent up to now is 42.9 secs Computing kpt #: 13 total cpu time spent up to now is 43.1 secs Computing kpt #: 14 total cpu time spent up to now is 43.3 secs Computing kpt #: 15 total cpu time spent up to now is 43.5 secs Computing kpt #: 16 total cpu time spent up to now is 43.7 secs Computing kpt #: 17 total cpu time spent up to now is 43.9 secs Computing kpt #: 18 total cpu time spent up to now is 44.1 secs Computing kpt #: 19 total cpu time spent up to now is 44.3 secs Computing kpt #: 20 total cpu time spent up to now is 44.5 secs Computing kpt #: 21 total cpu time spent up to now is 44.7 secs Computing kpt #: 22 total cpu time spent up to now is 45.0 secs Computing kpt #: 23 total cpu time spent up to now is 45.2 secs Computing kpt #: 24 total cpu time spent up to now is 45.4 secs Computing kpt #: 25 total cpu time spent up to now is 45.6 secs Computing kpt #: 26 total cpu time spent up to now is 46.0 secs Computing kpt #: 27 total cpu time spent up to now is 46.2 secs Computing kpt #: 28 total cpu time spent up to now is 46.4 secs Computing kpt #: 29 total cpu time spent up to now is 46.6 secs Computing kpt #: 30 total cpu time spent up to now is 46.8 secs Computing kpt #: 31 total cpu time spent up to now is 47.1 secs Computing kpt #: 32 total cpu time spent up to now is 47.3 secs Computing kpt #: 33 total cpu time spent up to now is 47.5 secs Computing kpt #: 34 total cpu time spent up to now is 47.7 secs Computing kpt #: 35 total cpu time spent up to now is 47.9 secs Computing kpt #: 36 total cpu time spent up to now is 48.2 secs Computing kpt #: 37 total cpu time spent up to now is 48.4 secs Computing kpt #: 38 total cpu time spent up to now is 48.6 secs Computing kpt #: 39 total cpu time spent up to now is 48.8 secs Computing kpt #: 40 total cpu time spent up to now is 49.1 secs Computing kpt #: 41 total cpu time spent up to now is 49.3 secs Computing kpt #: 42 total cpu time spent up to now is 49.5 secs Computing kpt #: 43 total cpu time spent up to now is 49.8 secs Computing kpt #: 44 total cpu time spent up to now is 50.0 secs Computing kpt #: 45 total cpu time spent up to now is 50.2 secs Computing kpt #: 46 total cpu time spent up to now is 50.5 secs Computing kpt #: 47 total cpu time spent up to now is 50.7 secs Computing kpt #: 48 total cpu time spent up to now is 50.9 secs Computing kpt #: 49 total cpu time spent up to now is 51.2 secs Computing kpt #: 50 total cpu time spent up to now is 51.4 secs Computing kpt #: 51 total cpu time spent up to now is 51.7 secs Computing kpt #: 52 total cpu time spent up to now is 52.0 secs Computing kpt #: 53 total cpu time spent up to now is 52.3 secs Computing kpt #: 54 total cpu time spent up to now is 52.6 secs Computing kpt #: 55 total cpu time spent up to now is 52.9 secs Computing kpt #: 56 total cpu time spent up to now is 53.1 secs Computing kpt #: 57 total cpu time spent up to now is 53.4 secs Computing kpt #: 58 total cpu time spent up to now is 53.7 secs Computing kpt #: 59 total cpu time spent up to now is 53.9 secs Computing kpt #: 60 total cpu time spent up to now is 54.2 secs Computing kpt #: 61 total cpu time spent up to now is 54.5 secs Computing kpt #: 62 total cpu time spent up to now is 54.8 secs Computing kpt #: 63 total cpu time spent up to now is 55.1 secs Computing kpt #: 64 total cpu time spent up to now is 55.4 secs Computing kpt #: 65 total cpu time spent up to now is 55.8 secs Computing kpt #: 66 total cpu time spent up to now is 56.1 secs Computing kpt #: 67 total cpu time spent up to now is 56.4 secs Computing kpt #: 68 total cpu time spent up to now is 56.6 secs Computing kpt #: 69 total cpu time spent up to now is 56.9 secs Computing kpt #: 70 total cpu time spent up to now is 57.1 secs Computing kpt #: 71 total cpu time spent up to now is 57.3 secs Computing kpt #: 72 total cpu time spent up to now is 57.6 secs Computing kpt #: 73 total cpu time spent up to now is 57.8 secs Computing kpt #: 74 total cpu time spent up to now is 58.1 secs Computing kpt #: 75 total cpu time spent up to now is 58.3 secs Computing kpt #: 76 total cpu time spent up to now is 58.7 secs Computing kpt #: 77 total cpu time spent up to now is 59.1 secs Computing kpt #: 78 total cpu time spent up to now is 59.4 secs Computing kpt #: 79 total cpu time spent up to now is 59.6 secs Computing kpt #: 80 total cpu time spent up to now is 59.9 secs Computing kpt #: 81 total cpu time spent up to now is 60.2 secs Computing kpt #: 82 total cpu time spent up to now is 60.6 secs Computing kpt #: 83 total cpu time spent up to now is 60.9 secs Computing kpt #: 84 total cpu time spent up to now is 61.2 secs Computing kpt #: 85 total cpu time spent up to now is 61.6 secs Computing kpt #: 86 total cpu time spent up to now is 61.9 secs Computing kpt #: 87 total cpu time spent up to now is 62.4 secs Computing kpt #: 88 total cpu time spent up to now is 62.9 secs Computing kpt #: 89 total cpu time spent up to now is 63.2 secs Computing kpt #: 90 total cpu time spent up to now is 63.6 secs Computing kpt #: 91 total cpu time spent up to now is 63.8 secs Computing kpt #: 92 total cpu time spent up to now is 64.1 secs Computing kpt #: 93 total cpu time spent up to now is 64.4 secs Computing kpt #: 94 total cpu time spent up to now is 64.6 secs Computing kpt #: 95 total cpu time spent up to now is 64.9 secs Computing kpt #: 96 total cpu time spent up to now is 65.1 secs Computing kpt #: 97 total cpu time spent up to now is 65.4 secs Computing kpt #: 98 total cpu time spent up to now is 65.6 secs Computing kpt #: 99 total cpu time spent up to now is 66.0 secs Computing kpt #: 100 total cpu time spent up to now is 66.6 secs Computing kpt #: 101 total cpu time spent up to now is 67.2 secs Computing kpt #: 102 total cpu time spent up to now is 67.6 secs Computing kpt #: 103 total cpu time spent up to now is 68.3 secs Computing kpt #: 104 total cpu time spent up to now is 68.7 secs Computing kpt #: 105 total cpu time spent up to now is 69.2 secs Computing kpt #: 106 total cpu time spent up to now is 69.7 secs Computing kpt #: 107 total cpu time spent up to now is 70.4 secs Computing kpt #: 108 total cpu time spent up to now is 70.8 secs Computing kpt #: 109 total cpu time spent up to now is 71.2 secs Computing kpt #: 110 total cpu time spent up to now is 71.8 secs Computing kpt #: 111 total cpu time spent up to now is 72.2 secs Computing kpt #: 112 total cpu time spent up to now is 72.5 secs Computing kpt #: 113 total cpu time spent up to now is 72.8 secs Computing kpt #: 114 total cpu time spent up to now is 73.1 secs Computing kpt #: 115 total cpu time spent up to now is 73.3 secs Computing kpt #: 116 total cpu time spent up to now is 73.6 secs Computing kpt #: 117 total cpu time spent up to now is 73.8 secs Computing kpt #: 118 total cpu time spent up to now is 74.2 secs Computing kpt #: 119 total cpu time spent up to now is 74.5 secs Computing kpt #: 120 total cpu time spent up to now is 74.8 secs Computing kpt #: 121 total cpu time spent up to now is 75.1 secs Computing kpt #: 122 total cpu time spent up to now is 75.4 secs Computing kpt #: 123 total cpu time spent up to now is 75.6 secs Computing kpt #: 124 total cpu time spent up to now is 75.9 secs Computing kpt #: 125 total cpu time spent up to now is 76.2 secs Computing kpt #: 126 total cpu time spent up to now is 76.6 secs Computing kpt #: 127 total cpu time spent up to now is 76.9 secs Computing kpt #: 128 total cpu time spent up to now is 77.2 secs Computing kpt #: 129 total cpu time spent up to now is 77.5 secs Computing kpt #: 130 total cpu time spent up to now is 77.8 secs Computing kpt #: 131 total cpu time spent up to now is 78.1 secs Computing kpt #: 132 total cpu time spent up to now is 78.3 secs Computing kpt #: 133 total cpu time spent up to now is 78.6 secs Computing kpt #: 134 total cpu time spent up to now is 78.8 secs Computing kpt #: 135 total cpu time spent up to now is 79.1 secs Computing kpt #: 136 total cpu time spent up to now is 79.4 secs Computing kpt #: 137 total cpu time spent up to now is 79.6 secs Computing kpt #: 138 total cpu time spent up to now is 79.9 secs Computing kpt #: 139 total cpu time spent up to now is 80.3 secs Computing kpt #: 140 total cpu time spent up to now is 80.6 secs Computing kpt #: 141 total cpu time spent up to now is 81.0 secs Computing kpt #: 142 total cpu time spent up to now is 81.4 secs Computing kpt #: 143 total cpu time spent up to now is 81.7 secs Computing kpt #: 144 total cpu time spent up to now is 82.1 secs Computing kpt #: 145 total cpu time spent up to now is 82.5 secs Computing kpt #: 146 total cpu time spent up to now is 82.7 secs Computing kpt #: 147 total cpu time spent up to now is 83.1 secs Computing kpt #: 148 total cpu time spent up to now is 83.4 secs Computing kpt #: 149 total cpu time spent up to now is 83.8 secs Computing kpt #: 150 total cpu time spent up to now is 84.2 secs Computing kpt #: 151 total cpu time spent up to now is 84.6 secs Computing kpt #: 152 total cpu time spent up to now is 85.0 secs Computing kpt #: 153 total cpu time spent up to now is 85.3 secs Computing kpt #: 154 total cpu time spent up to now is 85.7 secs Computing kpt #: 155 total cpu time spent up to now is 86.0 secs Computing kpt #: 156 total cpu time spent up to now is 86.2 secs Computing kpt #: 157 total cpu time spent up to now is 86.5 secs Computing kpt #: 158 total cpu time spent up to now is 86.7 secs Computing kpt #: 159 total cpu time spent up to now is 87.0 secs Computing kpt #: 160 total cpu time spent up to now is 87.2 secs Computing kpt #: 161 total cpu time spent up to now is 87.6 secs Computing kpt #: 162 total cpu time spent up to now is 87.9 secs Computing kpt #: 163 total cpu time spent up to now is 88.2 secs Computing kpt #: 164 total cpu time spent up to now is 88.6 secs Computing kpt #: 165 total cpu time spent up to now is 88.9 secs Computing kpt #: 166 total cpu time spent up to now is 89.2 secs Computing kpt #: 167 total cpu time spent up to now is 89.6 secs Computing kpt #: 168 total cpu time spent up to now is 90.0 secs Computing kpt #: 169 total cpu time spent up to now is 90.2 secs Computing kpt #: 170 total cpu time spent up to now is 90.5 secs Computing kpt #: 171 total cpu time spent up to now is 90.9 secs Computing kpt #: 172 total cpu time spent up to now is 91.2 secs Computing kpt #: 173 total cpu time spent up to now is 91.5 secs Computing kpt #: 174 total cpu time spent up to now is 91.9 secs Computing kpt #: 175 total cpu time spent up to now is 92.1 secs Computing kpt #: 176 total cpu time spent up to now is 92.3 secs Computing kpt #: 177 total cpu time spent up to now is 92.6 secs Computing kpt #: 178 total cpu time spent up to now is 92.8 secs Computing kpt #: 179 total cpu time spent up to now is 93.0 secs Computing kpt #: 180 total cpu time spent up to now is 93.2 secs Computing kpt #: 181 total cpu time spent up to now is 93.7 secs Computing kpt #: 182 total cpu time spent up to now is 94.1 secs Computing kpt #: 183 total cpu time spent up to now is 94.4 secs Computing kpt #: 184 total cpu time spent up to now is 94.6 secs Computing kpt #: 185 total cpu time spent up to now is 94.9 secs Computing kpt #: 186 total cpu time spent up to now is 95.1 secs Computing kpt #: 187 total cpu time spent up to now is 95.3 secs Computing kpt #: 188 total cpu time spent up to now is 95.7 secs Computing kpt #: 189 total cpu time spent up to now is 96.0 secs Computing kpt #: 190 total cpu time spent up to now is 96.3 secs Computing kpt #: 191 total cpu time spent up to now is 96.5 secs Computing kpt #: 192 total cpu time spent up to now is 96.9 secs Computing kpt #: 193 total cpu time spent up to now is 97.1 secs Computing kpt #: 194 total cpu time spent up to now is 97.3 secs Computing kpt #: 195 total cpu time spent up to now is 97.6 secs Computing kpt #: 196 total cpu time spent up to now is 98.0 secs Computing kpt #: 197 total cpu time spent up to now is 98.3 secs Computing kpt #: 198 total cpu time spent up to now is 98.6 secs Computing kpt #: 199 total cpu time spent up to now is 98.8 secs Computing kpt #: 200 total cpu time spent up to now is 99.0 secs Computing kpt #: 201 total cpu time spent up to now is 99.2 secs Computing kpt #: 202 total cpu time spent up to now is 99.4 secs Computing kpt #: 203 total cpu time spent up to now is 99.6 secs Computing kpt #: 204 total cpu time spent up to now is 100.1 secs Computing kpt #: 205 total cpu time spent up to now is 100.3 secs Computing kpt #: 206 total cpu time spent up to now is 100.6 secs Computing kpt #: 207 total cpu time spent up to now is 100.9 secs Computing kpt #: 208 total cpu time spent up to now is 101.1 secs Computing kpt #: 209 total cpu time spent up to now is 101.3 secs Computing kpt #: 210 total cpu time spent up to now is 101.5 secs Computing kpt #: 211 total cpu time spent up to now is 101.7 secs Computing kpt #: 212 total cpu time spent up to now is 102.0 secs Computing kpt #: 213 total cpu time spent up to now is 102.4 secs Computing kpt #: 214 total cpu time spent up to now is 102.8 secs Computing kpt #: 215 total cpu time spent up to now is 103.1 secs Computing kpt #: 216 total cpu time spent up to now is 103.3 secs Computing kpt #: 217 total cpu time spent up to now is 103.5 secs Computing kpt #: 218 total cpu time spent up to now is 103.8 secs Computing kpt #: 219 total cpu time spent up to now is 104.0 secs Computing kpt #: 220 total cpu time spent up to now is 104.2 secs Computing kpt #: 221 total cpu time spent up to now is 104.4 secs Computing kpt #: 222 total cpu time spent up to now is 104.6 secs Computing kpt #: 223 total cpu time spent up to now is 105.0 secs Computing kpt #: 224 total cpu time spent up to now is 105.2 secs Computing kpt #: 225 total cpu time spent up to now is 105.4 secs Computing kpt #: 226 total cpu time spent up to now is 105.8 secs Computing kpt #: 227 total cpu time spent up to now is 106.0 secs Computing kpt #: 228 total cpu time spent up to now is 106.3 secs Computing kpt #: 229 total cpu time spent up to now is 106.7 secs Computing kpt #: 230 total cpu time spent up to now is 107.0 secs Computing kpt #: 231 total cpu time spent up to now is 107.3 secs Computing kpt #: 232 total cpu time spent up to now is 107.5 secs Computing kpt #: 233 total cpu time spent up to now is 107.8 secs Computing kpt #: 234 total cpu time spent up to now is 108.1 secs Computing kpt #: 235 total cpu time spent up to now is 108.4 secs Computing kpt #: 236 total cpu time spent up to now is 108.7 secs Computing kpt #: 237 total cpu time spent up to now is 109.0 secs Computing kpt #: 238 total cpu time spent up to now is 109.2 secs Computing kpt #: 239 total cpu time spent up to now is 109.7 secs Computing kpt #: 240 total cpu time spent up to now is 110.0 secs Computing kpt #: 241 total cpu time spent up to now is 110.3 secs Computing kpt #: 242 total cpu time spent up to now is 110.5 secs Computing kpt #: 243 total cpu time spent up to now is 110.8 secs Computing kpt #: 244 total cpu time spent up to now is 111.1 secs Computing kpt #: 245 total cpu time spent up to now is 111.3 secs Computing kpt #: 246 total cpu time spent up to now is 111.6 secs Computing kpt #: 247 total cpu time spent up to now is 112.1 secs Computing kpt #: 248 total cpu time spent up to now is 112.5 secs Computing kpt #: 249 total cpu time spent up to now is 112.7 secs Computing kpt #: 250 total cpu time spent up to now is 113.1 secs Computing kpt #: 251 total cpu time spent up to now is 113.4 secs Computing kpt #: 252 total cpu time spent up to now is 113.6 secs Computing kpt #: 253 total cpu time spent up to now is 113.9 secs Computing kpt #: 254 total cpu time spent up to now is 114.2 secs Computing kpt #: 255 total cpu time spent up to now is 114.5 secs Computing kpt #: 256 total cpu time spent up to now is 114.8 secs Computing kpt #: 257 total cpu time spent up to now is 115.0 secs Computing kpt #: 258 total cpu time spent up to now is 115.3 secs Computing kpt #: 259 total cpu time spent up to now is 115.6 secs Computing kpt #: 260 total cpu time spent up to now is 115.9 secs Computing kpt #: 261 total cpu time spent up to now is 116.1 secs Computing kpt #: 262 total cpu time spent up to now is 116.3 secs Computing kpt #: 263 total cpu time spent up to now is 116.6 secs Computing kpt #: 264 total cpu time spent up to now is 116.8 secs Computing kpt #: 265 total cpu time spent up to now is 117.0 secs Computing kpt #: 266 total cpu time spent up to now is 117.2 secs Computing kpt #: 267 total cpu time spent up to now is 117.4 secs Computing kpt #: 268 total cpu time spent up to now is 117.8 secs Computing kpt #: 269 total cpu time spent up to now is 118.0 secs Computing kpt #: 270 total cpu time spent up to now is 118.3 secs Computing kpt #: 271 total cpu time spent up to now is 118.6 secs Computing kpt #: 272 total cpu time spent up to now is 118.8 secs Computing kpt #: 273 total cpu time spent up to now is 119.1 secs Computing kpt #: 274 total cpu time spent up to now is 119.4 secs Computing kpt #: 275 total cpu time spent up to now is 119.7 secs Computing kpt #: 276 total cpu time spent up to now is 119.9 secs Computing kpt #: 277 total cpu time spent up to now is 120.2 secs Computing kpt #: 278 total cpu time spent up to now is 120.4 secs Computing kpt #: 279 total cpu time spent up to now is 120.7 secs Computing kpt #: 280 total cpu time spent up to now is 120.9 secs Computing kpt #: 281 total cpu time spent up to now is 121.1 secs Computing kpt #: 282 total cpu time spent up to now is 121.3 secs Computing kpt #: 283 total cpu time spent up to now is 121.6 secs Computing kpt #: 284 total cpu time spent up to now is 121.8 secs Computing kpt #: 285 total cpu time spent up to now is 122.0 secs Computing kpt #: 286 total cpu time spent up to now is 122.3 secs Computing kpt #: 287 total cpu time spent up to now is 122.5 secs Computing kpt #: 288 total cpu time spent up to now is 122.7 secs Computing kpt #: 289 total cpu time spent up to now is 123.0 secs Computing kpt #: 290 total cpu time spent up to now is 123.2 secs Computing kpt #: 291 total cpu time spent up to now is 123.5 secs Computing kpt #: 292 total cpu time spent up to now is 123.7 secs Computing kpt #: 293 total cpu time spent up to now is 124.1 secs Computing kpt #: 294 total cpu time spent up to now is 124.4 secs Computing kpt #: 295 total cpu time spent up to now is 124.7 secs Computing kpt #: 296 total cpu time spent up to now is 125.0 secs Computing kpt #: 297 total cpu time spent up to now is 125.5 secs Computing kpt #: 298 total cpu time spent up to now is 125.8 secs Computing kpt #: 299 total cpu time spent up to now is 126.2 secs Computing kpt #: 300 total cpu time spent up to now is 126.5 secs Computing kpt #: 301 total cpu time spent up to now is 126.8 secs Computing kpt #: 302 total cpu time spent up to now is 127.1 secs Computing kpt #: 303 total cpu time spent up to now is 127.5 secs Computing kpt #: 304 total cpu time spent up to now is 128.1 secs Computing kpt #: 305 total cpu time spent up to now is 128.3 secs Computing kpt #: 306 total cpu time spent up to now is 128.7 secs Computing kpt #: 307 total cpu time spent up to now is 129.0 secs Computing kpt #: 308 total cpu time spent up to now is 129.2 secs Computing kpt #: 309 total cpu time spent up to now is 129.5 secs Computing kpt #: 310 total cpu time spent up to now is 129.8 secs Computing kpt #: 311 total cpu time spent up to now is 130.0 secs Computing kpt #: 312 total cpu time spent up to now is 130.3 secs Computing kpt #: 313 total cpu time spent up to now is 130.5 secs Computing kpt #: 314 total cpu time spent up to now is 130.8 secs Computing kpt #: 315 total cpu time spent up to now is 131.1 secs Computing kpt #: 316 total cpu time spent up to now is 131.4 secs Computing kpt #: 317 total cpu time spent up to now is 131.8 secs Computing kpt #: 318 total cpu time spent up to now is 132.2 secs Computing kpt #: 319 total cpu time spent up to now is 132.4 secs Computing kpt #: 320 total cpu time spent up to now is 132.7 secs Computing kpt #: 321 total cpu time spent up to now is 133.0 secs Computing kpt #: 322 total cpu time spent up to now is 133.3 secs Computing kpt #: 323 total cpu time spent up to now is 133.7 secs Computing kpt #: 324 total cpu time spent up to now is 134.0 secs Computing kpt #: 325 total cpu time spent up to now is 134.3 secs Computing kpt #: 326 total cpu time spent up to now is 134.8 secs Computing kpt #: 327 total cpu time spent up to now is 135.1 secs Computing kpt #: 328 total cpu time spent up to now is 135.5 secs Computing kpt #: 329 total cpu time spent up to now is 135.9 secs Computing kpt #: 330 total cpu time spent up to now is 136.2 secs Computing kpt #: 331 total cpu time spent up to now is 136.4 secs Computing kpt #: 332 total cpu time spent up to now is 136.7 secs Computing kpt #: 333 total cpu time spent up to now is 136.9 secs Computing kpt #: 334 total cpu time spent up to now is 137.2 secs Computing kpt #: 335 total cpu time spent up to now is 137.4 secs Computing kpt #: 336 total cpu time spent up to now is 137.7 secs Computing kpt #: 337 total cpu time spent up to now is 137.9 secs Computing kpt #: 338 total cpu time spent up to now is 138.2 secs Computing kpt #: 339 total cpu time spent up to now is 138.4 secs Computing kpt #: 340 total cpu time spent up to now is 138.7 secs Computing kpt #: 341 total cpu time spent up to now is 139.0 secs Computing kpt #: 342 total cpu time spent up to now is 139.3 secs Computing kpt #: 343 total cpu time spent up to now is 139.7 secs Computing kpt #: 344 total cpu time spent up to now is 140.1 secs Computing kpt #: 345 total cpu time spent up to now is 140.4 secs Computing kpt #: 346 total cpu time spent up to now is 140.8 secs Computing kpt #: 347 total cpu time spent up to now is 141.2 secs Computing kpt #: 348 total cpu time spent up to now is 141.6 secs Computing kpt #: 349 total cpu time spent up to now is 141.9 secs Computing kpt #: 350 total cpu time spent up to now is 142.2 secs Computing kpt #: 351 total cpu time spent up to now is 142.4 secs Computing kpt #: 352 total cpu time spent up to now is 142.7 secs Computing kpt #: 353 total cpu time spent up to now is 143.0 secs Computing kpt #: 354 total cpu time spent up to now is 143.5 secs Computing kpt #: 355 total cpu time spent up to now is 143.8 secs Computing kpt #: 356 total cpu time spent up to now is 144.1 secs Computing kpt #: 357 total cpu time spent up to now is 144.3 secs Computing kpt #: 358 total cpu time spent up to now is 144.7 secs Computing kpt #: 359 total cpu time spent up to now is 145.0 secs Computing kpt #: 360 total cpu time spent up to now is 145.3 secs Computing kpt #: 361 total cpu time spent up to now is 145.7 secs Computing kpt #: 362 total cpu time spent up to now is 146.0 secs Computing kpt #: 363 total cpu time spent up to now is 146.3 secs Computing kpt #: 364 total cpu time spent up to now is 146.5 secs Computing kpt #: 365 total cpu time spent up to now is 146.7 secs Computing kpt #: 366 total cpu time spent up to now is 147.0 secs Computing kpt #: 367 total cpu time spent up to now is 147.2 secs Computing kpt #: 368 total cpu time spent up to now is 147.4 secs Computing kpt #: 369 total cpu time spent up to now is 147.7 secs Computing kpt #: 370 total cpu time spent up to now is 148.1 secs Computing kpt #: 371 total cpu time spent up to now is 148.3 secs Computing kpt #: 372 total cpu time spent up to now is 148.6 secs Computing kpt #: 373 total cpu time spent up to now is 148.8 secs Computing kpt #: 374 total cpu time spent up to now is 149.2 secs Computing kpt #: 375 total cpu time spent up to now is 149.7 secs Computing kpt #: 376 total cpu time spent up to now is 150.1 secs Computing kpt #: 377 total cpu time spent up to now is 150.3 secs Computing kpt #: 378 total cpu time spent up to now is 150.6 secs Computing kpt #: 379 total cpu time spent up to now is 150.8 secs Computing kpt #: 380 total cpu time spent up to now is 151.0 secs Computing kpt #: 381 total cpu time spent up to now is 151.2 secs Computing kpt #: 382 total cpu time spent up to now is 151.5 secs Computing kpt #: 383 total cpu time spent up to now is 151.7 secs Computing kpt #: 384 total cpu time spent up to now is 151.9 secs Computing kpt #: 385 total cpu time spent up to now is 152.1 secs Computing kpt #: 386 total cpu time spent up to now is 152.3 secs Computing kpt #: 387 total cpu time spent up to now is 152.5 secs Computing kpt #: 388 total cpu time spent up to now is 152.8 secs Computing kpt #: 389 total cpu time spent up to now is 153.0 secs Computing kpt #: 390 total cpu time spent up to now is 153.2 secs Computing kpt #: 391 total cpu time spent up to now is 153.5 secs Computing kpt #: 392 total cpu time spent up to now is 153.9 secs Computing kpt #: 393 total cpu time spent up to now is 154.1 secs Computing kpt #: 394 total cpu time spent up to now is 154.4 secs Computing kpt #: 395 total cpu time spent up to now is 154.6 secs Computing kpt #: 396 total cpu time spent up to now is 154.8 secs Computing kpt #: 397 total cpu time spent up to now is 155.1 secs Computing kpt #: 398 total cpu time spent up to now is 155.3 secs Computing kpt #: 399 total cpu time spent up to now is 155.5 secs Computing kpt #: 400 total cpu time spent up to now is 155.7 secs Computing kpt #: 401 total cpu time spent up to now is 156.0 secs Computing kpt #: 402 total cpu time spent up to now is 156.2 secs Computing kpt #: 403 total cpu time spent up to now is 156.4 secs Computing kpt #: 404 total cpu time spent up to now is 156.6 secs Computing kpt #: 405 total cpu time spent up to now is 156.9 secs Computing kpt #: 406 total cpu time spent up to now is 157.1 secs Computing kpt #: 407 total cpu time spent up to now is 157.4 secs Computing kpt #: 408 total cpu time spent up to now is 157.6 secs Computing kpt #: 409 total cpu time spent up to now is 157.8 secs Computing kpt #: 410 total cpu time spent up to now is 158.1 secs Computing kpt #: 411 total cpu time spent up to now is 158.3 secs Computing kpt #: 412 total cpu time spent up to now is 158.6 secs Computing kpt #: 413 total cpu time spent up to now is 158.8 secs Computing kpt #: 414 total cpu time spent up to now is 159.1 secs Computing kpt #: 415 total cpu time spent up to now is 159.3 secs Computing kpt #: 416 total cpu time spent up to now is 159.6 secs Computing kpt #: 417 total cpu time spent up to now is 159.9 secs Computing kpt #: 418 total cpu time spent up to now is 160.1 secs Computing kpt #: 419 total cpu time spent up to now is 160.5 secs Computing kpt #: 420 total cpu time spent up to now is 160.8 secs Computing kpt #: 421 total cpu time spent up to now is 161.1 secs Computing kpt #: 422 total cpu time spent up to now is 161.3 secs Computing kpt #: 423 total cpu time spent up to now is 161.7 secs Computing kpt #: 424 total cpu time spent up to now is 161.9 secs Computing kpt #: 425 total cpu time spent up to now is 162.3 secs Computing kpt #: 426 total cpu time spent up to now is 162.7 secs Computing kpt #: 427 total cpu time spent up to now is 163.1 secs Computing kpt #: 428 total cpu time spent up to now is 163.3 secs Computing kpt #: 429 total cpu time spent up to now is 163.6 secs Computing kpt #: 430 total cpu time spent up to now is 163.9 secs Computing kpt #: 431 total cpu time spent up to now is 164.1 secs Computing kpt #: 432 total cpu time spent up to now is 164.4 secs Computing kpt #: 433 total cpu time spent up to now is 164.6 secs Computing kpt #: 434 total cpu time spent up to now is 164.9 secs Computing kpt #: 435 total cpu time spent up to now is 165.1 secs Computing kpt #: 436 total cpu time spent up to now is 165.4 secs Computing kpt #: 437 total cpu time spent up to now is 165.7 secs Computing kpt #: 438 total cpu time spent up to now is 165.9 secs Computing kpt #: 439 total cpu time spent up to now is 166.2 secs Computing kpt #: 440 total cpu time spent up to now is 166.6 secs Computing kpt #: 441 total cpu time spent up to now is 166.9 secs Computing kpt #: 442 total cpu time spent up to now is 167.2 secs Computing kpt #: 443 total cpu time spent up to now is 167.5 secs Computing kpt #: 444 total cpu time spent up to now is 167.8 secs Computing kpt #: 445 total cpu time spent up to now is 168.1 secs Computing kpt #: 446 total cpu time spent up to now is 168.4 secs Computing kpt #: 447 total cpu time spent up to now is 168.8 secs Computing kpt #: 448 total cpu time spent up to now is 169.1 secs Computing kpt #: 449 total cpu time spent up to now is 169.4 secs Computing kpt #: 450 total cpu time spent up to now is 169.7 secs Computing kpt #: 451 total cpu time spent up to now is 169.9 secs Computing kpt #: 452 total cpu time spent up to now is 170.2 secs Computing kpt #: 453 total cpu time spent up to now is 170.4 secs Computing kpt #: 454 total cpu time spent up to now is 170.7 secs Computing kpt #: 455 total cpu time spent up to now is 170.9 secs ethr = 5.00E-11, avg # of iterations = 13.0 total cpu time spent up to now is 171.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1067 PWs) bands (ev): -57.4244 -57.4244 -29.7327 -29.7327 -26.3378 -26.3378 -26.3378 -26.3378 2.7214 2.7214 9.8145 9.8145 9.8145 9.8145 9.9055 9.9055 14.0501 14.0501 14.0501 14.0501 19.9510 19.9510 21.9046 21.9046 21.9046 21.9046 22.0101 22.0101 k = 0.0072-0.0042 0.0059 ( 1067 PWs) bands (ev): -57.4244 -57.4244 -29.7327 -29.7327 -26.3379 -26.3379 -26.3378 -26.3378 2.7225 2.7225 9.8138 9.8138 9.8155 9.8155 9.9058 9.9058 14.0477 14.0477 14.0516 14.0516 19.9537 19.9537 21.9012 21.9012 21.9055 21.9055 22.0089 22.0089 k = 0.0145-0.0084 0.0118 ( 1067 PWs) bands (ev): -57.4243 -57.4243 -29.7329 -29.7329 -26.3381 -26.3381 -26.3379 -26.3379 2.7258 2.7258 9.8124 9.8124 9.8180 9.8180 9.9066 9.9066 14.0436 14.0436 14.0533 14.0533 19.9617 19.9617 21.8950 21.8950 21.9038 21.9038 22.0053 22.0053 k = 0.0217-0.0126 0.0177 ( 1067 PWs) bands (ev): -57.4243 -57.4243 -29.7331 -29.7331 -26.3385 -26.3385 -26.3381 -26.3381 2.7313 2.7313 9.8099 9.8099 9.8221 9.8221 9.9082 9.9082 14.0372 14.0372 14.0556 14.0556 19.9750 19.9750 21.8859 21.8859 21.8997 21.8997 21.9993 21.9993 k = 0.0290-0.0167 0.0237 ( 1067 PWs) bands (ev): -57.4242 -57.4242 -29.7334 -29.7334 -26.3391 -26.3391 -26.3384 -26.3384 2.7389 2.7389 9.8059 9.8059 9.8278 9.8278 9.9110 9.9110 14.0284 14.0284 14.0588 14.0588 19.9936 19.9936 21.8738 21.8738 21.8932 21.8932 21.9911 21.9911 k = 0.0362-0.0209 0.0296 ( 1067 PWs) bands (ev): -57.4241 -57.4241 -29.7338 -29.7338 -26.3398 -26.3398 -26.3388 -26.3388 2.7487 2.7487 9.8001 9.8001 9.8351 9.8351 9.9153 9.9153 14.0172 14.0172 14.0629 14.0629 20.0174 20.0174 21.8585 21.8585 21.8841 21.8841 21.9808 21.9808 k = 0.0435-0.0251 0.0355 ( 1067 PWs) bands (ev): -57.4240 -57.4240 -29.7343 -29.7343 -26.3407 -26.3407 -26.3392 -26.3392 2.7606 2.7606 9.7921 9.7921 9.8441 9.8441 9.9216 9.9216 14.0036 14.0036 14.0678 14.0678 20.0463 20.0463 21.8399 21.8399 21.8723 21.8723 21.9684 21.9684 k = 0.0507-0.0293 0.0414 ( 1066 PWs) bands (ev): -57.4239 -57.4239 -29.7348 -29.7348 -26.3417 -26.3417 -26.3397 -26.3397 2.7747 2.7747 9.7820 9.7820 9.8546 9.8547 9.9299 9.9299 13.9877 13.9877 14.0735 14.0735 20.0804 20.0804 21.8180 21.8180 21.8574 21.8574 21.9542 21.9542 k = 0.0580-0.0335 0.0473 ( 1066 PWs) bands (ev): -57.4237 -57.4237 -29.7354 -29.7354 -26.3429 -26.3429 -26.3403 -26.3403 2.7908 2.7908 9.7697 9.7697 9.8669 9.8669 9.9403 9.9403 13.9693 13.9693 14.0802 14.0802 20.1194 20.1194 21.7927 21.7927 21.8392 21.8392 21.9383 21.9383 k = 0.0652-0.0377 0.0532 ( 1066 PWs) bands (ev): -57.4235 -57.4235 -29.7362 -29.7362 -26.3442 -26.3442 -26.3409 -26.3409 2.8090 2.8090 9.7554 9.7554 9.8807 9.8807 9.9527 9.9527 13.9490 13.9490 14.0877 14.0877 20.1634 20.1634 21.7638 21.7638 21.8173 21.8173 21.9210 21.9210 k = 0.0725-0.0418 0.0592 ( 1074 PWs) bands (ev): -57.4233 -57.4233 -29.7370 -29.7370 -26.3457 -26.3457 -26.3417 -26.3417 2.8293 2.8293 9.7391 9.7391 9.8960 9.8960 9.9670 9.9670 13.9264 13.9264 14.0959 14.0959 20.2121 20.2121 21.7313 21.7313 21.7916 21.7916 21.9021 21.9021 k = 0.0797-0.0460 0.0651 ( 1066 PWs) bands (ev): -57.4231 -57.4231 -29.7378 -29.7378 -26.3473 -26.3473 -26.3424 -26.3424 2.8515 2.8515 9.7211 9.7211 9.9132 9.9132 9.9834 9.9834 13.9020 13.9020 14.1051 14.1051 20.2655 20.2655 21.6953 21.6953 21.7619 21.7619 21.8819 21.8820 k = 0.0870-0.0502 0.0710 ( 1066 PWs) bands (ev): -57.4229 -57.4229 -29.7388 -29.7388 -26.3491 -26.3491 -26.3433 -26.3433 2.8757 2.8757 9.7015 9.7015 9.9318 9.9318 10.0016 10.0016 13.8756 13.8756 14.1151 14.1151 20.3235 20.3235 21.6554 21.6554 21.7280 21.7280 21.8601 21.8601 k = 0.0942-0.0544 0.0769 ( 1074 PWs) bands (ev): -57.4227 -57.4227 -29.7398 -29.7398 -26.3510 -26.3510 -26.3442 -26.3442 2.9017 2.9017 9.6804 9.6804 9.9520 9.9520 10.0215 10.0215 13.8473 13.8473 14.1257 14.1257 20.3858 20.3858 21.6117 21.6117 21.6899 21.6899 21.8365 21.8366 k = 0.1014-0.0586 0.0828 ( 1062 PWs) bands (ev): -57.4224 -57.4224 -29.7409 -29.7409 -26.3530 -26.3530 -26.3452 -26.3452 2.9296 2.9296 9.6581 9.6581 9.9740 9.9740 10.0434 10.0434 13.8174 13.8174 14.1373 14.1373 20.4525 20.4525 21.5644 21.5644 21.6480 21.6480 21.8111 21.8111 k = 0.1087-0.0628 0.0887 ( 1062 PWs) bands (ev): -57.4221 -57.4221 -29.7421 -29.7421 -26.3551 -26.3551 -26.3463 -26.3463 2.9593 2.9593 9.6345 9.6345 9.9974 9.9974 10.0669 10.0669 13.7859 13.7859 14.1496 14.1496 20.5232 20.5232 21.5131 21.5131 21.6017 21.6017 21.7834 21.7834 k = 0.1159-0.0669 0.0947 ( 1062 PWs) bands (ev): -57.4218 -57.4218 -29.7433 -29.7433 -26.3574 -26.3574 -26.3474 -26.3474 2.9908 2.9908 9.6100 9.6100 10.0225 10.0225 10.0922 10.0922 13.7529 13.7529 14.1626 14.1626 20.5979 20.5979 21.4578 21.4578 21.5515 21.5515 21.7531 21.7531 k = 0.1232-0.0711 0.1006 ( 1062 PWs) bands (ev): -57.4215 -57.4215 -29.7446 -29.7446 -26.3598 -26.3598 -26.3486 -26.3486 3.0239 3.0239 9.5845 9.5845 10.0491 10.0491 10.1191 10.1191 13.7187 13.7187 14.1764 14.1764 20.6763 20.6763 21.3987 21.3987 21.4972 21.4972 21.7202 21.7203 k = 0.1304-0.0753 0.1065 ( 1062 PWs) bands (ev): -57.4212 -57.4212 -29.7459 -29.7459 -26.3623 -26.3623 -26.3498 -26.3498 3.0586 3.0586 9.5583 9.5583 10.0774 10.0774 10.1477 10.1477 13.6832 13.6832 14.1908 14.1908 20.7581 20.7581 21.3356 21.3356 21.4390 21.4390 21.6845 21.6845 k = 0.1377-0.0795 0.1124 ( 1054 PWs) bands (ev): -57.4208 -57.4208 -29.7473 -29.7473 -26.3649 -26.3649 -26.3510 -26.3510 3.0948 3.0948 9.5316 9.5316 10.1072 10.1072 10.1780 10.1780 13.6468 13.6468 14.2060 14.2060 20.8431 20.8431 21.2689 21.2689 21.3773 21.3773 21.6458 21.6458 k = 0.1449-0.0837 0.1183 ( 1054 PWs) bands (ev): -57.4205 -57.4205 -29.7488 -29.7488 -26.3676 -26.3676 -26.3524 -26.3524 3.1325 3.1325 9.5043 9.5043 10.1386 10.1386 10.2099 10.2099 13.6095 13.6095 14.2217 14.2217 20.9307 20.9307 21.1981 21.1981 21.3121 21.3121 21.6037 21.6037 k = 0.1522-0.0879 0.1242 ( 1062 PWs) bands (ev): -57.4201 -57.4201 -29.7504 -29.7504 -26.3704 -26.3704 -26.3538 -26.3538 3.1715 3.1715 9.4767 9.4767 10.1714 10.1714 10.2433 10.2433 13.5713 13.5713 14.2381 14.2381 21.0188 21.0188 21.1237 21.1237 21.2450 21.2450 21.5583 21.5583 k = 0.1594-0.0920 0.1302 ( 1066 PWs) bands (ev): -57.4197 -57.4197 -29.7520 -29.7520 -26.3734 -26.3734 -26.3552 -26.3552 3.2118 3.2118 9.4488 9.4488 10.2058 10.2058 10.2784 10.2784 13.5326 13.5326 14.2551 14.2551 21.0445 21.0445 21.0956 21.0956 21.1887 21.1887 21.5100 21.5100 k = 0.1667-0.0962 0.1361 ( 1066 PWs) bands (ev): -57.4193 -57.4193 -29.7536 -29.7536 -26.3763 -26.3763 -26.3567 -26.3567 3.2533 3.2533 9.4208 9.4208 10.2418 10.2418 10.3151 10.3151 13.4937 13.4937 14.2727 14.2727 20.9630 20.9630 21.0724 21.0724 21.2277 21.2277 21.4604 21.4604 k = 0.1739-0.1004 0.1420 ( 1066 PWs) bands (ev): -57.4189 -57.4189 -29.7552 -29.7552 -26.3794 -26.3794 -26.3582 -26.3582 3.2959 3.2959 9.3928 9.3928 10.2793 10.2793 10.3533 10.3533 13.4546 13.4546 14.2908 14.2908 20.8776 20.8776 20.9974 20.9974 21.3036 21.3036 21.4209 21.4209 k = 0.1812-0.1046 0.1479 ( 1062 PWs) bands (ev): -57.4185 -57.4185 -29.7569 -29.7569 -26.3825 -26.3825 -26.3597 -26.3597 3.3395 3.3395 9.3650 9.3650 10.3184 10.3184 10.3931 10.3931 13.4156 13.4156 14.3094 14.3094 20.7888 20.7888 20.9143 20.9143 21.3067 21.3067 21.4572 21.4572 k = 0.1884-0.1088 0.1538 ( 1062 PWs) bands (ev): -57.4181 -57.4181 -29.7587 -29.7587 -26.3857 -26.3857 -26.3613 -26.3613 3.3840 3.3840 9.3373 9.3373 10.3589 10.3589 10.4344 10.4344 13.3766 13.3766 14.3285 14.3285 20.6967 20.6967 20.8267 20.8267 21.2508 21.2508 21.5514 21.5514 k = 0.1957-0.1130 0.1597 ( 1070 PWs) bands (ev): -57.4177 -57.4177 -29.7605 -29.7605 -26.3889 -26.3889 -26.3629 -26.3629 3.4293 3.4293 9.3100 9.3100 10.4008 10.4008 10.4771 10.4771 13.3380 13.3380 14.3479 14.3479 20.6014 20.6014 20.7353 20.7353 21.1825 21.1825 21.6562 21.6562 k = 0.2029-0.1171 0.1657 ( 1070 PWs) bands (ev): -57.4172 -57.4172 -29.7623 -29.7623 -26.3922 -26.3922 -26.3646 -26.3646 3.4753 3.4753 9.2832 9.2832 10.4442 10.4442 10.5214 10.5214 13.2999 13.2999 14.3679 14.3679 20.5033 20.5033 20.6408 20.6408 21.1077 21.1077 21.7652 21.7652 k = 0.2101-0.1213 0.1716 ( 1070 PWs) bands (ev): -57.4168 -57.4168 -29.7641 -29.7641 -26.3955 -26.3955 -26.3662 -26.3662 3.5219 3.5219 9.2568 9.2568 10.4891 10.4891 10.5671 10.5671 13.2625 13.2625 14.3882 14.3882 20.4024 20.4024 20.5432 20.5432 21.0276 21.0276 21.8769 21.8769 k = 0.2174-0.1255 0.1775 ( 1062 PWs) bands (ev): -57.4163 -57.4163 -29.7659 -29.7659 -26.3989 -26.3989 -26.3679 -26.3679 3.5689 3.5689 9.2311 9.2311 10.5354 10.5354 10.6143 10.6143 13.2261 13.2261 14.4090 14.4090 20.2990 20.2990 20.4429 20.4429 20.9426 20.9426 21.9909 21.9909 k = 0.2246-0.1297 0.1834 ( 1062 PWs) bands (ev): -57.4159 -57.4159 -29.7678 -29.7678 -26.4023 -26.4023 -26.3696 -26.3696 3.6162 3.6162 9.2061 9.2061 10.5831 10.5831 10.6628 10.6628 13.1907 13.1907 14.4299 14.4299 20.1932 20.1932 20.3399 20.3399 20.8528 20.8528 22.1067 22.1067 k = 0.2319-0.1339 0.1893 ( 1062 PWs) bands (ev): -57.4154 -57.4154 -29.7696 -29.7696 -26.4057 -26.4057 -26.3713 -26.3713 3.6638 3.6638 9.1817 9.1817 10.6320 10.6320 10.7126 10.7126 13.1566 13.1566 14.4510 14.4510 20.0852 20.0852 20.2345 20.2345 20.7584 20.7584 22.2241 22.2241 k = 0.2391-0.1381 0.1952 ( 1062 PWs) bands (ev): -57.4150 -57.4150 -29.7715 -29.7715 -26.4091 -26.4091 -26.3730 -26.3730 3.7114 3.7114 9.1583 9.1583 10.6823 10.6823 10.7638 10.7638 13.1239 13.1239 14.4724 14.4724 19.9752 19.9752 20.1269 20.1269 20.6594 20.6594 22.3430 22.3430 k = 0.2464-0.1422 0.2012 ( 1062 PWs) bands (ev): -57.4145 -57.4145 -29.7734 -29.7734 -26.4125 -26.4125 -26.3747 -26.3747 3.7590 3.7590 9.1356 9.1356 10.7339 10.7339 10.8162 10.8162 13.0928 13.0928 14.4939 14.4939 19.8635 19.8635 20.0174 20.0174 20.5562 20.5562 22.4631 22.4631 k = 0.2536-0.1464 0.2071 ( 1062 PWs) bands (ev): -57.4140 -57.4140 -29.7753 -29.7753 -26.4159 -26.4159 -26.3764 -26.3764 3.8065 3.8065 9.1140 9.1140 10.7867 10.7867 10.8699 10.8699 13.0636 13.0636 14.5156 14.5156 19.7502 19.7502 19.9061 19.9061 20.4488 20.4488 22.5842 22.5842 k = 0.2609-0.1506 0.2130 ( 1062 PWs) bands (ev): -57.4136 -57.4136 -29.7772 -29.7772 -26.4193 -26.4193 -26.3781 -26.3781 3.8537 3.8537 9.0933 9.0933 10.8407 10.8407 10.9247 10.9247 13.0363 13.0364 14.5373 14.5373 19.6357 19.6357 19.7932 19.7932 20.3375 20.3375 22.7063 22.7063 k = 0.2681-0.1548 0.2189 ( 1062 PWs) bands (ev): -57.4131 -57.4131 -29.7791 -29.7791 -26.4227 -26.4227 -26.3798 -26.3798 3.9005 3.9005 9.0736 9.0736 10.8958 10.8958 10.9806 10.9806 13.0113 13.0113 14.5591 14.5591 19.5200 19.5200 19.6790 19.6790 20.2224 20.2224 22.8292 22.8292 k = 0.2754-0.1590 0.2248 ( 1066 PWs) bands (ev): -57.4127 -57.4127 -29.7809 -29.7809 -26.4261 -26.4261 -26.3815 -26.3815 3.9467 3.9467 9.0549 9.0549 10.9520 10.9520 11.0376 11.0376 12.9885 12.9885 14.5808 14.5808 19.4034 19.4034 19.5637 19.5637 20.1039 20.1039 22.9525 22.9525 k = 0.2826-0.1632 0.2307 ( 1074 PWs) bands (ev): -57.4122 -57.4122 -29.7828 -29.7828 -26.4295 -26.4295 -26.3833 -26.3833 3.9924 3.9924 9.0372 9.0372 11.0091 11.0092 11.0955 11.0955 12.9682 12.9682 14.6022 14.6022 19.2861 19.2861 19.4475 19.4475 19.9822 19.9822 23.0764 23.0764 k = 0.2899-0.1673 0.2367 ( 1074 PWs) bands (ev): -57.4118 -57.4118 -29.7847 -29.7847 -26.4328 -26.4328 -26.3849 -26.3849 4.0373 4.0373 9.0206 9.0206 11.0674 11.0674 11.1544 11.1544 12.9506 12.9506 14.6238 14.6238 19.1685 19.1685 19.3307 19.3307 19.8577 19.8577 23.2005 23.2005 k = 0.2971-0.1715 0.2426 ( 1066 PWs) bands (ev): -57.4113 -57.4113 -29.7865 -29.7865 -26.4360 -26.4360 -26.3866 -26.3866 4.0813 4.0813 9.0052 9.0052 11.1265 11.1265 11.2141 11.2141 12.9360 12.9360 14.6453 14.6453 19.0508 19.0508 19.2136 19.2136 19.7308 19.7308 23.3249 23.3249 k = 0.3043-0.1757 0.2485 ( 1066 PWs) bands (ev): -57.4109 -57.4109 -29.7882 -29.7882 -26.4392 -26.4392 -26.3882 -26.3882 4.1243 4.1243 8.9908 8.9908 11.1864 11.1864 11.2746 11.2746 12.9241 12.9241 14.6665 14.6665 18.9330 18.9330 19.0962 19.0962 19.6015 19.6015 23.4492 23.4492 k = 0.3116-0.1799 0.2544 ( 1066 PWs) bands (ev): -57.4105 -57.4105 -29.7900 -29.7900 -26.4424 -26.4424 -26.3898 -26.3898 4.1663 4.1663 8.9773 8.9773 11.2471 11.2471 11.3357 11.3357 12.9152 12.9152 14.6875 14.6875 18.8155 18.8155 18.9788 18.9788 19.4703 19.4703 23.5733 23.5733 k = 0.3188-0.1841 0.2603 ( 1066 PWs) bands (ev): -57.4101 -57.4101 -29.7917 -29.7917 -26.4455 -26.4455 -26.3914 -26.3914 4.2072 4.2072 8.9649 8.9649 11.3083 11.3083 11.3974 11.3974 12.9094 12.9094 14.7082 14.7082 18.6985 18.6985 18.8617 18.8617 19.3376 19.3376 23.6970 23.6970 k = 0.3261-0.1883 0.2662 ( 1066 PWs) bands (ev): -57.4096 -57.4096 -29.7934 -29.7934 -26.4485 -26.4485 -26.3929 -26.3929 4.2467 4.2467 8.9534 8.9534 11.3701 11.3701 11.4595 11.4595 12.9069 12.9069 14.7286 14.7286 18.5822 18.5822 18.7452 18.7452 19.2038 19.2038 23.8203 23.8203 k = 0.3333-0.1925 0.2722 ( 1078 PWs) bands (ev): -57.4093 -57.4093 -29.7951 -29.7951 -26.4515 -26.4515 -26.3945 -26.3945 4.2849 4.2849 8.9428 8.9428 11.4323 11.4323 11.5218 11.5218 12.9074 12.9074 14.7483 14.7483 18.4669 18.4669 18.6293 18.6293 19.0690 19.0690 23.9427 23.9427 k = 0.3406-0.1966 0.2781 ( 1070 PWs) bands (ev): -57.4089 -57.4089 -29.7967 -29.7967 -26.4544 -26.4544 -26.3959 -26.3959 4.3218 4.3218 8.9332 8.9332 11.4949 11.4949 11.5844 11.5844 12.9115 12.9115 14.7680 14.7680 18.3530 18.3530 18.5146 18.5146 18.9341 18.9342 24.0645 24.0645 k = 0.3478-0.2008 0.2840 ( 1070 PWs) bands (ev): -57.4085 -57.4085 -29.7983 -29.7983 -26.4572 -26.4572 -26.3973 -26.3973 4.3572 4.3572 8.9244 8.9244 11.5575 11.5575 11.6469 11.6469 12.9188 12.9188 14.7871 14.7871 18.2405 18.2405 18.4011 18.4011 18.7993 18.7993 24.1851 24.1851 k = 0.3551-0.2050 0.2899 ( 1070 PWs) bands (ev): -57.4081 -57.4081 -29.7998 -29.7998 -26.4599 -26.4599 -26.3987 -26.3987 4.3910 4.3910 8.9164 8.9164 11.6202 11.6202 11.7093 11.7093 12.9294 12.9294 14.8056 14.8056 18.1297 18.1297 18.2890 18.2890 18.6649 18.6649 24.3046 24.3046 k = 0.3623-0.2092 0.2958 ( 1070 PWs) bands (ev): -57.4078 -57.4078 -29.8012 -29.8012 -26.4625 -26.4625 -26.4000 -26.4000 4.4233 4.4233 8.9091 8.9091 11.6827 11.6827 11.7713 11.7713 12.9433 12.9433 14.8236 14.8236 18.0209 18.0209 18.1787 18.1787 18.5315 18.5315 24.4225 24.4225 k = 0.3696-0.2134 0.3017 ( 1074 PWs) bands (ev): -57.4074 -57.4074 -29.8027 -29.8027 -26.4650 -26.4650 -26.4013 -26.4013 4.4539 4.4539 8.9025 8.9025 11.7448 11.7448 11.8326 11.8326 12.9602 12.9602 14.8410 14.8410 17.9144 17.9144 18.0705 18.0705 18.3995 18.3995 24.5387 24.5387 k = 0.3768-0.2176 0.3077 ( 1074 PWs) bands (ev): -57.4071 -57.4071 -29.8040 -29.8040 -26.4674 -26.4674 -26.4026 -26.4026 4.4829 4.4829 8.8966 8.8966 11.8065 11.8065 11.8932 11.8932 12.9801 12.9801 14.8577 14.8577 17.8105 17.8105 17.9645 17.9646 18.2695 18.2695 24.6531 24.6531 k = 0.3841-0.2217 0.3136 ( 1082 PWs) bands (ev): -57.4068 -57.4068 -29.8053 -29.8053 -26.4697 -26.4697 -26.4037 -26.4037 4.5102 4.5102 8.8913 8.8913 11.8672 11.8673 11.9527 11.9527 13.0028 13.0028 14.8737 14.8737 17.7094 17.7094 17.8612 17.8612 18.1419 18.1420 24.7651 24.7651 k = 0.3913-0.2259 0.3195 ( 1082 PWs) bands (ev): -57.4065 -57.4065 -29.8065 -29.8065 -26.4718 -26.4718 -26.4048 -26.4048 4.5358 4.5358 8.8865 8.8865 11.9271 11.9271 12.0109 12.0109 13.0281 13.0281 14.8890 14.8890 17.6116 17.6116 17.7608 17.7608 18.0175 18.0175 24.8747 24.8747 k = 0.3986-0.2301 0.3254 ( 1082 PWs) bands (ev): -57.4062 -57.4062 -29.8077 -29.8077 -26.4739 -26.4739 -26.4059 -26.4059 4.5598 4.5598 8.8822 8.8822 11.9858 11.9858 12.0675 12.0676 13.0556 13.0557 14.9036 14.9036 17.5172 17.5172 17.6637 17.6637 17.8968 17.8968 24.9814 24.9814 k = 0.4058-0.2343 0.3313 ( 1082 PWs) bands (ev): -57.4059 -57.4059 -29.8088 -29.8088 -26.4758 -26.4758 -26.4069 -26.4069 4.5820 4.5820 8.8784 8.8784 12.0429 12.0429 12.1223 12.1223 13.0851 13.0851 14.9173 14.9173 17.4266 17.4266 17.5702 17.5702 17.7804 17.7804 25.0849 25.0849 k = 0.4130-0.2385 0.3372 ( 1082 PWs) bands (ev): -57.4057 -57.4057 -29.8098 -29.8098 -26.4776 -26.4776 -26.4078 -26.4078 4.6025 4.6025 8.8750 8.8750 12.0982 12.0982 12.1747 12.1747 13.1161 13.1161 14.9301 14.9301 17.3401 17.3401 17.4805 17.4805 17.6691 17.6691 25.1848 25.1848 k = 0.4203-0.2427 0.3432 ( 1082 PWs) bands (ev): -57.4055 -57.4055 -29.8107 -29.8107 -26.4793 -26.4793 -26.4087 -26.4087 4.6213 4.6213 8.8719 8.8719 12.1513 12.1513 12.2246 12.2246 13.1481 13.1481 14.9421 14.9421 17.2580 17.2580 17.3952 17.3952 17.5637 17.5638 25.2805 25.2805 k = 0.4275-0.2468 0.3491 ( 1082 PWs) bands (ev): -57.4053 -57.4053 -29.8116 -29.8116 -26.4808 -26.4808 -26.4095 -26.4095 4.6385 4.6385 8.8692 8.8692 12.2019 12.2019 12.2716 12.2716 13.1806 13.1806 14.9532 14.9532 17.1805 17.1805 17.3145 17.3145 17.4651 17.4651 25.3717 25.3717 k = 0.4348-0.2510 0.3550 ( 1082 PWs) bands (ev): -57.4051 -57.4051 -29.8124 -29.8124 -26.4822 -26.4822 -26.4102 -26.4102 4.6539 4.6539 8.8669 8.8669 12.2497 12.2497 12.3152 12.3152 13.2131 13.2131 14.9633 14.9633 17.1080 17.1080 17.2389 17.2389 17.3740 17.3740 25.4576 25.4576 k = 0.4420-0.2552 0.3609 ( 1082 PWs) bands (ev): -57.4049 -57.4049 -29.8131 -29.8131 -26.4835 -26.4835 -26.4108 -26.4108 4.6677 4.6677 8.8648 8.8648 12.2943 12.2943 12.3552 12.3552 13.2448 13.2448 14.9725 14.9725 17.0407 17.0407 17.1690 17.1690 17.2911 17.2911 25.5376 25.5376 k = 0.4493-0.2594 0.3668 ( 1082 PWs) bands (ev): -57.4047 -57.4047 -29.8137 -29.8137 -26.4846 -26.4846 -26.4114 -26.4114 4.6798 4.6798 8.8630 8.8630 12.3352 12.3352 12.3911 12.3911 13.2752 13.2752 14.9806 14.9806 16.9790 16.9790 17.1054 17.1054 17.2172 17.2172 25.6111 25.6111 k = 0.4565-0.2636 0.3727 ( 1082 PWs) bands (ev): -57.4046 -57.4046 -29.8143 -29.8143 -26.4855 -26.4855 -26.4119 -26.4119 4.6902 4.6902 8.8615 8.8615 12.3721 12.3721 12.4227 12.4227 13.3035 13.3035 14.9877 14.9877 16.9233 16.9233 17.0488 17.0488 17.1527 17.1527 25.6772 25.6772 k = 0.4638-0.2678 0.3787 ( 1082 PWs) bands (ev): -57.4045 -57.4045 -29.8147 -29.8147 -26.4864 -26.4864 -26.4123 -26.4123 4.6990 4.6990 8.8603 8.8603 12.4046 12.4046 12.4496 12.4496 13.3289 13.3290 14.9938 14.9938 16.8742 16.8742 16.9999 16.9999 17.0979 17.0979 25.7351 25.7351 k = 0.4710-0.2719 0.3846 ( 1082 PWs) bands (ev): -57.4044 -57.4044 -29.8151 -29.8151 -26.4870 -26.4870 -26.4127 -26.4127 4.7062 4.7062 8.8592 8.8592 12.4322 12.4322 12.4715 12.4715 13.3509 13.3509 14.9988 14.9988 16.8325 16.8325 16.9593 16.9593 17.0529 17.0529 25.7840 25.7840 k = 0.4783-0.2761 0.3905 ( 1086 PWs) bands (ev): -57.4043 -57.4043 -29.8154 -29.8154 -26.4876 -26.4876 -26.4129 -26.4129 4.7119 4.7119 8.8584 8.8584 12.4545 12.4545 12.4884 12.4884 13.3688 13.3688 15.0027 15.0027 16.7988 16.7988 16.9273 16.9273 17.0178 17.0178 25.8231 25.8231 k = 0.4855-0.2803 0.3964 ( 1094 PWs) bands (ev): -57.4043 -57.4043 -29.8157 -29.8157 -26.4880 -26.4880 -26.4131 -26.4131 4.7158 4.7158 8.8578 8.8578 12.4709 12.4709 12.5001 12.5001 13.3820 13.3820 15.0055 15.0055 16.7740 16.7740 16.9044 16.9044 16.9926 16.9926 25.8515 25.8515 k = 0.4928-0.2845 0.4023 ( 1094 PWs) bands (ev): -57.4043 -57.4043 -29.8158 -29.8158 -26.4882 -26.4882 -26.4133 -26.4133 4.7182 4.7182 8.8575 8.8575 12.4812 12.4812 12.5069 12.5069 13.3901 13.3901 15.0072 15.0072 16.7589 16.7589 16.8906 16.8906 16.9775 16.9775 25.8689 25.8689 k = 0.5000-0.2887 0.4082 ( 1090 PWs) bands (ev): -57.4042 -57.4042 -29.8158 -29.8158 -26.4883 -26.4883 -26.4133 -26.4133 4.7190 4.7190 8.8575 8.8575 12.4847 12.4847 12.5092 12.5092 13.3928 13.3928 15.0078 15.0078 16.7539 16.7539 16.8861 16.8861 16.9725 16.9725 25.8747 25.8747 k = 0.5000-0.2887 0.4082 ( 1090 PWs) bands (ev): -57.4042 -57.4042 -29.8158 -29.8158 -26.4883 -26.4883 -26.4133 -26.4133 4.7190 4.7190 8.8575 8.8575 12.4847 12.4847 12.5092 12.5092 13.3928 13.3928 15.0078 15.0078 16.7539 16.7539 16.8861 16.8861 16.9725 16.9725 25.8747 25.8747 k = 0.5000-0.2804 0.4141 ( 1090 PWs) bands (ev): -57.4042 -57.4042 -29.8161 -29.8156 -26.4887 -26.4879 -26.4133 -26.4133 4.7171 4.7210 8.8581 8.8594 12.4751 12.4914 12.5080 12.5083 13.3851 13.4035 14.9998 15.0124 16.6827 16.7831 16.8856 16.8886 16.9414 17.0477 25.8747 25.8761 k = 0.5000-0.2722 0.4199 ( 1094 PWs) bands (ev): -57.4042 -57.4042 -29.8164 -29.8153 -26.4890 -26.4874 -26.4134 -26.4134 4.7152 4.7229 8.8613 8.8638 12.4627 12.4945 12.5050 12.5053 13.3803 13.4169 14.9883 15.0136 16.6049 16.7321 16.8904 16.8939 16.9859 17.1342 25.8761 25.8787 k = 0.5000-0.2639 0.4257 ( 1092 PWs) bands (ev): -57.4042 -57.4042 -29.8166 -29.8150 -26.4893 -26.4869 -26.4136 -26.4136 4.7134 4.7249 8.8670 8.8708 12.4478 12.4929 12.5002 12.5015 13.3788 13.4328 14.9735 15.0116 16.5273 16.6558 16.8928 16.8987 17.0634 17.2244 25.8788 25.8828 k = 0.5000-0.2557 0.4316 ( 1088 PWs) bands (ev): -57.4042 -57.4042 -29.8169 -29.8147 -26.4895 -26.4863 -26.4137 -26.4137 4.7116 4.7270 8.8752 8.8803 12.4308 12.4860 12.4929 12.4981 13.3805 13.4511 14.9550 15.0060 16.4519 16.5761 16.8962 16.9036 17.1484 17.3159 25.8831 25.8884 k = 0.5000-0.2474 0.4374 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8171 -29.8144 -26.4896 -26.4856 -26.4140 -26.4139 4.7100 4.7292 8.8859 8.8923 12.4119 12.4757 12.4836 12.4929 13.3852 13.4712 14.9329 14.9970 16.3797 16.4976 16.9005 16.9095 17.2357 17.4078 25.8888 25.8955 k = 0.5000-0.2392 0.4432 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8174 -29.8142 -26.4898 -26.4849 -26.4143 -26.4142 4.7083 4.7313 8.8991 8.9067 12.3912 12.4627 12.4721 12.4853 13.3926 13.4927 14.9070 14.9844 16.3112 16.4217 16.9058 16.9163 17.3236 17.4994 25.8958 25.9038 k = 0.5000-0.2309 0.4491 ( 1072 PWs) bands (ev): -57.4042 -57.4042 -29.8176 -29.8139 -26.4898 -26.4842 -26.4146 -26.4146 4.7067 4.7334 8.9147 8.9237 12.3692 12.4476 12.4585 12.4752 13.4025 13.5156 14.8776 14.9683 16.2470 16.3495 16.9121 16.9242 17.4114 17.5904 25.9042 25.9135 k = 0.5000-0.2227 0.4549 ( 1072 PWs) bands (ev): -57.4042 -57.4042 -29.8178 -29.8136 -26.4899 -26.4834 -26.4151 -26.4149 4.7052 4.7355 8.9326 8.9429 12.3459 12.4304 12.4428 12.4625 13.4145 13.5393 14.8446 14.9486 16.1873 16.2813 16.9191 16.9329 17.4985 17.6803 25.9141 25.9246 k = 0.5000-0.2144 0.4607 ( 1076 PWs) bands (ev): -57.4042 -57.4042 -29.8181 -29.8134 -26.4899 -26.4826 -26.4156 -26.4154 4.7037 4.7377 8.9527 8.9645 12.3216 12.4113 12.4251 12.4473 13.4285 13.5639 14.8083 14.9252 16.1323 16.2177 16.9270 16.9424 17.5845 17.7688 25.9254 25.9372 k = 0.5000-0.2062 0.4666 ( 1076 PWs) bands (ev): -57.4042 -57.4042 -29.8183 -29.8131 -26.4898 -26.4817 -26.4161 -26.4158 4.7023 4.7398 8.9752 8.9884 12.2965 12.3907 12.4053 12.4297 13.4440 13.5888 14.7689 14.8984 16.0822 16.1590 16.9356 16.9528 17.6691 17.8557 25.9382 25.9513 k = 0.5000-0.1979 0.4724 ( 1076 PWs) bands (ev): -57.4042 -57.4042 -29.8186 -29.8129 -26.4897 -26.4808 -26.4167 -26.4163 4.7010 4.7419 8.9999 9.0146 12.2708 12.3685 12.3835 12.4098 13.4608 13.6141 14.7269 14.8684 16.0370 16.1055 16.9449 16.9638 17.7521 17.9407 25.9525 25.9668 k = 0.5000-0.1897 0.4782 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8188 -29.8127 -26.4896 -26.4799 -26.4174 -26.4169 4.6997 4.7440 9.0267 9.0429 12.2445 12.3449 12.3598 12.3879 13.4785 13.6394 14.6827 14.8352 15.9962 16.0570 16.9548 16.9755 17.8331 18.0235 25.9683 25.9838 k = 0.5000-0.1815 0.4841 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8190 -29.8124 -26.4894 -26.4789 -26.4181 -26.4175 4.6985 4.7461 9.0556 9.0734 12.2177 12.3198 12.3343 12.3642 13.4969 13.6646 14.6370 14.7995 15.9600 16.0137 16.9653 16.9878 17.9119 18.1041 25.9857 26.0023 k = 0.5000-0.1732 0.4899 ( 1076 PWs) bands (ev): -57.4042 -57.4042 -29.8192 -29.8122 -26.4892 -26.4779 -26.4188 -26.4181 4.6974 4.7482 9.0864 9.1058 12.1903 12.2930 12.3072 12.3393 13.5157 13.6895 14.5903 14.7618 15.9280 15.9753 16.9762 17.0005 17.9884 18.1822 26.0045 26.0223 k = 0.5000-0.1650 0.4957 ( 1076 PWs) bands (ev): -57.4042 -57.4042 -29.8194 -29.8120 -26.4889 -26.4768 -26.4196 -26.4187 4.6963 4.7502 9.1190 9.1401 12.1623 12.2640 12.2789 12.3137 13.5347 13.7140 14.5433 14.7225 15.8997 15.9415 16.9874 17.0135 18.0622 18.2575 26.0248 26.0436 k = 0.5000-0.1567 0.5016 ( 1076 PWs) bands (ev): -57.4042 -57.4042 -29.8196 -29.8118 -26.4887 -26.4757 -26.4205 -26.4193 4.6953 4.7521 9.1532 9.1761 12.1335 12.2324 12.2496 12.2882 13.5538 13.7380 14.4963 14.6822 15.8749 15.9119 16.9989 17.0268 18.1333 18.3299 26.0465 26.0663 k = 0.5000-0.1485 0.5074 ( 1082 PWs) bands (ev): -57.4042 -57.4042 -29.8198 -29.8116 -26.4884 -26.4746 -26.4214 -26.4200 4.6943 4.7540 9.1890 9.2137 12.1034 12.1979 12.2199 12.2632 13.5726 13.7613 14.4501 14.6414 15.8529 15.8860 17.0105 17.0402 18.2015 18.3993 26.0696 26.0903 k = 0.5000-0.1402 0.5132 ( 1082 PWs) bands (ev): -57.4042 -57.4042 -29.8200 -29.8114 -26.4881 -26.4734 -26.4223 -26.4206 4.6934 4.7559 9.2261 9.2528 12.0719 12.1605 12.1904 12.2394 13.5912 13.7838 14.4051 14.6008 15.8339 15.8636 17.0222 17.0537 18.2666 18.4655 26.0940 26.1156 k = 0.5000-0.1320 0.5191 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8202 -29.8112 -26.4877 -26.4723 -26.4233 -26.4213 4.6925 4.7577 9.2644 9.2931 12.0386 12.1203 12.1618 12.2166 13.6093 13.8055 14.3618 14.5608 15.8173 15.8444 17.0339 17.0671 18.3286 18.5285 26.1196 26.1421 k = 0.5000-0.1237 0.5249 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8203 -29.8110 -26.4874 -26.4711 -26.4243 -26.4220 4.6918 4.7594 9.3037 9.3345 12.0032 12.0778 12.1347 12.1950 13.6267 13.8263 14.3205 14.5220 15.8028 15.8278 17.0454 17.0804 18.3872 18.5880 26.1463 26.1695 k = 0.5000-0.1155 0.5307 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8205 -29.8108 -26.4870 -26.4698 -26.4253 -26.4226 4.6910 4.7611 9.3437 9.3766 11.9657 12.0334 12.1093 12.1745 13.6435 13.8460 14.2815 14.4847 15.7902 15.8136 17.0567 17.0934 18.4424 18.6441 26.1738 26.1976 k = 0.5000-0.1072 0.5366 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8206 -29.8107 -26.4866 -26.4686 -26.4263 -26.4233 4.6904 4.7627 9.3840 9.4193 11.9263 11.9875 12.0860 12.1552 13.6595 13.8647 14.2450 14.4492 15.7793 15.8014 17.0677 17.1060 18.4942 18.6965 26.2020 26.2264 k = 0.5000-0.0990 0.5424 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8208 -29.8105 -26.4863 -26.4674 -26.4274 -26.4239 4.6898 4.7642 9.4245 9.4621 11.8855 11.9407 12.0647 12.1371 13.6745 13.8822 14.2112 14.4159 15.7698 15.7910 17.0783 17.1182 18.5423 18.7453 26.2307 26.2555 k = 0.5000-0.0907 0.5482 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8209 -29.8104 -26.4859 -26.4662 -26.4285 -26.4245 4.6892 4.7655 9.4647 9.5048 11.8439 11.8934 12.0453 12.1202 13.6886 13.8985 14.1802 14.3848 15.7616 15.7821 17.0883 17.1297 18.5868 18.7904 26.2595 26.2846 k = 0.5000-0.0825 0.5541 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8210 -29.8102 -26.4855 -26.4649 -26.4296 -26.4251 4.6887 4.7668 9.5042 9.5468 11.8022 11.8464 12.0279 12.1047 13.7016 13.9135 14.1521 14.3563 15.7545 15.7746 17.0978 17.1406 18.6276 18.8318 26.2881 26.3135 k = 0.5000-0.0742 0.5599 ( 1078 PWs) bands (ev): -57.4042 -57.4042 -29.8211 -29.8101 -26.4852 -26.4637 -26.4307 -26.4257 4.6883 4.7680 9.5427 9.5878 11.7610 11.8002 12.0123 12.0905 13.7134 13.9273 14.1269 14.3304 15.7484 15.7681 17.1067 17.1508 18.6647 18.8693 26.3161 26.3416 k = 0.5000-0.0660 0.5657 ( 1078 PWs) bands (ev): -57.4042 -57.4042 -29.8212 -29.8100 -26.4849 -26.4626 -26.4317 -26.4262 4.6879 4.7691 9.5794 9.6271 11.7211 11.7556 11.9983 12.0777 13.7242 13.9397 14.1045 14.3071 15.7432 15.7628 17.1148 17.1601 18.6980 18.9030 26.3431 26.3687 k = 0.5000-0.0577 0.5715 ( 1074 PWs) bands (ev): -57.4042 -57.4042 -29.8213 -29.8099 -26.4846 -26.4614 -26.4327 -26.4267 4.6876 4.7701 9.6140 9.6642 11.6833 11.7134 11.9861 12.0663 13.7337 13.9507 14.0850 14.2866 15.7389 15.7584 17.1222 17.1686 18.7274 18.9327 26.3687 26.3943 k = 0.5000-0.0495 0.5774 ( 1074 PWs) bands (ev): -57.4042 -57.4042 -29.8213 -29.8098 -26.4843 -26.4603 -26.4337 -26.4271 4.6873 4.7709 9.6458 9.6985 11.6484 11.6743 11.9756 12.0563 13.7419 13.9603 14.0682 14.2688 15.7353 15.7547 17.1287 17.1760 18.7529 18.9586 26.3922 26.4177 k = 0.5000-0.0412 0.5832 ( 1074 PWs) bands (ev): -57.4042 -57.4042 -29.8214 -29.8098 -26.4840 -26.4594 -26.4346 -26.4274 4.6870 4.7716 9.6741 9.7291 11.6170 11.6394 11.9667 12.0478 13.7489 13.9685 14.0541 14.2536 15.7324 15.7519 17.1343 17.1824 18.7745 18.9804 26.4133 26.4387 k = 0.5000-0.0330 0.5890 ( 1076 PWs) bands (ev): -57.4042 -57.4042 -29.8215 -29.8097 -26.4839 -26.4585 -26.4355 -26.4278 4.6868 4.7722 9.6984 9.7554 11.5901 11.6093 11.9594 12.0408 13.7546 13.9752 14.0428 14.2413 15.7301 15.7496 17.1389 17.1877 18.7923 18.9983 26.4313 26.4566 k = 0.5000-0.0247 0.5949 ( 1076 PWs) bands (ev): -57.4042 -57.4042 -29.8215 -29.8097 -26.4837 -26.4578 -26.4361 -26.4280 4.6867 4.7727 9.7180 9.7768 11.5683 11.5849 11.9537 12.0353 13.7591 13.9805 14.0340 14.2318 15.7283 15.7478 17.1425 17.1919 18.8061 19.0123 26.4460 26.4710 k = 0.5000-0.0165 0.6007 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8097 -26.4836 -26.4572 -26.4367 -26.4282 4.6865 4.7729 9.7325 9.7926 11.5522 11.5668 11.9495 12.0313 13.7622 13.9842 14.0278 14.2249 15.7269 15.7465 17.1449 17.1947 18.8159 19.0222 26.4567 26.4816 k = 0.5000-0.0082 0.6065 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8096 -26.4835 -26.4569 -26.4370 -26.4283 4.6864 4.7731 9.7414 9.8023 11.5423 11.5558 11.9470 12.0289 13.7641 13.9865 14.0241 14.2208 15.7262 15.7458 17.1465 17.1965 18.8219 19.0282 26.4633 26.4881 k = 0.5000-0.0000 0.6124 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8096 -26.4835 -26.4568 -26.4371 -26.4283 4.6864 4.7732 9.7443 9.8055 11.5390 11.5520 11.9462 12.0281 13.7648 13.9872 14.0229 14.2195 15.7259 15.7455 17.1470 17.1971 18.8238 19.0302 26.4655 26.4903 k = 0.5000-0.0000 0.6124 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8096 -26.4835 -26.4568 -26.4371 -26.4283 4.6864 4.7732 9.7443 9.8055 11.5390 11.5520 11.9462 12.0281 13.7648 13.9872 14.0229 14.2195 15.7259 15.7455 17.1470 17.1971 18.8238 19.0302 26.4655 26.4903 k = 0.4950 0.0087 0.6124 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8096 -26.4835 -26.4568 -26.4371 -26.4283 4.6862 4.7729 9.7432 9.8043 11.5331 11.5529 11.9513 12.0334 13.7559 13.9481 14.0597 14.2265 15.7272 15.7471 17.1468 17.1986 18.8234 19.0297 26.4637 26.4888 k = 0.4900 0.0173 0.6124 ( 1079 PWs) bands (ev): -57.4042 -57.4042 -29.8215 -29.8096 -26.4835 -26.4570 -26.4368 -26.4281 4.6857 4.7723 9.7397 9.8004 11.5210 11.5522 11.9657 12.0484 13.7306 13.8928 14.1078 14.2462 15.7308 15.7520 17.1466 17.2033 18.8220 19.0280 26.4582 26.4840 k = 0.4850 0.0260 0.6124 ( 1075 PWs) bands (ev): -57.4042 -57.4042 -29.8214 -29.8096 -26.4836 -26.4573 -26.4364 -26.4279 4.6848 4.7712 9.7340 9.7940 11.5073 11.5490 11.9876 12.0712 13.6925 13.8341 14.1540 14.2747 15.7364 15.7604 17.1466 17.2111 18.8191 19.0248 26.4487 26.4758 k = 0.4800 0.0346 0.6124 ( 1075 PWs) bands (ev): -57.4042 -57.4042 -29.8214 -29.8095 -26.4837 -26.4577 -26.4359 -26.4275 4.6837 4.7697 9.7261 9.7852 11.4943 11.5447 12.0157 12.0998 13.6451 13.7731 14.1972 14.3078 15.7439 15.7723 17.1477 17.2218 18.8145 19.0196 26.4351 26.4642 k = 0.4750 0.0433 0.6124 ( 1075 PWs) bands (ev): -57.4043 -57.4043 -29.8213 -29.8095 -26.4838 -26.4582 -26.4353 -26.4271 4.6822 4.7678 9.7161 9.7740 11.4835 11.5407 12.0483 12.1327 13.5914 13.7102 14.2365 14.3423 15.7536 15.7875 17.1505 17.2355 18.8077 19.0122 26.4176 26.4489 k = 0.4700 0.0520 0.6124 ( 1079 PWs) bands (ev): -57.4043 -57.4043 -29.8212 -29.8095 -26.4840 -26.4587 -26.4346 -26.4267 4.6806 4.7657 9.7043 9.7608 11.4757 11.5383 12.0842 12.1685 13.5335 13.6459 14.2717 14.3759 15.7655 15.8056 17.1553 17.2521 18.7986 19.0023 26.3961 26.4298 k = 0.4650 0.0606 0.6124 ( 1079 PWs) bands (ev): -57.4043 -57.4043 -29.8210 -29.8094 -26.4842 -26.4593 -26.4338 -26.4261 4.6788 4.7633 9.6908 9.7457 11.4716 11.5384 12.1225 12.2065 13.4728 13.5805 14.3023 14.4070 15.7798 15.8264 17.1629 17.2718 18.7871 18.9898 26.3710 26.4072 k = 0.4600 0.0693 0.6124 ( 1077 PWs) bands (ev): -57.4043 -57.4043 -29.8209 -29.8094 -26.4844 -26.4599 -26.4331 -26.4255 4.6768 4.7607 9.6758 9.7291 11.4715 11.5414 12.1625 12.2459 13.4102 13.5144 14.3282 14.4348 15.7965 15.8494 17.1736 17.2946 18.7727 18.9744 26.3426 26.3812 k = 0.4550 0.0779 0.6124 ( 1081 PWs) bands (ev): -57.4044 -57.4044 -29.8208 -29.8093 -26.4846 -26.4605 -26.4323 -26.4249 4.6747 4.7579 9.6598 9.7112 11.4753 11.5477 12.2034 12.2858 13.3466 13.4479 14.3491 14.4584 15.8154 15.8741 17.1876 17.3205 18.7555 18.9558 26.3115 26.3520 k = 0.4500 0.0866 0.6124 ( 1081 PWs) bands (ev): -57.4044 -57.4044 -29.8206 -29.8093 -26.4849 -26.4611 -26.4315 -26.4243 4.6726 4.7550 9.6429 9.6925 11.4831 11.5573 12.2448 12.3260 13.2825 13.3814 14.3653 14.4777 15.8364 15.9000 17.2052 17.3497 18.7354 18.9342 26.2781 26.3203 k = 0.4450 0.0953 0.6124 ( 1081 PWs) bands (ev): -57.4044 -57.4044 -29.8205 -29.8092 -26.4851 -26.4617 -26.4306 -26.4236 4.6704 4.7521 9.6256 9.6733 11.4947 11.5703 12.2861 12.3660 13.2184 13.3151 14.3770 14.4926 15.8590 15.9265 17.2267 17.3821 18.7122 18.9094 26.2433 26.2864 k = 0.4400 0.1039 0.6124 ( 1087 PWs) bands (ev): -57.4044 -57.4044 -29.8203 -29.8092 -26.4854 -26.4622 -26.4299 -26.4230 4.6681 4.7491 9.6080 9.6538 11.5098 11.5863 12.3269 12.4051 13.1548 13.2493 14.3843 14.5031 15.8828 15.9529 17.2521 17.4176 18.6860 18.8813 26.2075 26.2510 k = 0.4350 0.1126 0.6124 ( 1088 PWs) bands (ev): -57.4045 -57.4045 -29.8202 -29.8092 -26.4857 -26.4628 -26.4291 -26.4223 4.6659 4.7461 9.5905 9.6344 11.5281 11.6052 12.3669 12.4432 13.0923 13.1844 14.3879 14.5097 15.9074 15.9788 17.2816 17.4564 18.6570 18.8500 26.1715 26.2149 k = 0.4300 0.1212 0.6124 ( 1086 PWs) bands (ev): -57.4045 -57.4045 -29.8200 -29.8091 -26.4859 -26.4633 -26.4283 -26.4217 4.6638 4.7432 9.5734 9.6155 11.5493 11.6266 12.4056 12.4797 13.0312 13.1209 14.3882 14.5129 15.9324 16.0036 17.3150 17.4981 18.6252 18.8157 26.1360 26.1786 k = 0.4250 0.1299 0.6124 ( 1086 PWs) bands (ev): -57.4045 -57.4045 -29.8199 -29.8091 -26.4862 -26.4638 -26.4276 -26.4211 4.6617 4.7404 9.5569 9.5974 11.5730 11.6500 12.4427 12.5141 12.9722 13.0590 14.3857 14.5131 15.9570 16.0269 17.3520 17.5424 18.5909 18.7785 26.1017 26.1429 k = 0.4200 0.1386 0.6124 ( 1080 PWs) bands (ev): -57.4045 -57.4045 -29.8197 -29.8090 -26.4864 -26.4642 -26.4270 -26.4205 4.6598 4.7377 9.5414 9.5803 11.5986 11.6751 12.4776 12.5458 12.9161 12.9994 14.3810 14.5108 15.9810 16.0482 17.3925 17.5892 18.5543 18.7385 26.0691 26.1084 k = 0.4150 0.1472 0.6124 ( 1079 PWs) bands (ev): -57.4046 -57.4046 -29.8196 -29.8090 -26.4866 -26.4646 -26.4263 -26.4200 4.6580 4.7352 9.5269 9.5643 11.6257 11.7011 12.5097 12.5738 12.8637 12.9427 14.3747 14.5067 16.0039 16.0672 17.4356 17.6375 18.5160 18.6961 26.0387 26.0757 k = 0.4100 0.1559 0.6124 ( 1079 PWs) bands (ev): -57.4046 -57.4046 -29.8195 -29.8089 -26.4868 -26.4650 -26.4258 -26.4195 4.6563 4.7329 9.5137 9.5497 11.6537 11.7274 12.5386 12.5968 12.8166 12.8900 14.3673 14.5014 16.0251 16.0837 17.4807 17.6870 18.4767 18.6517 26.0111 26.0454 k = 0.4050 0.1645 0.6124 ( 1079 PWs) bands (ev): -57.4046 -57.4046 -29.8194 -29.8089 -26.4870 -26.4653 -26.4253 -26.4191 4.6549 4.7309 9.5019 9.5368 11.6817 11.7532 12.5635 12.6127 12.7768 12.8426 14.3595 14.4953 16.0446 16.0975 17.5270 17.7366 18.4372 18.6059 25.9865 26.0178 k = 0.4000 0.1732 0.6124 ( 1077 PWs) bands (ev): -57.4046 -57.4046 -29.8193 -29.8089 -26.4872 -26.4655 -26.4249 -26.4187 4.6536 4.7291 9.4917 9.5256 11.7090 11.7776 12.5832 12.6187 12.7469 12.8034 14.3519 14.4893 16.0620 16.1087 17.5731 17.7850 18.3990 18.5594 25.9654 25.9935 k = 0.3950 0.1819 0.6124 ( 1077 PWs) bands (ev): -57.4046 -57.4046 -29.8192 -29.8089 -26.4873 -26.4658 -26.4245 -26.4184 4.6525 4.7276 9.4832 9.5162 11.7344 11.7995 12.5956 12.6139 12.7263 12.7767 14.3449 14.4835 16.0770 16.1173 17.6172 17.8303 18.3639 18.5136 25.9481 25.9729 k = 0.3900 0.1905 0.6124 ( 1077 PWs) bands (ev): -57.4046 -57.4046 -29.8192 -29.8089 -26.4874 -26.4659 -26.4242 -26.4182 4.6517 4.7264 9.4765 9.5089 11.7566 11.8177 12.5955 12.6067 12.7117 12.7649 14.3389 14.4785 16.0894 16.1233 17.6573 17.8702 18.3345 18.4701 25.9346 25.9564 k = 0.3850 0.1992 0.6124 ( 1077 PWs) bands (ev): -57.4046 -57.4046 -29.8191 -29.8089 -26.4875 -26.4661 -26.4240 -26.4180 4.6510 4.7255 9.4716 9.5035 11.7742 11.8314 12.5851 12.6021 12.7031 12.7625 14.3343 14.4747 16.0989 16.1270 17.6903 17.9016 18.3136 18.4319 25.9250 25.9442 k = 0.3800 0.2078 0.6124 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8191 -29.8088 -26.4875 -26.4661 -26.4239 -26.4179 4.6507 4.7251 9.4688 9.5004 11.7857 11.8399 12.5770 12.5964 12.6998 12.7632 14.3315 14.4724 16.1051 16.1289 17.7124 17.9216 18.3028 18.4041 25.9194 25.9368 k = 0.3750 0.2165 0.6124 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8190 -29.8088 -26.4875 -26.4662 -26.4239 -26.4178 4.6506 4.7249 9.4678 9.4993 11.7897 11.8428 12.5742 12.5938 12.6991 12.7637 14.3306 14.4716 16.1073 16.1294 17.7202 17.9284 18.2999 18.3935 25.9176 25.9343 k = 0.3750 0.2165 0.6124 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8190 -29.8088 -26.4875 -26.4662 -26.4239 -26.4178 4.6506 4.7249 9.4678 9.4993 11.7897 11.8428 12.5742 12.5938 12.6991 12.7637 14.3306 14.4716 16.1073 16.1294 17.7202 17.9284 18.2999 18.3935 25.9176 25.9343 k = 0.3699 0.2135 0.6040 ( 1069 PWs) bands (ev): -57.4047 -57.4047 -29.8189 -29.8084 -26.4872 -26.4652 -26.4239 -26.4175 4.6440 4.7196 9.5070 9.5396 11.7470 11.7999 12.4783 12.5411 12.6965 12.8118 14.2966 14.4375 16.1772 16.1928 17.6972 17.9086 18.3884 18.4838 25.9054 25.9235 k = 0.3647 0.2106 0.5956 ( 1073 PWs) bands (ev): -57.4048 -57.4048 -29.8186 -29.8081 -26.4870 -26.4643 -26.4239 -26.4170 4.6367 4.7135 9.5461 9.5796 11.7043 11.7569 12.3773 12.4422 12.7432 12.8680 14.2626 14.4033 16.2504 16.2603 17.6703 17.8842 18.4785 18.5749 25.8925 25.9118 k = 0.3596 0.2076 0.5872 ( 1073 PWs) bands (ev): -57.4049 -57.4049 -29.8184 -29.8076 -26.4867 -26.4634 -26.4237 -26.4165 4.6288 4.7067 9.5848 9.6193 11.6616 11.7138 12.2737 12.3356 12.8013 12.9302 14.2288 14.3692 16.3262 16.3310 17.6403 17.8563 18.5695 18.6667 25.8789 25.8993 k = 0.3545 0.2046 0.5788 ( 1073 PWs) bands (ev): -57.4050 -57.4050 -29.8180 -29.8072 -26.4863 -26.4627 -26.4234 -26.4159 4.6203 4.6990 9.6233 9.6586 11.6191 11.6706 12.1687 12.2267 12.8660 12.9978 14.1950 14.3351 16.4038 16.4041 17.6079 17.8258 18.6613 18.7590 25.8650 25.8864 k = 0.3493 0.2017 0.5704 ( 1077 PWs) bands (ev): -57.4051 -57.4051 -29.8177 -29.8068 -26.4860 -26.4620 -26.4229 -26.4152 4.6110 4.6903 9.6612 9.6973 11.5767 11.6273 12.0631 12.1167 12.9360 13.0704 14.1615 14.3012 16.4786 16.4824 17.5739 17.7933 18.7535 18.8515 25.8509 25.8731 k = 0.3442 0.1987 0.5620 ( 1077 PWs) bands (ev): -57.4052 -57.4052 -29.8172 -29.8063 -26.4856 -26.4613 -26.4223 -26.4144 4.6010 4.6808 9.6986 9.7354 11.5345 11.5839 11.9574 12.0065 13.0110 13.1478 14.1283 14.2676 16.5534 16.5610 17.5396 17.7601 18.8461 18.9443 25.8369 25.8597 k = 0.3390 0.1957 0.5537 ( 1073 PWs) bands (ev): -57.4053 -57.4053 -29.8168 -29.8057 -26.4851 -26.4607 -26.4215 -26.4135 4.5903 4.6704 9.7355 9.7727 11.4926 11.5403 11.8523 11.8965 13.0907 13.2298 14.0956 14.2346 16.6270 16.6384 17.5066 17.7275 18.9389 19.0373 25.8232 25.8466 k = 0.3339 0.1928 0.5453 ( 1073 PWs) bands (ev): -57.4054 -57.4054 -29.8162 -29.8052 -26.4846 -26.4601 -26.4205 -26.4125 4.5787 4.6589 9.7716 9.8094 11.4511 11.4962 11.7484 11.7870 13.1744 13.3159 14.0633 14.2019 16.6971 16.7130 17.4770 17.6971 19.0316 19.1302 25.8100 25.8339 k = 0.3288 0.1898 0.5369 ( 1073 PWs) bands (ev): -57.4056 -57.4056 -29.8156 -29.8046 -26.4841 -26.4596 -26.4195 -26.4115 4.5663 4.6464 9.8071 9.8452 11.4100 11.4510 11.6468 11.6785 13.2618 13.4055 14.0316 14.1700 16.7609 16.7828 17.4541 17.6713 19.1243 19.2229 25.7975 25.8218 k = 0.3236 0.1868 0.5285 ( 1073 PWs) bands (ev): -57.4057 -57.4057 -29.8150 -29.8040 -26.4835 -26.4591 -26.4183 -26.4103 4.5530 4.6329 9.8417 9.8801 11.3692 11.4030 11.5495 11.5711 13.3523 13.4982 14.0010 14.1390 16.8142 16.8451 17.4423 17.6530 19.2167 19.3154 25.7860 25.8106 k = 0.3185 0.1839 0.5201 ( 1077 PWs) bands (ev): -57.4059 -57.4059 -29.8143 -29.8034 -26.4828 -26.4586 -26.4170 -26.4092 4.5388 4.6183 9.8756 9.9141 11.3289 11.3481 11.4608 11.4652 13.4450 13.5927 13.9720 14.1094 16.8527 16.8967 17.4462 17.6458 19.3089 19.4075 25.7756 25.8004 k = 0.3134 0.1809 0.5117 ( 1077 PWs) bands (ev): -57.4061 -57.4061 -29.8136 -29.8027 -26.4820 -26.4581 -26.4155 -26.4079 4.5237 4.6026 9.9086 9.9473 11.2797 11.2891 11.3611 11.3877 13.5390 13.6870 13.9464 14.0819 16.8731 16.9346 17.4698 17.6534 19.4006 19.4993 25.7664 25.7915 k = 0.3082 0.1780 0.5033 ( 1081 PWs) bands (ev): -57.4063 -57.4063 -29.8128 -29.8020 -26.4811 -26.4576 -26.4141 -26.4066 4.5076 4.5858 9.9407 9.9794 11.1973 11.2485 11.2600 11.3309 13.6322 13.7736 13.9308 14.0576 16.8759 16.9569 17.5133 17.6782 19.4917 19.5903 25.7587 25.7839 k = 0.3031 0.1750 0.4949 ( 1081 PWs) bands (ev): -57.4065 -57.4065 -29.8119 -29.8013 -26.4802 -26.4570 -26.4125 -26.4052 4.4905 4.5677 9.9719 10.0106 11.1082 11.1581 11.2114 11.2834 13.7208 13.8233 13.9538 14.0402 16.8651 16.9644 17.5734 17.7199 19.5823 19.6808 25.7525 25.7779 k = 0.2979 0.1720 0.4865 ( 1081 PWs) bands (ev): -57.4067 -57.4067 -29.8110 -29.8005 -26.4791 -26.4564 -26.4108 -26.4038 4.4723 4.5485 10.0021 10.0407 11.0176 11.0604 11.1730 11.2401 13.7961 13.8205 14.0303 14.0374 16.8457 16.9600 17.6458 17.7766 19.6722 19.7706 25.7477 25.7734 k = 0.2928 0.1691 0.4782 ( 1081 PWs) bands (ev): -57.4069 -57.4069 -29.8100 -29.7997 -26.4780 -26.4557 -26.4091 -26.4023 4.4531 4.5281 10.0313 10.0697 10.9277 10.9649 11.1352 11.1991 13.8005 13.8420 14.0643 14.1235 16.8225 16.9478 17.7267 17.8451 19.7613 19.8596 25.7442 25.7704 k = 0.2877 0.1661 0.4698 ( 1077 PWs) bands (ev): -57.4072 -57.4072 -29.8090 -29.7988 -26.4767 -26.4550 -26.4073 -26.4008 4.4329 4.5065 10.0593 10.0977 10.8398 10.8722 11.0980 11.1595 13.7772 13.8532 14.1254 14.2188 16.7997 16.9318 17.8137 17.9222 19.8496 19.9476 25.7415 25.7685 k = 0.2825 0.1631 0.4614 ( 1077 PWs) bands (ev): -57.4074 -57.4074 -29.8079 -29.7979 -26.4754 -26.4542 -26.4055 -26.3993 4.4115 4.4836 10.0860 10.1244 10.7543 10.7822 11.0614 11.1209 13.7531 13.8444 14.2045 14.3117 16.7804 16.9159 17.9045 18.0055 19.9368 20.0347 25.7383 25.7665 k = 0.2774 0.1602 0.4530 ( 1077 PWs) bands (ev): -57.4077 -57.4077 -29.8067 -29.7969 -26.4739 -26.4533 -26.4036 -26.3977 4.3889 4.4594 10.1112 10.1498 10.6717 10.6952 11.0252 11.0830 13.7295 13.8279 14.2881 14.3996 16.7676 16.9032 17.9981 18.0932 20.0230 20.1207 25.7310 25.7602 k = 0.2723 0.1572 0.4446 ( 1083 PWs) bands (ev): -57.4079 -57.4079 -29.8055 -29.7960 -26.4723 -26.4523 -26.4017 -26.3961 4.3652 4.4340 10.1345 10.1738 10.5926 10.6114 10.9896 11.0458 13.7065 13.8085 14.3699 14.4803 16.7638 16.8965 18.0936 18.1837 20.1080 20.2053 25.7089 25.7337 k = 0.2671 0.1542 0.4362 ( 1083 PWs) bands (ev): -57.4082 -57.4082 -29.8043 -29.7949 -26.4706 -26.4512 -26.3998 -26.3945 4.3403 4.4072 10.1555 10.1960 10.5178 10.5312 10.9546 11.0091 13.6846 13.7883 14.4463 14.5520 16.7714 16.8983 18.1904 18.2765 20.1918 20.2889 25.6500 25.6550 k = 0.2620 0.1513 0.4278 ( 1077 PWs) bands (ev): -57.4085 -57.4085 -29.8029 -29.7938 -26.4688 -26.4500 -26.3979 -26.3928 4.3142 4.3792 10.1728 10.2159 10.4485 10.4553 10.9201 10.9731 13.6640 13.7684 14.5150 14.6129 16.7927 16.9108 18.2881 18.3708 20.2744 20.3711 25.5370 25.5488 k = 0.2568 0.1483 0.4194 ( 1077 PWs) bands (ev): -57.4088 -57.4088 -29.8016 -29.7927 -26.4668 -26.4487 -26.3959 -26.3911 4.2870 4.3499 10.1836 10.2316 10.3853 10.3876 10.8861 10.9375 13.6445 13.7490 14.5740 14.6616 16.8288 16.9358 18.3863 18.4659 20.3556 20.4519 25.4059 25.4256 k = 0.2517 0.1453 0.4110 ( 1081 PWs) bands (ev): -57.4091 -57.4091 -29.8002 -29.7916 -26.4648 -26.4473 -26.3940 -26.3894 4.2585 4.3193 10.1815 10.2358 10.3287 10.3414 10.8527 10.9024 13.6263 13.7305 14.6220 14.6973 16.8809 16.9747 18.4845 18.5614 20.4353 20.5312 25.2701 25.2934 k = 0.2466 0.1424 0.4027 ( 1081 PWs) bands (ev): -57.4095 -57.4095 -29.7987 -29.7904 -26.4626 -26.4458 -26.3920 -26.3877 4.2288 4.2874 10.1588 10.2077 10.3063 10.3180 10.8198 10.8677 13.6097 13.7132 14.6585 14.7201 16.9491 17.0282 18.5828 18.6571 20.5135 20.6089 25.1319 25.1571 k = 0.2414 0.1394 0.3943 ( 1077 PWs) bands (ev): -57.4098 -57.4098 -29.7971 -29.7891 -26.4603 -26.4442 -26.3901 -26.3860 4.1980 4.2543 10.1181 10.1548 10.3106 10.3143 10.7875 10.8335 13.5946 13.6972 14.6834 14.7307 17.0327 17.0965 18.6809 18.7528 20.5901 20.6850 24.9923 25.0184 k = 0.2363 0.1364 0.3859 ( 1077 PWs) bands (ev): -57.4101 -57.4101 -29.7956 -29.7878 -26.4579 -26.4425 -26.3881 -26.3843 4.1660 4.2200 10.0699 10.0977 10.3201 10.3207 10.7558 10.7997 13.5810 13.6826 14.6970 14.7301 17.1307 17.1791 18.7785 18.8480 20.6650 20.7594 24.8518 24.8784 k = 0.2312 0.1335 0.3775 ( 1073 PWs) bands (ev): -57.4105 -57.4105 -29.7939 -29.7865 -26.4553 -26.4406 -26.3862 -26.3826 4.1328 4.1844 10.0205 10.0421 10.3291 10.3313 10.7247 10.7664 13.5690 13.6695 14.7006 14.7199 17.2415 17.2751 18.8757 18.9429 20.7381 20.8320 24.7107 24.7375 k = 0.2260 0.1305 0.3691 ( 1073 PWs) bands (ev): -57.4109 -57.4109 -29.7923 -29.7852 -26.4527 -26.4386 -26.3843 -26.3809 4.0985 4.1478 9.9722 9.9892 10.3387 10.3407 10.6942 10.7334 13.5586 13.6578 14.6950 14.7017 17.3634 17.3833 18.9721 19.0370 20.8095 20.9027 24.5692 24.5960 k = 0.2209 0.1275 0.3607 ( 1073 PWs) bands (ev): -57.4112 -57.4112 -29.7906 -29.7838 -26.4500 -26.4366 -26.3824 -26.3793 4.0631 4.1100 9.9262 9.9394 10.3477 10.3485 10.6644 10.7009 13.5499 13.6477 14.6772 14.6820 17.4948 17.5021 19.0678 19.1304 20.8789 20.9714 24.4276 24.4542 k = 0.2158 0.1246 0.3523 ( 1077 PWs) bands (ev): -57.4116 -57.4116 -29.7889 -29.7824 -26.4471 -26.4344 -26.3805 -26.3776 4.0267 4.0711 9.8830 9.8930 10.3542 10.3555 10.6354 10.6687 13.5428 13.6391 14.6476 14.6626 17.6300 17.6341 19.1625 19.2228 20.9464 21.0382 24.2859 24.3124 k = 0.2106 0.1216 0.3439 ( 1077 PWs) bands (ev): -57.4120 -57.4120 -29.7871 -29.7809 -26.4442 -26.4321 -26.3786 -26.3759 3.9893 4.0313 9.8429 9.8500 10.3578 10.3618 10.6072 10.6370 13.5375 13.6322 14.6146 14.6385 17.7658 17.7798 19.2564 19.3142 21.0118 21.1028 24.1444 24.1707 k = 0.2055 0.1186 0.3355 ( 1077 PWs) bands (ev): -57.4124 -57.4124 -29.7853 -29.7794 -26.4412 -26.4298 -26.3768 -26.3743 3.9509 3.9906 9.8060 9.8105 10.3590 10.3663 10.5799 10.6057 13.5339 13.6270 14.5793 14.6108 17.9079 17.9306 19.3492 19.4046 21.0752 21.1654 24.0033 24.0293 k = 0.2003 0.1157 0.3272 ( 1073 PWs) bands (ev): -57.4128 -57.4128 -29.7835 -29.7779 -26.4380 -26.4273 -26.3750 -26.3726 3.9117 3.9490 9.7724 9.7744 10.3577 10.3691 10.5538 10.5750 13.5321 13.6235 14.5424 14.5806 18.0552 18.0854 19.4409 19.4937 21.1364 21.2257 23.8628 23.8884 k = 0.1952 0.1127 0.3188 ( 1073 PWs) bands (ev): -57.4132 -57.4132 -29.7817 -29.7764 -26.4348 -26.4247 -26.3732 -26.3710 3.8717 3.9066 9.7418 9.7419 10.3535 10.3698 10.5288 10.5447 13.5319 13.6216 14.5049 14.5487 18.2065 18.2430 19.5315 19.5816 21.1954 21.2838 23.7230 23.7481 k = 0.1901 0.1097 0.3104 ( 1073 PWs) bands (ev): -57.4136 -57.4136 -29.7798 -29.7748 -26.4316 -26.4221 -26.3714 -26.3694 3.8309 3.8636 9.7126 9.7147 10.3465 10.3684 10.5051 10.5150 13.5334 13.6213 14.4674 14.5159 18.3608 18.4026 19.6208 19.6680 21.2521 21.3395 23.5841 23.6088 k = 0.1849 0.1068 0.3020 ( 1075 PWs) bands (ev): -57.4140 -57.4140 -29.7780 -29.7733 -26.4282 -26.4193 -26.3697 -26.3679 3.7896 3.8200 9.6867 9.6906 10.3365 10.3647 10.4828 10.4860 13.5365 13.6226 14.4305 14.4828 18.5171 18.5633 19.7089 19.7530 21.3065 21.3929 23.4464 23.4706 k = 0.1798 0.1038 0.2936 ( 1075 PWs) bands (ev): -57.4145 -57.4145 -29.7761 -29.7717 -26.4248 -26.4165 -26.3680 -26.3664 3.7476 3.7759 9.6640 9.6697 10.3238 10.3586 10.4579 10.4617 13.5413 13.6255 14.3945 14.4500 18.6747 18.7242 19.7957 19.8365 21.3586 21.4439 23.3101 23.3338 k = 0.1747 0.1008 0.2852 ( 1075 PWs) bands (ev): -57.4149 -57.4149 -29.7742 -29.7701 -26.4214 -26.4137 -26.3664 -26.3649 3.7053 3.7314 9.6445 9.6518 10.3085 10.3500 10.4308 10.4417 13.5476 13.6300 14.3598 14.4180 18.8327 18.8845 19.8812 19.9183 21.4083 21.4925 23.1756 23.1986 k = 0.1695 0.0979 0.2768 ( 1073 PWs) bands (ev): -57.4153 -57.4153 -29.7723 -29.7684 -26.4179 -26.4107 -26.3648 -26.3634 3.6626 3.6867 9.6280 9.6367 10.2912 10.3386 10.4053 10.4225 13.5556 13.6360 14.3267 14.3869 18.9903 19.0435 19.9653 19.9984 21.4555 21.5385 23.0429 23.0652 k = 0.1644 0.0949 0.2684 ( 1073 PWs) bands (ev): -57.4157 -57.4157 -29.7704 -29.7668 -26.4144 -26.4077 -26.3632 -26.3619 3.6196 3.6418 9.6146 9.6246 10.2721 10.3239 10.3814 10.4037 13.5649 13.6434 14.2954 14.3571 19.1468 19.2003 20.0482 20.0767 21.5003 21.5821 22.9126 22.9340 k = 0.1592 0.0919 0.2600 ( 1073 PWs) bands (ev): -57.4162 -57.4162 -29.7685 -29.7652 -26.4108 -26.4047 -26.3617 -26.3605 3.5765 3.5968 9.6039 9.6151 10.2517 10.3061 10.3596 10.3849 13.5757 13.6522 14.2660 14.3288 19.3015 19.3542 20.1299 20.1530 21.5426 21.6231 22.7850 22.8054 k = 0.1541 0.0890 0.2517 ( 1073 PWs) bands (ev): -57.4166 -57.4166 -29.7666 -29.7636 -26.4073 -26.4016 -26.3602 -26.3591 3.5333 3.5519 9.5960 9.6082 10.2305 10.2855 10.3393 10.3658 13.5878 13.6623 14.2386 14.3021 19.4538 19.5042 20.2105 20.2272 21.5823 21.6616 22.6605 22.6797 k = 0.1490 0.0860 0.2433 ( 1069 PWs) bands (ev): -57.4170 -57.4170 -29.7647 -29.7620 -26.4037 -26.3985 -26.3587 -26.3578 3.4903 3.5071 9.5906 9.6038 10.2089 10.2631 10.3199 10.3463 13.6013 13.6736 14.2134 14.2772 19.6027 19.6493 20.2901 20.2992 21.6196 21.6976 22.5397 22.5573 k = 0.1438 0.0830 0.2349 ( 1069 PWs) bands (ev): -57.4174 -57.4174 -29.7629 -29.7604 -26.4001 -26.3954 -26.3573 -26.3565 3.4474 3.4627 9.5877 9.6017 10.1869 10.2397 10.3007 10.3262 13.6158 13.6861 14.1902 14.2539 19.7475 19.7882 20.3689 20.3691 21.6542 21.7310 22.4231 22.4389 k = 0.1387 0.0801 0.2265 ( 1069 PWs) bands (ev): -57.4178 -57.4178 -29.7611 -29.7588 -26.3966 -26.3923 -26.3560 -26.3552 3.4048 3.4186 9.5870 9.6017 10.1650 10.2158 10.2812 10.3055 13.6315 13.6997 14.1690 14.2324 19.8872 19.9197 20.4361 20.4481 21.6861 21.7619 22.3116 22.3250 k = 0.1336 0.0771 0.2181 ( 1061 PWs) bands (ev): -57.4182 -57.4182 -29.7592 -29.7571 -26.3930 -26.3892 -26.3547 -26.3540 3.3627 3.3750 9.5887 9.6039 10.1432 10.1920 10.2612 10.2843 13.6483 13.7144 14.1499 14.2127 20.0205 20.0419 20.5014 20.5277 21.7152 21.7903 22.2062 22.2165 k = 0.1284 0.0741 0.2097 ( 1055 PWs) bands (ev): -57.4186 -57.4186 -29.7574 -29.7556 -26.3895 -26.3860 -26.3534 -26.3528 3.3211 3.3321 9.5922 9.6079 10.1216 10.1683 10.2408 10.2625 13.6660 13.7299 14.1328 14.1948 20.1456 20.1528 20.5648 20.6088 21.7413 21.8162 22.1081 22.1141 k = 0.1233 0.0712 0.2013 ( 1055 PWs) bands (ev): -57.4190 -57.4190 -29.7557 -29.7540 -26.3860 -26.3829 -26.3522 -26.3516 3.2801 3.2899 9.5975 9.6135 10.1003 10.1450 10.2198 10.2403 13.6844 13.7461 14.1175 14.1784 20.2503 20.2597 20.6278 20.6921 21.7635 21.8396 22.0190 22.0194 k = 0.1182 0.0682 0.1929 ( 1055 PWs) bands (ev): -57.4194 -57.4194 -29.7540 -29.7525 -26.3826 -26.3799 -26.3510 -26.3505 3.2398 3.2485 9.6044 9.6207 10.0795 10.1222 10.1984 10.2178 13.7034 13.7629 14.1040 14.1636 20.3324 20.3590 20.6927 20.7782 21.7797 21.8607 21.9324 21.9437 k = 0.1130 0.0652 0.1846 ( 1059 PWs) bands (ev): -57.4198 -57.4198 -29.7524 -29.7510 -26.3793 -26.3768 -26.3499 -26.3495 3.2004 3.2080 9.6128 9.6291 10.0591 10.0999 10.1767 10.1950 13.7230 13.7803 14.0921 14.1502 20.3977 20.4384 20.7626 20.8668 21.7823 21.8557 21.8794 21.8900 k = 0.1079 0.0623 0.1762 ( 1069 PWs) bands (ev): -57.4202 -57.4202 -29.7508 -29.7496 -26.3760 -26.3739 -26.3488 -26.3485 3.1620 3.1686 9.6224 9.6388 10.0392 10.0780 10.1548 10.1721 13.7429 13.7979 14.0818 14.1382 20.4459 20.4944 20.8397 20.9568 21.7606 21.7904 21.8707 21.8959 k = 0.1027 0.0593 0.1678 ( 1069 PWs) bands (ev): -57.4205 -57.4205 -29.7492 -29.7482 -26.3728 -26.3710 -26.3478 -26.3475 3.1246 3.1303 9.6332 9.6495 10.0200 10.0570 10.1330 10.1494 13.7633 13.8160 14.0729 14.1276 20.4769 20.5266 20.9234 21.0470 21.7276 21.7378 21.8743 21.9103 k = 0.0976 0.0564 0.1594 ( 1069 PWs) bands (ev): -57.4209 -57.4209 -29.7477 -29.7468 -26.3697 -26.3681 -26.3468 -26.3466 3.0884 3.0933 9.6450 9.6611 10.0014 10.0366 10.1115 10.1270 13.7838 13.8342 14.0655 14.1182 20.4915 20.5373 21.0103 21.1358 21.6988 21.7003 21.8841 21.9227 k = 0.0925 0.0534 0.1510 ( 1059 PWs) bands (ev): -57.4212 -57.4212 -29.7462 -29.7455 -26.3667 -26.3653 -26.3459 -26.3457 3.0534 3.0576 9.6576 9.6733 9.9837 10.0170 10.0904 10.1050 13.8046 13.8526 14.0594 14.1100 20.4907 20.5303 21.0975 21.2218 21.6734 21.6837 21.8949 21.9332 k = 0.0873 0.0504 0.1426 ( 1059 PWs) bands (ev): -57.4215 -57.4215 -29.7448 -29.7442 -26.3638 -26.3626 -26.3450 -26.3448 3.0198 3.0234 9.6706 9.6860 9.9665 9.9981 10.0697 10.0835 13.8252 13.8708 14.0542 14.1026 20.4763 20.5090 21.1827 21.3041 21.6609 21.6779 21.9052 21.9419 k = 0.0822 0.0475 0.1342 ( 1063 PWs) bands (ev): -57.4218 -57.4218 -29.7435 -29.7430 -26.3610 -26.3600 -26.3442 -26.3440 2.9876 2.9906 9.6840 9.6989 9.9501 9.9798 10.0496 10.0626 13.8455 13.8887 14.0500 14.0961 20.4507 20.4767 21.2644 21.3819 21.6595 21.6816 21.9146 21.9490 k = 0.0771 0.0445 0.1258 ( 1063 PWs) bands (ev): -57.4221 -57.4221 -29.7423 -29.7418 -26.3583 -26.3575 -26.3434 -26.3433 2.9570 2.9594 9.6976 9.7119 9.9345 9.9624 10.0305 10.0425 13.8656 13.9063 14.0468 14.0904 20.4165 20.4368 21.3420 21.4547 21.6675 21.6926 21.9231 21.9545 k = 0.0719 0.0415 0.1174 ( 1067 PWs) bands (ev): -57.4224 -57.4224 -29.7411 -29.7407 -26.3558 -26.3552 -26.3427 -26.3426 2.9279 2.9299 9.7112 9.7249 9.9196 9.9456 10.0123 10.0234 13.8852 13.9233 14.0442 14.0854 20.3763 20.3918 21.4149 21.5220 21.6826 21.7089 21.9307 21.9588 k = 0.0668 0.0386 0.1091 ( 1063 PWs) bands (ev): -57.4226 -57.4226 -29.7399 -29.7396 -26.3534 -26.3529 -26.3420 -26.3419 2.9005 2.9021 9.7248 9.7376 9.9056 9.9297 9.9953 10.0055 13.9043 13.9399 14.0425 14.0811 20.3325 20.3440 21.4829 21.5837 21.7032 21.7287 21.9376 21.9620 k = 0.0616 0.0356 0.1007 ( 1063 PWs) bands (ev): -57.4229 -57.4229 -29.7389 -29.7387 -26.3512 -26.3508 -26.3414 -26.3413 2.8748 2.8761 9.7378 9.7498 9.8924 9.9146 9.9795 9.9887 13.9226 13.9557 14.0413 14.0772 20.2868 20.2953 21.5460 21.6391 21.7276 21.7504 21.9439 21.9643 k = 0.0565 0.0326 0.0923 ( 1071 PWs) bands (ev): -57.4231 -57.4231 -29.7380 -29.7378 -26.3491 -26.3488 -26.3408 -26.3408 2.8510 2.8519 9.7502 9.7613 9.8801 9.9003 9.9651 9.9732 13.9400 13.9704 14.0406 14.0737 20.2408 20.2470 21.6038 21.6879 21.7546 21.7724 21.9498 21.9659 k = 0.0514 0.0297 0.0839 ( 1067 PWs) bands (ev): -57.4233 -57.4233 -29.7370 -29.7369 -26.3472 -26.3470 -26.3403 -26.3402 2.8290 2.8297 9.7620 9.7720 9.8687 9.8869 9.9523 9.9593 13.9568 13.9845 14.0405 14.0708 20.1961 20.2005 21.6567 21.7299 21.7836 21.7941 21.9555 21.9671 k = 0.0462 0.0267 0.0755 ( 1067 PWs) bands (ev): -57.4235 -57.4235 -29.7362 -29.7361 -26.3454 -26.3453 -26.3398 -26.3398 2.8089 2.8094 9.7728 9.7817 9.8583 9.8745 9.9411 9.9469 13.9723 13.9974 14.0406 14.0681 20.1533 20.1564 21.7044 21.7653 21.8131 21.8145 21.9613 21.9684 k = 0.0411 0.0237 0.0671 ( 1069 PWs) bands (ev): -57.4237 -57.4237 -29.7355 -29.7354 -26.3439 -26.3437 -26.3394 -26.3394 2.7908 2.7912 9.7825 9.7902 9.8489 9.8630 9.9316 9.9362 13.9865 14.0090 14.0411 14.0656 20.1134 20.1155 21.7470 21.7952 21.8330 21.8409 21.9674 21.9703 k = 0.0360 0.0208 0.0587 ( 1065 PWs) bands (ev): -57.4239 -57.4239 -29.7348 -29.7348 -26.3424 -26.3424 -26.3390 -26.3390 2.7747 2.7750 9.7909 9.7974 9.8405 9.8527 9.9238 9.9274 13.9996 14.0193 14.0418 14.0634 20.0771 20.0784 21.7844 21.8208 21.8493 21.8650 21.9732 21.9739 k = 0.0308 0.0178 0.0503 ( 1067 PWs) bands (ev): -57.4240 -57.4240 -29.7343 -29.7342 -26.3412 -26.3412 -26.3387 -26.3387 2.7607 2.7608 9.7979 9.8032 9.8331 9.8434 9.9177 9.9201 14.0113 14.0282 14.0428 14.0613 20.0447 20.0455 21.8166 21.8429 21.8631 21.8836 21.9779 21.9806 k = 0.0257 0.0148 0.0419 ( 1067 PWs) bands (ev): -57.4241 -57.4241 -29.7338 -29.7338 -26.3402 -26.3401 -26.3384 -26.3384 2.7488 2.7489 9.8034 9.8076 9.8269 9.8353 9.9131 9.9146 14.0215 14.0357 14.0439 14.0593 20.0167 20.0171 21.8437 21.8617 21.8744 21.8963 21.9844 21.9876 k = 0.0205 0.0119 0.0336 ( 1067 PWs) bands (ev): -57.4242 -57.4242 -29.7334 -29.7334 -26.3393 -26.3393 -26.3382 -26.3382 2.7390 2.7390 9.8077 9.8107 9.8219 9.8285 9.9099 9.9107 14.0303 14.0417 14.0451 14.0575 19.9933 19.9936 21.8656 21.8773 21.8836 21.9037 21.9920 21.9944 k = 0.0154 0.0089 0.0252 ( 1067 PWs) bands (ev): -57.4243 -57.4243 -29.7331 -29.7331 -26.3386 -26.3386 -26.3380 -26.3380 2.7313 2.7313 9.8106 9.8128 9.8181 9.8230 9.9077 9.9081 14.0375 14.0461 14.0464 14.0557 19.9750 19.9751 21.8824 21.8895 21.8910 21.9071 21.9993 22.0006 k = 0.0103 0.0059 0.0168 ( 1067 PWs) bands (ev): -57.4243 -57.4243 -29.7329 -29.7329 -26.3382 -26.3382 -26.3379 -26.3379 2.7258 2.7258 9.8126 9.8140 9.8156 9.8188 9.9064 9.9066 14.0431 14.0478 14.0489 14.0539 19.9617 19.9617 21.8943 21.8968 21.8983 21.9079 22.0052 22.0056 k = 0.0051 0.0030 0.0084 ( 1067 PWs) bands (ev): -57.4244 -57.4244 -29.7327 -29.7327 -26.3379 -26.3379 -26.3378 -26.3378 2.7225 2.7225 9.8138 9.8144 9.8145 9.8160 9.9058 9.9058 14.0472 14.0491 14.0501 14.0521 19.9537 19.9537 21.9011 21.9018 21.9034 21.9069 22.0089 22.0089 k = 0.0000 0.0000 0.0000 ( 1067 PWs) bands (ev): -57.4244 -57.4244 -29.7327 -29.7327 -26.3378 -26.3378 -26.3378 -26.3378 2.7214 2.7214 9.8145 9.8145 9.8145 9.8145 9.9055 9.9055 14.0501 14.0501 14.0501 14.0501 19.9510 19.9510 21.9046 21.9046 21.9046 21.9046 22.0101 22.0101 k = 0.0000 0.0000 0.0000 ( 1067 PWs) bands (ev): -57.4244 -57.4244 -29.7327 -29.7327 -26.3378 -26.3378 -26.3378 -26.3378 2.7214 2.7214 9.8145 9.8145 9.8145 9.8145 9.9055 9.9055 14.0501 14.0501 14.0501 14.0501 19.9510 19.9510 21.9046 21.9046 21.9046 21.9046 22.0101 22.0101 k = 0.0083 0.0048 0.0034 ( 1067 PWs) bands (ev): -57.4244 -57.4244 -29.7327 -29.7327 -26.3379 -26.3379 -26.3378 -26.3378 2.7225 2.7225 9.8142 9.8142 9.8142 9.8160 9.9058 9.9058 14.0473 14.0496 14.0496 14.0521 19.9537 19.9537 21.9012 21.9025 21.9025 21.9072 22.0089 22.0089 k = 0.0167 0.0096 0.0068 ( 1067 PWs) bands (ev): -57.4243 -57.4243 -29.7329 -29.7329 -26.3382 -26.3382 -26.3379 -26.3379 2.7258 2.7258 9.8136 9.8136 9.8151 9.8187 9.9065 9.9065 14.0438 14.0483 14.0483 14.0535 19.9616 19.9616 21.8960 21.8960 21.8969 21.9088 22.0055 22.0055 k = 0.0250 0.0144 0.0102 ( 1067 PWs) bands (ev): -57.4243 -57.4243 -29.7331 -29.7331 -26.3387 -26.3387 -26.3380 -26.3380 2.7312 2.7312 9.8123 9.8123 9.8173 9.8227 9.9078 9.9078 14.0396 14.0461 14.0461 14.0541 19.9747 19.9747 21.8847 21.8847 21.8917 21.9094 22.0002 22.0002 k = 0.0333 0.0192 0.0136 ( 1067 PWs) bands (ev): -57.4242 -57.4242 -29.7334 -29.7334 -26.3393 -26.3393 -26.3381 -26.3381 2.7387 2.7387 9.8103 9.8103 9.8207 9.8279 9.9100 9.9100 14.0348 14.0431 14.0431 14.0540 19.9928 19.9928 21.8685 21.8685 21.8855 21.9091 21.9935 21.9935 k = 0.0417 0.0241 0.0170 ( 1067 PWs) bands (ev): -57.4241 -57.4241 -29.7338 -29.7338 -26.3402 -26.3402 -26.3383 -26.3383 2.7484 2.7484 9.8074 9.8074 9.8252 9.8342 9.9132 9.9132 14.0293 14.0392 14.0392 14.0533 20.0157 20.0157 21.8469 21.8469 21.8784 21.9078 21.9858 21.9858 k = 0.0500 0.0289 0.0204 ( 1067 PWs) bands (ev): -57.4240 -57.4240 -29.7342 -29.7342 -26.3413 -26.3413 -26.3385 -26.3385 2.7602 2.7602 9.8033 9.8033 9.8310 9.8418 9.9176 9.9176 14.0233 14.0347 14.0347 14.0520 20.0432 20.0432 21.8200 21.8200 21.8702 21.9054 21.9772 21.9772 k = 0.0583 0.0337 0.0238 ( 1067 PWs) bands (ev): -57.4239 -57.4239 -29.7348 -29.7348 -26.3425 -26.3425 -26.3388 -26.3388 2.7741 2.7741 9.7982 9.7982 9.8379 9.8504 9.9234 9.9234 14.0167 14.0294 14.0294 14.0501 20.0749 20.0749 21.7880 21.7880 21.8610 21.9017 21.9680 21.9680 k = 0.0667 0.0385 0.0272 ( 1061 PWs) bands (ev): -57.4237 -57.4237 -29.7354 -29.7354 -26.3439 -26.3439 -26.3391 -26.3391 2.7900 2.7900 9.7919 9.7919 9.8459 9.8603 9.9307 9.9307 14.0098 14.0235 14.0235 14.0478 20.1102 20.1102 21.7515 21.7515 21.8507 21.8969 21.9580 21.9580 k = 0.0750 0.0433 0.0306 ( 1067 PWs) bands (ev): -57.4235 -57.4235 -29.7361 -29.7361 -26.3456 -26.3456 -26.3394 -26.3394 2.8079 2.8079 9.7843 9.7843 9.8550 9.8711 9.9393 9.9393 14.0024 14.0170 14.0170 14.0450 20.1485 20.1485 21.7109 21.7109 21.8390 21.8906 21.9469 21.9469 k = 0.0833 0.0481 0.0340 ( 1064 PWs) bands (ev): -57.4233 -57.4233 -29.7369 -29.7369 -26.3473 -26.3473 -26.3398 -26.3398 2.8278 2.8278 9.7759 9.7759 9.8651 9.8830 9.9493 9.9493 13.9948 14.0101 14.0101 14.0419 20.1888 20.1888 21.6676 21.6676 21.8260 21.8829 21.9348 21.9348 k = 0.0917 0.0529 0.0374 ( 1061 PWs) bands (ev): -57.4231 -57.4231 -29.7378 -29.7378 -26.3493 -26.3493 -26.3402 -26.3402 2.8495 2.8495 9.7667 9.7667 9.8762 9.8958 9.9607 9.9607 13.9871 14.0029 14.0029 14.0386 20.2301 20.2301 21.6223 21.6224 21.8115 21.8735 21.9214 21.9214 k = 0.1000 0.0577 0.0408 ( 1067 PWs) bands (ev): -57.4229 -57.4229 -29.7387 -29.7387 -26.3514 -26.3514 -26.3407 -26.3407 2.8731 2.8731 9.7569 9.7569 9.8882 9.9095 9.9732 9.9732 13.9790 13.9952 13.9952 14.0348 20.2707 20.2707 21.5770 21.5770 21.7955 21.8624 21.9064 21.9064 k = 0.1083 0.0625 0.0442 ( 1064 PWs) bands (ev): -57.4227 -57.4227 -29.7397 -29.7397 -26.3536 -26.3536 -26.3412 -26.3412 2.8985 2.8985 9.7466 9.7466 9.9011 9.9242 9.9869 9.9869 13.9712 13.9875 13.9875 14.0313 20.3084 20.3084 21.5336 21.5336 21.7779 21.8496 21.8898 21.8898 k = 0.1167 0.0674 0.0476 ( 1064 PWs) bands (ev): -57.4224 -57.4224 -29.7408 -29.7408 -26.3561 -26.3561 -26.3417 -26.3417 2.9256 2.9256 9.7359 9.7359 9.9149 9.9396 10.0016 10.0016 13.9635 13.9797 13.9797 14.0277 20.3404 20.3404 21.4950 21.4950 21.7586 21.8348 21.8715 21.8715 k = 0.1250 0.0722 0.0510 ( 1064 PWs) bands (ev): -57.4221 -57.4221 -29.7419 -29.7419 -26.3586 -26.3586 -26.3422 -26.3422 2.9543 2.9543 9.7251 9.7251 9.9294 9.9558 10.0173 10.0173 13.9560 13.9719 13.9719 14.0243 20.3634 20.3634 21.4646 21.4646 21.7374 21.8180 21.8513 21.8513 k = 0.1333 0.0770 0.0544 ( 1064 PWs) bands (ev): -57.4219 -57.4219 -29.7431 -29.7431 -26.3613 -26.3613 -26.3428 -26.3428 2.9845 2.9845 9.7144 9.7145 9.9446 9.9726 10.0339 10.0339 13.9490 13.9644 13.9644 14.0211 20.3733 20.3733 21.4462 21.4462 21.7142 21.7990 21.8291 21.8291 k = 0.1417 0.0818 0.0578 ( 1064 PWs) bands (ev): -57.4216 -57.4216 -29.7443 -29.7443 -26.3641 -26.3641 -26.3434 -26.3434 3.0163 3.0163 9.7040 9.7040 9.9604 9.9900 10.0512 10.0512 13.9424 13.9572 13.9572 14.0184 20.3668 20.3668 21.4432 21.4432 21.6890 21.7777 21.8048 21.8048 k = 0.1500 0.0866 0.0612 ( 1070 PWs) bands (ev): -57.4212 -57.4212 -29.7457 -29.7457 -26.3671 -26.3671 -26.3441 -26.3441 3.0494 3.0494 9.6940 9.6940 9.9768 10.0079 10.0691 10.0691 13.9363 13.9501 13.9502 14.0159 20.3415 20.3415 21.4577 21.4577 21.6617 21.7541 21.7783 21.7783 k = 0.1583 0.0914 0.0646 ( 1067 PWs) bands (ev): -57.4209 -57.4209 -29.7470 -29.7470 -26.3701 -26.3701 -26.3447 -26.3447 3.0838 3.0838 9.6845 9.6845 9.9937 10.0263 10.0878 10.0878 13.9312 13.9440 13.9440 14.0143 20.2969 20.2970 21.4899 21.4899 21.6322 21.7281 21.7498 21.7498 k = 0.1667 0.0962 0.0680 ( 1067 PWs) bands (ev): -57.4206 -57.4206 -29.7484 -29.7484 -26.3733 -26.3733 -26.3454 -26.3454 3.1193 3.1193 9.6759 9.6759 10.0110 10.0450 10.1068 10.1068 13.9269 13.9384 13.9384 14.0134 20.2346 20.2346 21.5379 21.5379 21.6004 21.6995 21.7198 21.7198 k = 0.1750 0.1010 0.0714 ( 1067 PWs) bands (ev): -57.4202 -57.4202 -29.7499 -29.7499 -26.3765 -26.3765 -26.3461 -26.3461 3.1560 3.1560 9.6683 9.6683 10.0286 10.0640 10.1263 10.1263 13.9236 13.9336 13.9336 14.0133 20.1567 20.1567 21.5663 21.5962 21.5962 21.6684 21.6912 21.6912 k = 0.1833 0.1058 0.0748 ( 1071 PWs) bands (ev): -57.4199 -57.4199 -29.7514 -29.7514 -26.3799 -26.3799 -26.3468 -26.3468 3.1936 3.1936 9.6616 9.6616 10.0464 10.0831 10.1460 10.1460 13.9213 13.9297 13.9297 14.0141 20.0657 20.0658 21.5299 21.6275 21.6275 21.6347 21.6985 21.6985 k = 0.1917 0.1107 0.0782 ( 1065 PWs) bands (ev): -57.4195 -57.4195 -29.7529 -29.7529 -26.3833 -26.3833 -26.3475 -26.3475 3.2320 3.2320 9.6564 9.6564 10.0644 10.1024 10.1660 10.1660 13.9204 13.9269 13.9269 14.0161 19.9639 19.9639 21.4912 21.5985 21.5994 21.5994 21.7723 21.7723 k = 0.2000 0.1155 0.0816 ( 1065 PWs) bands (ev): -57.4191 -57.4191 -29.7545 -29.7545 -26.3868 -26.3868 -26.3483 -26.3483 3.2712 3.2712 9.6526 9.6526 10.0825 10.1215 10.1861 10.1861 13.9209 13.9253 13.9253 14.0192 19.8530 19.8530 21.4500 21.5595 21.5599 21.5599 21.8621 21.8621 k = 0.2083 0.1203 0.0851 ( 1071 PWs) bands (ev): -57.4188 -57.4188 -29.7561 -29.7561 -26.3903 -26.3903 -26.3491 -26.3491 3.3109 3.3109 9.6505 9.6505 10.1004 10.1405 10.2061 10.2061 13.9227 13.9248 13.9248 14.0235 19.7344 19.7345 21.4064 21.5164 21.5164 21.5178 21.9588 21.9588 k = 0.2167 0.1251 0.0885 ( 1071 PWs) bands (ev): -57.4184 -57.4184 -29.7577 -29.7577 -26.3939 -26.3939 -26.3498 -26.3498 3.3512 3.3512 9.6501 9.6501 10.1184 10.1594 10.2261 10.2261 13.9258 13.9258 13.9261 14.0292 19.6095 19.6095 21.3604 21.4699 21.4699 21.4735 22.0603 22.0603 k = 0.2250 0.1299 0.0919 ( 1071 PWs) bands (ev): -57.4180 -57.4180 -29.7593 -29.7593 -26.3975 -26.3975 -26.3506 -26.3506 3.3918 3.3918 9.6516 9.6516 10.1362 10.1781 10.2459 10.2459 13.9282 13.9282 13.9312 14.0364 19.4792 19.4792 21.3122 21.4208 21.4208 21.4267 22.1651 22.1651 k = 0.2333 0.1347 0.0953 ( 1074 PWs) bands (ev): -57.4176 -57.4176 -29.7610 -29.7610 -26.4011 -26.4011 -26.3514 -26.3514 3.4326 3.4326 9.6551 9.6551 10.1538 10.1963 10.2655 10.2655 13.9321 13.9321 13.9380 14.0449 19.3442 19.3442 21.2617 21.3691 21.3692 21.3773 22.2720 22.2720 k = 0.2417 0.1395 0.0987 ( 1074 PWs) bands (ev): -57.4172 -57.4172 -29.7626 -29.7626 -26.4048 -26.4048 -26.3522 -26.3522 3.4735 3.4735 9.6608 9.6608 10.1710 10.2142 10.2848 10.2848 13.9377 13.9377 13.9466 14.0551 19.2051 19.2052 21.2090 21.3151 21.3151 21.3255 22.3800 22.3800 k = 0.2500 0.1443 0.1021 ( 1077 PWs) bands (ev): -57.4168 -57.4168 -29.7643 -29.7643 -26.4084 -26.4084 -26.3530 -26.3530 3.5143 3.5143 9.6688 9.6688 10.1879 10.2315 10.3036 10.3036 13.9449 13.9449 13.9571 14.0669 19.0627 19.0627 21.1542 21.2588 21.2588 21.2713 22.4879 22.4879 k = 0.2583 0.1491 0.1055 ( 1077 PWs) bands (ev): -57.4164 -57.4164 -29.7660 -29.7660 -26.4121 -26.4121 -26.3538 -26.3538 3.5550 3.5550 9.6791 9.6791 10.2043 10.2482 10.3220 10.3220 13.9539 13.9539 13.9694 14.0803 18.9175 18.9175 21.0975 21.2005 21.2005 21.2149 22.5949 22.5949 k = 0.2667 0.1540 0.1089 ( 1077 PWs) bands (ev): -57.4160 -57.4160 -29.7676 -29.7676 -26.4157 -26.4157 -26.3546 -26.3546 3.5954 3.5954 9.6919 9.6919 10.2203 10.2644 10.3398 10.3398 13.9646 13.9646 13.9837 14.0954 18.7698 18.7699 21.0391 21.1402 21.1402 21.1565 22.6999 22.6999 k = 0.2750 0.1588 0.1123 ( 1077 PWs) bands (ev): -57.4156 -57.4156 -29.7693 -29.7693 -26.4193 -26.4193 -26.3554 -26.3554 3.6353 3.6353 9.7071 9.7071 10.2357 10.2798 10.3570 10.3570 13.9771 13.9771 13.9999 14.1120 18.6203 18.6203 20.9790 21.0782 21.0782 21.0961 22.8017 22.8017 k = 0.2833 0.1636 0.1157 ( 1077 PWs) bands (ev): -57.4152 -57.4152 -29.7709 -29.7709 -26.4229 -26.4229 -26.3562 -26.3562 3.6746 3.6746 9.7250 9.7250 10.2506 10.2945 10.3735 10.3735 13.9912 13.9912 14.0179 14.1303 18.4694 18.4694 20.9174 21.0146 21.0146 21.0340 22.8993 22.8993 k = 0.2917 0.1684 0.1191 ( 1077 PWs) bands (ev): -57.4148 -57.4148 -29.7725 -29.7725 -26.4265 -26.4265 -26.3569 -26.3569 3.7133 3.7133 9.7454 9.7454 10.2648 10.3084 10.3893 10.3893 14.0071 14.0071 14.0379 14.1501 18.3175 18.3175 20.8545 20.9496 20.9496 20.9704 22.9913 22.9913 k = 0.3000 0.1732 0.1225 ( 1077 PWs) bands (ev): -57.4145 -57.4145 -29.7741 -29.7741 -26.4299 -26.4299 -26.3577 -26.3577 3.7511 3.7511 9.7684 9.7684 10.2783 10.3216 10.4044 10.4044 14.0246 14.0246 14.0596 14.1715 18.1651 18.1651 20.7907 20.8835 20.8835 20.9054 23.0767 23.0767 k = 0.3083 0.1780 0.1259 ( 1077 PWs) bands (ev): -57.4141 -57.4141 -29.7757 -29.7757 -26.4334 -26.4334 -26.3585 -26.3585 3.7881 3.7881 9.7939 9.7939 10.2912 10.3339 10.4187 10.4187 14.0437 14.0437 14.0831 14.1942 18.0126 18.0126 20.7259 20.8166 20.8166 20.8393 23.1543 23.1543 k = 0.3167 0.1828 0.1293 ( 1083 PWs) bands (ev): -57.4137 -57.4137 -29.7773 -29.7773 -26.4367 -26.4367 -26.3592 -26.3592 3.8240 3.8240 9.8219 9.8220 10.3034 10.3453 10.4321 10.4321 14.0643 14.0643 14.1082 14.2183 17.8605 17.8605 20.6606 20.7489 20.7489 20.7723 23.2231 23.2231 k = 0.3250 0.1876 0.1327 ( 1083 PWs) bands (ev): -57.4134 -57.4134 -29.7788 -29.7788 -26.4400 -26.4400 -26.3599 -26.3599 3.8587 3.8587 9.8524 9.8524 10.3149 10.3559 10.4447 10.4447 14.0862 14.0862 14.1349 14.2435 17.7092 17.7092 20.5950 20.6810 20.6810 20.7048 23.2823 23.2823 k = 0.3333 0.1925 0.1361 ( 1089 PWs) bands (ev): -57.4130 -57.4130 -29.7803 -29.7803 -26.4432 -26.4432 -26.3607 -26.3607 3.8923 3.8923 9.8852 9.8852 10.3256 10.3656 10.4565 10.4565 14.1093 14.1093 14.1628 14.2697 17.5592 17.5592 20.5293 20.6129 20.6129 20.6369 23.3316 23.3316 k = 0.3417 0.1973 0.1395 ( 1083 PWs) bands (ev): -57.4127 -57.4127 -29.7817 -29.7817 -26.4462 -26.4462 -26.3613 -26.3613 3.9246 3.9246 9.9201 9.9201 10.3358 10.3746 10.4676 10.4676 14.1337 14.1337 14.1921 14.2969 17.4111 17.4111 20.4640 20.5452 20.5452 20.5691 23.3710 23.3710 k = 0.3500 0.2021 0.1429 ( 1083 PWs) bands (ev): -57.4124 -57.4124 -29.7831 -29.7831 -26.4492 -26.4492 -26.3620 -26.3620 3.9554 3.9554 9.9570 9.9570 10.3453 10.3828 10.4779 10.4779 14.1588 14.1588 14.2224 14.3248 17.2652 17.2652 20.3992 20.4779 20.4779 20.5015 23.4007 23.4007 k = 0.3583 0.2069 0.1463 ( 1077 PWs) bands (ev): -57.4120 -57.4120 -29.7844 -29.7844 -26.4521 -26.4521 -26.3626 -26.3626 3.9849 3.9849 9.9957 9.9957 10.3542 10.3902 10.4874 10.4874 14.1847 14.1847 14.2536 14.3532 17.1222 17.1222 20.3353 20.4115 20.4115 20.4345 23.4216 23.4216 k = 0.3667 0.2117 0.1497 ( 1077 PWs) bands (ev): -57.4117 -57.4117 -29.7857 -29.7857 -26.4548 -26.4548 -26.3632 -26.3632 4.0128 4.0128 10.0358 10.0358 10.3623 10.3968 10.4961 10.4961 14.2111 14.2111 14.2854 14.3818 16.9824 16.9825 20.2726 20.3463 20.3463 20.3684 23.4345 23.4345 k = 0.3750 0.2165 0.1531 ( 1077 PWs) bands (ev): -57.4115 -57.4115 -29.7869 -29.7869 -26.4574 -26.4574 -26.3637 -26.3637 4.0392 4.0392 10.0771 10.0771 10.3698 10.4027 10.5041 10.5041 14.2377 14.2377 14.3175 14.4104 16.8466 16.8466 20.2115 20.2825 20.2825 20.3035 23.4408 23.4408 k = 0.3833 0.2213 0.1565 ( 1077 PWs) bands (ev): -57.4112 -57.4112 -29.7880 -29.7880 -26.4599 -26.4599 -26.3643 -26.3643 4.0640 4.0640 10.1192 10.1192 10.3768 10.4079 10.5115 10.5115 14.2642 14.2642 14.3498 14.4388 16.7152 16.7152 20.1522 20.2206 20.2206 20.2402 23.4416 23.4416 k = 0.3917 0.2261 0.1599 ( 1071 PWs) bands (ev): -57.4109 -57.4109 -29.7891 -29.7891 -26.4622 -26.4622 -26.3648 -26.3648 4.0871 4.0871 10.1618 10.1618 10.3832 10.4125 10.5182 10.5182 14.2905 14.2905 14.3820 14.4668 16.5889 16.5889 20.0954 20.1610 20.1610 20.1789 23.4381 23.4381 k = 0.4000 0.2309 0.1633 ( 1065 PWs) bands (ev): -57.4107 -57.4107 -29.7901 -29.7901 -26.4644 -26.4644 -26.3652 -26.3652 4.1086 4.1086 10.2042 10.2042 10.3890 10.4164 10.5244 10.5244 14.3164 14.3164 14.4139 14.4940 16.4684 16.4684 20.0410 20.1039 20.1039 20.1199 23.4313 23.4313 k = 0.4083 0.2358 0.1667 ( 1071 PWs) bands (ev): -57.4104 -57.4104 -29.7911 -29.7911 -26.4664 -26.4664 -26.3657 -26.3657 4.1283 4.1283 10.2461 10.2461 10.3943 10.4196 10.5300 10.5300 14.3412 14.3412 14.4449 14.5199 16.3539 16.3539 19.9897 20.0497 20.0497 20.0635 23.4223 23.4223 k = 0.4167 0.2406 0.1701 ( 1074 PWs) bands (ev): -57.4102 -57.4102 -29.7919 -29.7919 -26.4683 -26.4683 -26.3661 -26.3661 4.1464 4.1464 10.2869 10.2869 10.3992 10.4224 10.5351 10.5351 14.3649 14.3649 14.4749 14.5446 16.2465 16.2465 19.9417 19.9988 19.9988 20.0101 23.4118 23.4118 k = 0.4250 0.2454 0.1735 ( 1074 PWs) bands (ev): -57.4101 -57.4101 -29.7927 -29.7927 -26.4700 -26.4700 -26.3665 -26.3665 4.1627 4.1627 10.3261 10.3261 10.4036 10.4246 10.5399 10.5399 14.3873 14.3873 14.5037 14.5676 16.1467 16.1467 19.8974 19.9515 19.9515 19.9601 23.4007 23.4007 k = 0.4333 0.2502 0.1769 ( 1074 PWs) bands (ev): -57.4099 -57.4099 -29.7935 -29.7935 -26.4716 -26.4716 -26.3668 -26.3668 4.1774 4.1774 10.3629 10.3629 10.4075 10.4264 10.5445 10.5445 14.4080 14.4080 14.5308 14.5886 16.0552 16.0552 19.8571 19.9081 19.9081 19.9138 23.3894 23.3894 k = 0.4417 0.2550 0.1803 ( 1074 PWs) bands (ev): -57.4097 -57.4097 -29.7941 -29.7941 -26.4729 -26.4729 -26.3671 -26.3671 4.1903 4.1903 10.3966 10.3966 10.4111 10.4277 10.5490 10.5490 14.4268 14.4268 14.5561 14.6075 15.9727 15.9727 19.8212 19.8689 19.8689 19.8715 23.3784 23.3784 k = 0.4500 0.2598 0.1837 ( 1074 PWs) bands (ev): -57.4096 -57.4096 -29.7947 -29.7947 -26.4741 -26.4741 -26.3674 -26.3674 4.2015 4.2015 10.4143 10.4266 10.4266 10.4286 10.5536 10.5536 14.4435 14.4435 14.5792 14.6238 15.8997 15.8997 19.7899 19.8337 19.8344 19.8344 23.3683 23.3683 k = 0.4583 0.2646 0.1871 ( 1074 PWs) bands (ev): -57.4095 -57.4095 -29.7952 -29.7952 -26.4751 -26.4751 -26.3676 -26.3676 4.2110 4.2110 10.4172 10.4292 10.4522 10.4522 10.5584 10.5584 14.4578 14.4578 14.5998 14.6375 15.8369 15.8369 19.7636 19.8005 19.8046 19.8046 23.3592 23.3592 k = 0.4667 0.2694 0.1905 ( 1068 PWs) bands (ev): -57.4094 -57.4094 -29.7955 -29.7955 -26.4759 -26.4759 -26.3678 -26.3678 4.2187 4.2187 10.4198 10.4294 10.4727 10.4727 10.5635 10.5635 14.4699 14.4699 14.6180 14.6484 15.7848 15.7848 19.7424 19.7722 19.7800 19.7800 23.3514 23.3514 k = 0.4750 0.2742 0.1939 ( 1068 PWs) bands (ev): -57.4093 -57.4093 -29.7958 -29.7958 -26.4766 -26.4766 -26.3679 -26.3679 4.2248 4.2248 10.4220 10.4292 10.4879 10.4879 10.5688 10.5688 14.4792 14.4792 14.6331 14.6561 15.7437 15.7437 19.7266 19.7491 19.7605 19.7605 23.3452 23.3452 k = 0.4833 0.2791 0.1973 ( 1068 PWs) bands (ev): -57.4093 -57.4093 -29.7960 -29.7960 -26.4771 -26.4771 -26.3680 -26.3680 4.2291 4.2291 10.4239 10.4288 10.4981 10.4981 10.5735 10.5735 14.4860 14.4860 14.6451 14.6606 15.7142 15.7142 19.7163 19.7314 19.7465 19.7465 23.3407 23.3407 k = 0.4917 0.2839 0.2007 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7962 -29.7962 -26.4773 -26.4773 -26.3681 -26.3681 4.2316 4.2316 10.4256 10.4280 10.5037 10.5038 10.5769 10.5769 14.4900 14.4900 14.6540 14.6617 15.6963 15.6964 19.7116 19.7191 19.7381 19.7381 23.3379 23.3379 k = 0.5000 0.2887 0.2041 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7962 -29.7962 -26.4774 -26.4774 -26.3681 -26.3681 4.2325 4.2325 10.4269 10.4269 10.5056 10.5056 10.5781 10.5781 14.4913 14.4913 14.6595 14.6595 15.6904 15.6904 19.7125 19.7125 19.7353 19.7353 23.3370 23.3370 k = 0.5000 0.2887 0.2041 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7962 -29.7962 -26.4774 -26.4774 -26.3681 -26.3681 4.2325 4.2325 10.4269 10.4269 10.5056 10.5056 10.5781 10.5781 14.4913 14.4913 14.6595 14.6595 15.6904 15.6904 19.7125 19.7125 19.7353 19.7353 23.3370 23.3370 k = 0.5030 0.2801 0.2090 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7965 -29.7960 -26.4778 -26.4771 -26.3682 -26.3682 4.2314 4.2347 10.4270 10.4270 10.5017 10.5104 10.5750 10.5818 14.4879 14.4944 14.6594 14.6594 15.6851 15.6937 19.7103 19.7107 19.7332 19.7362 23.3399 23.3406 k = 0.5060 0.2715 0.2138 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7968 -29.7958 -26.4781 -26.4767 -26.3684 -26.3684 4.2315 4.2381 10.4268 10.4274 10.4991 10.5161 10.5728 10.5863 14.4840 14.4968 14.6590 14.6592 15.6780 15.6952 19.7032 19.7058 19.7310 19.7351 23.3494 23.3508 k = 0.5089 0.2629 0.2187 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7971 -29.7957 -26.4784 -26.4763 -26.3687 -26.3687 4.2328 4.2426 10.4258 10.4276 10.4984 10.5223 10.5719 10.5916 14.4798 14.4986 14.6582 14.6590 15.6690 15.6950 19.6912 19.6982 19.7285 19.7315 23.3654 23.3675 k = 0.5119 0.2543 0.2236 ( 1070 PWs) bands (ev): -57.4091 -57.4091 -29.7975 -29.7956 -26.4788 -26.4759 -26.3692 -26.3692 4.2352 4.2483 10.4230 10.4272 10.5002 10.5290 10.5730 10.5982 14.4750 14.4996 14.6568 14.6588 15.6583 15.6932 19.6749 19.6879 19.7253 19.7254 23.3878 23.3905 k = 0.5149 0.2457 0.2284 ( 1070 PWs) bands (ev): -57.4091 -57.4091 -29.7979 -29.7955 -26.4791 -26.4755 -26.3698 -26.3698 4.2388 4.2551 10.4176 10.4255 10.5050 10.5362 10.5771 10.6063 14.4697 14.4994 14.6549 14.6586 15.6462 15.6902 19.6547 19.6748 19.7171 19.7209 23.4165 23.4200 k = 0.5179 0.2371 0.2333 ( 1074 PWs) bands (ev): -57.4090 -57.4090 -29.7984 -29.7955 -26.4794 -26.4751 -26.3706 -26.3705 4.2434 4.2629 10.4093 10.4215 10.5131 10.5441 10.5846 10.6160 14.4635 14.4980 14.6522 14.6581 15.6330 15.6863 19.6307 19.6586 19.7067 19.7153 23.4516 23.4556 k = 0.5208 0.2285 0.2381 ( 1078 PWs) bands (ev): -57.4090 -57.4090 -29.7989 -29.7956 -26.4797 -26.4746 -26.3715 -26.3714 4.2491 4.2718 10.3982 10.4147 10.5242 10.5536 10.5954 10.6278 14.4564 14.4952 14.6487 14.6575 15.6190 15.6818 19.6032 19.6390 19.6946 19.7081 23.4926 23.4972 k = 0.5238 0.2199 0.2430 ( 1078 PWs) bands (ev): -57.4089 -57.4089 -29.7994 -29.7956 -26.4799 -26.4742 -26.3725 -26.3723 4.2558 4.2816 10.3844 10.4047 10.5382 10.5654 10.6093 10.6417 14.4482 14.4910 14.6443 14.6562 15.6050 15.6772 19.5723 19.6160 19.6810 19.6995 23.5397 23.5448 k = 0.5268 0.2114 0.2479 ( 1078 PWs) bands (ev): -57.4088 -57.4088 -29.7999 -29.7957 -26.4802 -26.4737 -26.3736 -26.3734 4.2636 4.2925 10.3683 10.3917 10.5547 10.5800 10.6259 10.6578 14.4386 14.4853 14.6386 14.6537 15.5913 15.6730 19.5380 19.5893 19.6658 19.6893 23.5926 23.5981 k = 0.5298 0.2028 0.2527 ( 1078 PWs) bands (ev): -57.4087 -57.4087 -29.8005 -29.7959 -26.4804 -26.4733 -26.3748 -26.3746 4.2723 4.3042 10.3500 10.3759 10.5736 10.5973 10.6449 10.6762 14.4274 14.4781 14.6316 14.6494 15.5787 15.6697 19.5004 19.5591 19.6492 19.6775 23.6510 23.6569 k = 0.5327 0.1942 0.2576 ( 1082 PWs) bands (ev): -57.4086 -57.4086 -29.8011 -29.7961 -26.4807 -26.4728 -26.3762 -26.3758 4.2818 4.3168 10.3297 10.3575 10.5948 10.6174 10.6663 10.6969 14.4142 14.4696 14.6231 14.6425 15.5680 15.6677 19.4596 19.5254 19.6311 19.6640 23.7147 23.7210 k = 0.5357 0.1856 0.2624 ( 1080 PWs) bands (ev): -57.4085 -57.4085 -29.8017 -29.7963 -26.4809 -26.4723 -26.3776 -26.3772 4.2923 4.3302 10.3077 10.3371 10.6182 10.6400 10.6899 10.7201 14.3989 14.4597 14.6130 14.6323 15.5599 15.6676 19.4157 19.4882 19.6115 19.6487 23.7836 23.7901 k = 0.5387 0.1770 0.2673 ( 1078 PWs) bands (ev): -57.4084 -57.4084 -29.8023 -29.7965 -26.4811 -26.4718 -26.3792 -26.3786 4.3035 4.3442 10.2841 10.3149 10.6438 10.6651 10.7158 10.7456 14.3810 14.4486 14.6014 14.6182 15.5552 15.6699 19.3688 19.4477 19.5903 19.6317 23.8572 23.8639 k = 0.5417 0.1684 0.2722 ( 1078 PWs) bands (ev): -57.4083 -57.4083 -29.8030 -29.7968 -26.4813 -26.4713 -26.3808 -26.3802 4.3154 4.3590 10.2592 10.2910 10.6715 10.6925 10.7440 10.7734 14.3601 14.4362 14.5883 14.5996 15.5543 15.6748 19.3189 19.4040 19.5674 19.6128 23.9355 23.9422 k = 0.5446 0.1598 0.2770 ( 1082 PWs) bands (ev): -57.4081 -57.4081 -29.8037 -29.7971 -26.4815 -26.4708 -26.3826 -26.3818 4.3279 4.3743 10.2330 10.2656 10.7012 10.7220 10.7744 10.8035 14.3360 14.4226 14.5738 14.5762 15.5579 15.6827 19.2661 19.3571 19.5427 19.5919 24.0179 24.0246 k = 0.5476 0.1512 0.2819 ( 1082 PWs) bands (ev): -57.4080 -57.4080 -29.8044 -29.7974 -26.4817 -26.4703 -26.3844 -26.3834 4.3411 4.3901 10.2057 10.2391 10.7333 10.7538 10.8072 10.8360 14.3081 14.4075 14.5481 14.5584 15.5662 15.6938 19.2105 19.3071 19.5162 19.5692 24.1042 24.1108 k = 0.5506 0.1426 0.2867 ( 1082 PWs) bands (ev): -57.4079 -57.4079 -29.8051 -29.7978 -26.4819 -26.4697 -26.3863 -26.3851 4.3548 4.4063 10.1775 10.2115 10.7675 10.7876 10.8423 10.8707 14.2763 14.3905 14.5158 14.5424 15.5792 15.7081 19.1523 19.2542 19.4880 19.5445 24.1940 24.2004 k = 0.5536 0.1340 0.2916 ( 1080 PWs) bands (ev): -57.4077 -57.4077 -29.8058 -29.7982 -26.4821 -26.4692 -26.3882 -26.3869 4.3689 4.4229 10.1485 10.1831 10.8039 10.8233 10.8799 10.9076 14.2403 14.3707 14.4806 14.5262 15.5968 15.7257 19.0914 19.1986 19.4580 19.5178 24.2869 24.2929 k = 0.5565 0.1254 0.2965 ( 1080 PWs) bands (ev): -57.4076 -57.4076 -29.8066 -29.7986 -26.4822 -26.4687 -26.3903 -26.3886 4.3833 4.4397 10.1189 10.1540 10.8425 10.8608 10.9200 10.9466 14.1999 14.3458 14.4449 14.5100 15.6187 15.7464 19.0281 19.1402 19.4261 19.4890 24.3825 24.3880 k = 0.5595 0.1168 0.3013 ( 1082 PWs) bands (ev): -57.4074 -57.4074 -29.8073 -29.7991 -26.4824 -26.4682 -26.3923 -26.3905 4.3981 4.4567 10.0887 10.1242 10.8832 10.8999 10.9627 10.9879 14.1551 14.3128 14.4123 14.4942 15.6446 15.7700 18.9623 19.0793 19.3922 19.4583 24.4802 24.4851 k = 0.5625 0.1083 0.3062 ( 1081 PWs) bands (ev): -57.4073 -57.4073 -29.8081 -29.7995 -26.4826 -26.4676 -26.3944 -26.3923 4.4130 4.4738 10.0581 10.0939 10.9261 10.9405 11.0082 11.0313 14.1062 14.2698 14.3855 14.4789 15.6741 15.7964 18.8944 19.0160 19.3565 19.4254 24.5796 24.5836 k = 0.5655 0.0997 0.3110 ( 1081 PWs) bands (ev): -57.4071 -57.4071 -29.8088 -29.8000 -26.4828 -26.4671 -26.3965 -26.3941 4.4281 4.4909 10.0273 10.0634 10.9709 10.9823 11.0565 11.0770 14.0533 14.2176 14.3639 14.4644 15.7067 15.8251 18.8244 18.9505 19.3189 19.3906 24.6801 24.6831 k = 0.5685 0.0911 0.3159 ( 1081 PWs) bands (ev): -57.4069 -57.4069 -29.8096 -29.8005 -26.4830 -26.4666 -26.3987 -26.3959 4.4432 4.5079 9.9962 10.0325 11.0175 11.0252 11.1078 11.1249 13.9968 14.1588 14.3458 14.4507 15.7420 15.8559 18.7525 18.8831 19.2794 19.3537 24.7810 24.7829 k = 0.5714 0.0825 0.3208 ( 1081 PWs) bands (ev): -57.4068 -57.4068 -29.8103 -29.8010 -26.4832 -26.4661 -26.4008 -26.3977 4.4582 4.5248 9.9651 10.0016 11.0657 11.0689 11.1622 11.1754 13.9369 14.0950 14.3299 14.4380 15.7795 15.8884 18.6789 18.8140 19.2381 19.3148 24.8816 24.8823 k = 0.5744 0.0739 0.3256 ( 1079 PWs) bands (ev): -57.4066 -57.4066 -29.8110 -29.8015 -26.4833 -26.4657 -26.4029 -26.3995 4.4732 4.5414 9.9341 9.9707 11.1134 11.1151 11.2197 11.2286 13.8741 14.0275 14.3156 14.4263 15.8187 15.9223 18.6040 18.7434 19.1949 19.2739 24.9805 24.9813 k = 0.5774 0.0653 0.3305 ( 1079 PWs) bands (ev): -57.4065 -57.4065 -29.8117 -29.8020 -26.4836 -26.4652 -26.4050 -26.4013 4.4880 4.5578 9.9031 9.9398 11.1584 11.1654 11.2805 11.2847 13.8087 13.9570 14.3027 14.4157 15.8591 15.9568 18.5279 18.6718 19.1500 19.2312 25.0768 25.0793 k = 0.5804 0.0567 0.3353 ( 1081 PWs) bands (ev): -57.4063 -57.4063 -29.8124 -29.8025 -26.4838 -26.4648 -26.4071 -26.4030 4.5025 4.5737 9.8724 9.9090 11.2037 11.2161 11.3440 11.3444 13.7409 13.8841 14.2910 14.4062 15.9002 15.9918 18.4511 18.5996 19.1034 19.1866 25.1705 25.1747 k = 0.5833 0.0481 0.3402 ( 1083 PWs) bands (ev): -57.4061 -57.4061 -29.8131 -29.8031 -26.4840 -26.4644 -26.4091 -26.4046 4.5168 4.5891 9.8419 9.8785 11.2492 11.2669 11.4067 11.4115 13.6712 13.8092 14.2805 14.3980 15.9416 16.0266 18.3740 18.5271 19.0552 19.1402 25.2607 25.2668 k = 0.5863 0.0395 0.3451 ( 1083 PWs) bands (ev): -57.4060 -57.4060 -29.8138 -29.8036 -26.4842 -26.4641 -26.4111 -26.4062 4.5306 4.6040 9.8118 9.8483 11.2947 11.3174 11.4730 11.4819 13.5999 13.7328 14.2715 14.3913 15.9826 16.0607 18.2972 18.4551 19.0055 19.0922 25.3467 25.3547 k = 0.5893 0.0309 0.3499 ( 1079 PWs) bands (ev): -57.4058 -57.4058 -29.8144 -29.8041 -26.4845 -26.4638 -26.4129 -26.4077 4.5440 4.6184 9.7821 9.8184 11.3400 11.3673 11.5429 11.5555 13.5273 13.6553 14.2640 14.3860 16.0228 16.0934 18.2212 18.3841 18.9545 19.0428 25.4277 25.4376 k = 0.5923 0.0223 0.3548 ( 1081 PWs) bands (ev): -57.4057 -57.4057 -29.8150 -29.8046 -26.4847 -26.4636 -26.4147 -26.4091 4.5568 4.6320 9.7528 9.7890 11.3848 11.4163 11.6164 11.6322 13.4536 13.5767 14.2580 14.3823 16.0613 16.1241 18.1467 18.3148 18.9021 18.9919 25.5031 25.5148 k = 0.5952 0.0137 0.3596 ( 1083 PWs) bands (ev): -57.4056 -57.4056 -29.8156 -29.8051 -26.4850 -26.4635 -26.4163 -26.4105 4.5691 4.6450 9.7240 9.7600 11.4291 11.4643 11.6934 11.7120 13.3791 13.4976 14.2536 14.3802 16.0974 16.1520 18.0746 18.2480 18.8486 18.9396 25.5723 25.5858 k = 0.5982 0.0052 0.3645 ( 1087 PWs) bands (ev): -57.4054 -57.4054 -29.8162 -29.8056 -26.4853 -26.4634 -26.4178 -26.4117 4.5808 4.6571 9.6957 9.7314 11.4725 11.5111 11.7737 11.7948 13.3041 13.4180 14.2512 14.3800 16.1303 16.1762 18.0057 18.1847 18.7942 18.8863 25.6351 25.6501 k = 0.6012-0.0034 0.3694 ( 1083 PWs) bands (ev): -57.4053 -57.4053 -29.8167 -29.8061 -26.4856 -26.4634 -26.4192 -26.4128 4.5918 4.6685 9.6680 9.7034 11.5150 11.5565 11.8573 11.8805 13.2289 13.3385 14.2507 14.3817 16.1589 16.1959 17.9413 18.1261 18.7391 18.8322 25.6913 25.7075 k = 0.6042-0.0120 0.3742 ( 1083 PWs) bands (ev): -57.4052 -57.4052 -29.8171 -29.8065 -26.4859 -26.4635 -26.4204 -26.4138 4.6021 4.6790 9.6409 9.6759 11.5561 11.6003 11.9438 11.9691 13.1535 13.2590 14.2524 14.3853 16.1823 16.2101 17.8826 18.0730 18.6834 18.7773 25.7407 25.7580 k = 0.6071-0.0206 0.3791 ( 1080 PWs) bands (ev): -57.4051 -57.4051 -29.8175 -29.8069 -26.4861 -26.4636 -26.4214 -26.4148 4.6116 4.6886 9.6144 9.6491 11.5958 11.6422 12.0332 12.0602 13.0785 13.1800 14.2563 14.3911 16.1993 16.2180 17.8308 18.0266 18.6273 18.7219 25.7836 25.8015 k = 0.6101-0.0292 0.3839 ( 1080 PWs) bands (ev): -57.4050 -57.4050 -29.8179 -29.8073 -26.4864 -26.4639 -26.4222 -26.4156 4.6203 4.6972 9.5885 9.6227 11.6336 11.6820 12.1249 12.1537 13.0039 13.1017 14.2625 14.3991 16.2089 16.2187 17.7872 17.9879 18.5712 18.6662 25.8201 25.8384 k = 0.6131-0.0378 0.3888 ( 1080 PWs) bands (ev): -57.4049 -57.4049 -29.8183 -29.8077 -26.4867 -26.4642 -26.4229 -26.4162 4.6282 4.7048 9.5632 9.5969 11.6696 11.7196 12.2187 12.2493 12.9301 13.0246 14.2711 14.4092 16.2102 16.2117 17.7529 17.9577 18.5152 18.6106 25.8505 25.8690 k = 0.6161-0.0464 0.3937 ( 1076 PWs) bands (ev): -57.4048 -57.4048 -29.8185 -29.8080 -26.4869 -26.4646 -26.4234 -26.4168 4.6352 4.7114 9.5384 9.5717 11.7033 11.7546 12.3137 12.3464 12.8576 12.9492 14.2823 14.4215 16.1968 16.2027 17.7289 17.9367 18.4597 18.5551 25.8751 25.8935 k = 0.6190-0.0550 0.3985 ( 1075 PWs) bands (ev): -57.4047 -57.4047 -29.8188 -29.8083 -26.4872 -26.4651 -26.4237 -26.4173 4.6413 4.7170 9.5143 9.5470 11.7347 11.7870 12.4087 12.4439 12.7873 12.8767 14.2959 14.4361 16.1740 16.1863 17.7155 17.9249 18.4051 18.5003 25.8943 25.9124 k = 0.6220-0.0636 0.4034 ( 1069 PWs) bands (ev): -57.4047 -57.4047 -29.8189 -29.8086 -26.4873 -26.4656 -26.4239 -26.4176 4.6464 4.7215 9.4908 9.5229 11.7636 11.8164 12.5002 12.5378 12.7233 12.8103 14.3121 14.4528 16.1439 16.1616 17.7129 17.9224 18.3517 18.4463 25.9084 25.9259 k = 0.6250-0.0722 0.4082 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8190 -29.8088 -26.4875 -26.4662 -26.4239 -26.4178 4.6506 4.7249 9.4678 9.4993 11.7897 11.8428 12.5742 12.5938 12.6991 12.7637 14.3306 14.4716 16.1073 16.1294 17.7202 17.9284 18.2999 18.3935 25.9176 25.9343 k = 0.6250-0.0722 0.4082 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8190 -29.8088 -26.4875 -26.4662 -26.4239 -26.4178 4.6506 4.7249 9.4678 9.4993 11.7897 11.8428 12.5742 12.5938 12.6991 12.7637 14.3306 14.4716 16.1073 16.1294 17.7202 17.9284 18.2999 18.3935 25.9176 25.9343 k = 0.6200-0.0693 0.4164 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8191 -29.8088 -26.4875 -26.4661 -26.4239 -26.4179 4.6507 4.7251 9.4688 9.5004 11.7857 11.8399 12.5770 12.5964 12.6998 12.7632 14.3315 14.4724 16.1051 16.1289 17.7124 17.9216 18.3028 18.4042 25.9194 25.9368 k = 0.6150-0.0664 0.4246 ( 1077 PWs) bands (ev): -57.4046 -57.4046 -29.8191 -29.8089 -26.4875 -26.4661 -26.4240 -26.4180 4.6510 4.7256 9.4716 9.5035 11.7742 11.8314 12.5851 12.6021 12.7031 12.7625 14.3343 14.4747 16.0989 16.1270 17.6903 17.9016 18.3137 18.4319 25.9250 25.9442 k = 0.6100-0.0635 0.4327 ( 1077 PWs) bands (ev): -57.4046 -57.4046 -29.8192 -29.8089 -26.4874 -26.4659 -26.4242 -26.4182 4.6517 4.7264 9.4765 9.5089 11.7566 11.8177 12.5955 12.6067 12.7117 12.7649 14.3389 14.4785 16.0894 16.1233 17.6573 17.8702 18.3345 18.4701 25.9346 25.9564 k = 0.6050-0.0606 0.4409 ( 1077 PWs) bands (ev): -57.4046 -57.4046 -29.8192 -29.8089 -26.4873 -26.4658 -26.4245 -26.4184 4.6525 4.7276 9.4832 9.5162 11.7344 11.7995 12.5956 12.6139 12.7263 12.7767 14.3449 14.4835 16.0770 16.1173 17.6172 17.8303 18.3639 18.5136 25.9481 25.9729 k = 0.6000-0.0577 0.4491 ( 1077 PWs) bands (ev): -57.4046 -57.4046 -29.8193 -29.8089 -26.4872 -26.4655 -26.4249 -26.4187 4.6536 4.7291 9.4917 9.5256 11.7090 11.7776 12.5832 12.6187 12.7469 12.8034 14.3519 14.4893 16.0620 16.1087 17.5731 17.7850 18.3990 18.5595 25.9654 25.9935 k = 0.5950-0.0548 0.4572 ( 1079 PWs) bands (ev): -57.4046 -57.4046 -29.8194 -29.8089 -26.4870 -26.4653 -26.4253 -26.4191 4.6549 4.7309 9.5019 9.5368 11.6817 11.7532 12.5635 12.6127 12.7769 12.8426 14.3595 14.4953 16.0446 16.0975 17.5270 17.7366 18.4372 18.6059 25.9865 26.0178 k = 0.5900-0.0520 0.4654 ( 1079 PWs) bands (ev): -57.4046 -57.4046 -29.8195 -29.8089 -26.4868 -26.4650 -26.4258 -26.4195 4.6563 4.7329 9.5137 9.5497 11.6537 11.7274 12.5386 12.5968 12.8166 12.8899 14.3673 14.5014 16.0251 16.0837 17.4808 17.6870 18.4767 18.6517 26.0111 26.0454 k = 0.5850-0.0491 0.4736 ( 1079 PWs) bands (ev): -57.4046 -57.4046 -29.8196 -29.8090 -26.4866 -26.4646 -26.4263 -26.4200 4.6580 4.7352 9.5269 9.5643 11.6257 11.7011 12.5097 12.5738 12.8638 12.9427 14.3747 14.5067 16.0039 16.0672 17.4356 17.6375 18.5160 18.6961 26.0387 26.0757 k = 0.5800-0.0462 0.4817 ( 1080 PWs) bands (ev): -57.4045 -57.4045 -29.8197 -29.8090 -26.4864 -26.4642 -26.4270 -26.4205 4.6598 4.7377 9.5414 9.5803 11.5986 11.6751 12.4776 12.5458 12.9161 12.9994 14.3810 14.5108 15.9810 16.0482 17.3925 17.5892 18.5543 18.7385 26.0691 26.1084 k = 0.5750-0.0433 0.4899 ( 1086 PWs) bands (ev): -57.4045 -57.4045 -29.8199 -29.8091 -26.4862 -26.4638 -26.4276 -26.4211 4.6617 4.7404 9.5569 9.5974 11.5730 11.6500 12.4427 12.5141 12.9722 13.0590 14.3857 14.5131 15.9570 16.0269 17.3520 17.5424 18.5909 18.7785 26.1017 26.1429 k = 0.5700-0.0404 0.4981 ( 1086 PWs) bands (ev): -57.4045 -57.4045 -29.8200 -29.8091 -26.4859 -26.4633 -26.4283 -26.4217 4.6638 4.7432 9.5734 9.6155 11.5493 11.6266 12.4056 12.4797 13.0312 13.1209 14.3882 14.5129 15.9324 16.0036 17.3150 17.4981 18.6252 18.8157 26.1360 26.1786 k = 0.5650-0.0375 0.5062 ( 1088 PWs) bands (ev): -57.4045 -57.4045 -29.8202 -29.8092 -26.4857 -26.4628 -26.4291 -26.4223 4.6659 4.7461 9.5905 9.6344 11.5281 11.6052 12.3669 12.4432 13.0923 13.1844 14.3879 14.5097 15.9074 15.9788 17.2816 17.4564 18.6570 18.8500 26.1715 26.2149 k = 0.5600-0.0346 0.5144 ( 1087 PWs) bands (ev): -57.4044 -57.4044 -29.8203 -29.8092 -26.4854 -26.4622 -26.4299 -26.4230 4.6681 4.7491 9.6080 9.6538 11.5098 11.5863 12.3269 12.4051 13.1548 13.2493 14.3843 14.5031 15.8828 15.9528 17.2521 17.4176 18.6860 18.8813 26.2075 26.2510 k = 0.5550-0.0318 0.5226 ( 1081 PWs) bands (ev): -57.4044 -57.4044 -29.8205 -29.8092 -26.4851 -26.4617 -26.4306 -26.4236 4.6704 4.7521 9.6256 9.6733 11.4947 11.5703 12.2861 12.3660 13.2184 13.3151 14.3770 14.4926 15.8590 15.9264 17.2267 17.3821 18.7122 18.9094 26.2433 26.2864 k = 0.5500-0.0289 0.5307 ( 1081 PWs) bands (ev): -57.4044 -57.4044 -29.8206 -29.8093 -26.4849 -26.4611 -26.4315 -26.4243 4.6726 4.7550 9.6429 9.6925 11.4831 11.5573 12.2448 12.3260 13.2825 13.3814 14.3653 14.4777 15.8364 15.9000 17.2052 17.3497 18.7354 18.9342 26.2781 26.3203 k = 0.5450-0.0260 0.5389 ( 1081 PWs) bands (ev): -57.4044 -57.4044 -29.8208 -29.8093 -26.4846 -26.4605 -26.4323 -26.4249 4.6747 4.7579 9.6598 9.7112 11.4753 11.5477 12.2034 12.2858 13.3466 13.4479 14.3491 14.4584 15.8154 15.8741 17.1876 17.3205 18.7555 18.9558 26.3115 26.3520 k = 0.5400-0.0231 0.5471 ( 1077 PWs) bands (ev): -57.4043 -57.4043 -29.8209 -29.8094 -26.4844 -26.4599 -26.4331 -26.4255 4.6768 4.7607 9.6758 9.7291 11.4715 11.5414 12.1625 12.2459 13.4102 13.5144 14.3282 14.4348 15.7965 15.8494 17.1736 17.2946 18.7727 18.9744 26.3426 26.3812 k = 0.5350-0.0202 0.5552 ( 1079 PWs) bands (ev): -57.4043 -57.4043 -29.8210 -29.8094 -26.4842 -26.4593 -26.4338 -26.4261 4.6788 4.7633 9.6908 9.7457 11.4716 11.5383 12.1225 12.2065 13.4728 13.5805 14.3023 14.4070 15.7798 15.8264 17.1629 17.2718 18.7871 18.9898 26.3710 26.4072 k = 0.5300-0.0173 0.5634 ( 1079 PWs) bands (ev): -57.4043 -57.4043 -29.8212 -29.8095 -26.4840 -26.4587 -26.4346 -26.4267 4.6806 4.7657 9.7043 9.7608 11.4757 11.5383 12.0842 12.1685 13.5335 13.6459 14.2717 14.3759 15.7655 15.8056 17.1553 17.2521 18.7986 19.0024 26.3961 26.4298 k = 0.5250-0.0144 0.5715 ( 1075 PWs) bands (ev): -57.4043 -57.4043 -29.8213 -29.8095 -26.4838 -26.4582 -26.4353 -26.4271 4.6822 4.7678 9.7161 9.7740 11.4835 11.5407 12.0483 12.1327 13.5914 13.7102 14.2366 14.3423 15.7536 15.7875 17.1505 17.2355 18.8077 19.0122 26.4176 26.4489 k = 0.5200-0.0115 0.5797 ( 1075 PWs) bands (ev): -57.4042 -57.4042 -29.8214 -29.8095 -26.4837 -26.4577 -26.4359 -26.4275 4.6837 4.7697 9.7261 9.7852 11.4943 11.5447 12.0157 12.0998 13.6451 13.7730 14.1972 14.3078 15.7439 15.7723 17.1477 17.2218 18.8145 19.0196 26.4351 26.4642 k = 0.5150-0.0087 0.5879 ( 1075 PWs) bands (ev): -57.4042 -57.4042 -29.8214 -29.8096 -26.4836 -26.4573 -26.4364 -26.4279 4.6848 4.7712 9.7340 9.7940 11.5073 11.5490 11.9876 12.0712 13.6925 13.8341 14.1541 14.2747 15.7364 15.7604 17.1466 17.2111 18.8191 19.0248 26.4487 26.4758 k = 0.5100-0.0058 0.5960 ( 1079 PWs) bands (ev): -57.4042 -57.4042 -29.8215 -29.8096 -26.4835 -26.4570 -26.4368 -26.4281 4.6857 4.7723 9.7397 9.8004 11.5210 11.5522 11.9657 12.0484 13.7306 13.8927 14.1078 14.2462 15.7308 15.7520 17.1466 17.2033 18.8220 19.0280 26.4582 26.4840 k = 0.5050-0.0029 0.6042 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8096 -26.4835 -26.4568 -26.4371 -26.4283 4.6862 4.7729 9.7432 9.8043 11.5331 11.5529 11.9513 12.0334 13.7559 13.9481 14.0597 14.2265 15.7272 15.7471 17.1468 17.1986 18.8234 19.0297 26.4637 26.4888 k = 0.5000-0.0000 0.6124 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8096 -26.4835 -26.4568 -26.4371 -26.4283 4.6864 4.7732 9.7443 9.8055 11.5390 11.5520 11.9462 12.0281 13.7648 13.9872 14.0229 14.2195 15.7259 15.7455 17.1470 17.1971 18.8238 19.0302 26.4655 26.4903 k = 0.5000-0.0000 0.6124 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8096 -26.4835 -26.4568 -26.4371 -26.4283 4.6864 4.7732 9.7443 9.8055 11.5390 11.5520 11.9462 12.0281 13.7648 13.9872 14.0229 14.2195 15.7259 15.7455 17.1470 17.1971 18.8238 19.0302 26.4655 26.4903 k = 0.5000 0.0059 0.6040 ( 1084 PWs) bands (ev): -57.4042 -57.4042 -29.8216 -29.8096 -26.4835 -26.4568 -26.4371 -26.4283 4.6860 4.7727 9.7450 9.8062 11.5242 11.5487 11.9561 12.0384 13.7474 13.9248 14.0802 14.2325 15.7284 15.7484 17.1472 17.2007 18.8251 19.0313 26.4641 26.4893 k = 0.5000 0.0118 0.5957 ( 1082 PWs) bands (ev): -57.4042 -57.4042 -29.8215 -29.8095 -26.4835 -26.4568 -26.4369 -26.4281 4.6847 4.7714 9.7469 9.8082 11.4914 11.5312 11.9841 12.0667 13.7008 13.8432 14.1465 14.2662 15.7357 15.7568 17.1484 17.2109 18.8290 19.0348 26.4599 26.4863 k = 0.5000 0.0177 0.5874 ( 1074 PWs) bands (ev): -57.4043 -57.4043 -29.8213 -29.8094 -26.4835 -26.4569 -26.4365 -26.4277 4.6826 4.7692 9.7503 9.8116 11.4493 11.5003 12.0258 12.1077 13.6348 13.7574 14.2075 14.3109 15.7471 15.7707 17.1520 17.2270 18.8355 19.0406 26.4527 26.4810 k = 0.5000 0.0236 0.5790 ( 1072 PWs) bands (ev): -57.4043 -57.4043 -29.8212 -29.8093 -26.4835 -26.4570 -26.4360 -26.4272 4.6796 4.7660 9.7548 9.8162 11.4021 11.4607 12.0766 12.1564 13.5576 13.6690 14.2625 14.3590 15.7615 15.7892 17.1592 17.2483 18.8443 19.0485 26.4423 26.4729 k = 0.5000 0.0295 0.5707 ( 1072 PWs) bands (ev): -57.4043 -57.4043 -29.8210 -29.8091 -26.4835 -26.4572 -26.4354 -26.4266 4.6757 4.7620 9.7605 9.8221 11.3524 11.4160 12.1328 12.2090 13.4741 13.5795 14.3113 14.4063 15.7781 15.8113 17.1712 17.2749 18.8555 19.0584 26.4282 26.4616 k = 0.5000 0.0353 0.5624 ( 1074 PWs) bands (ev): -57.4044 -57.4044 -29.8208 -29.8089 -26.4835 -26.4574 -26.4347 -26.4259 4.6711 4.7571 9.7675 9.8293 11.3018 11.3688 12.1917 12.2627 13.3878 13.4904 14.3540 14.4507 15.7957 15.8353 17.1889 17.3069 18.8688 19.0703 26.4100 26.4465 k = 0.5000 0.0412 0.5541 ( 1080 PWs) bands (ev): -57.4045 -57.4045 -29.8205 -29.8087 -26.4836 -26.4576 -26.4338 -26.4251 4.6655 4.7513 9.7757 9.8376 11.2512 11.3206 12.2512 12.3146 13.3015 13.4040 14.3911 14.4911 15.8133 15.8598 17.2131 17.3446 18.8840 19.0839 26.3870 26.4267 k = 0.5000 0.0471 0.5457 ( 1080 PWs) bands (ev): -57.4045 -57.4045 -29.8202 -29.8084 -26.4836 -26.4579 -26.4328 -26.4242 4.6592 4.7446 9.7852 9.8472 11.2013 11.2723 12.3087 12.3617 13.2181 13.3232 14.4228 14.5273 15.8298 15.8831 17.2448 17.3885 18.9013 19.0993 26.3586 26.4013 k = 0.5000 0.0530 0.5374 ( 1076 PWs) bands (ev): -57.4046 -57.4046 -29.8198 -29.8081 -26.4836 -26.4582 -26.4316 -26.4231 4.6522 4.7371 9.7957 9.8580 11.1525 11.2247 12.3613 12.3997 13.1410 13.2519 14.4499 14.5592 15.8443 15.9040 17.2844 17.4387 18.9203 19.1162 26.3238 26.3694 k = 0.5000 0.0589 0.5291 ( 1074 PWs) bands (ev): -57.4047 -57.4047 -29.8194 -29.8078 -26.4836 -26.4585 -26.4303 -26.4220 4.6443 4.7288 9.8075 9.8700 11.1051 11.1781 12.4041 12.4233 13.0751 13.1958 14.4726 14.5870 15.8556 15.9212 17.3320 17.4951 18.9408 19.1345 26.2818 26.3299 k = 0.5000 0.0648 0.5207 ( 1074 PWs) bands (ev): -57.4048 -57.4048 -29.8190 -29.8074 -26.4836 -26.4589 -26.4289 -26.4208 4.6356 4.7196 9.8203 9.8831 11.0592 11.1327 12.4264 12.4308 13.0270 13.1608 14.4916 14.6109 15.8633 15.9340 17.3876 17.5577 18.9626 19.1539 26.2321 26.2821 k = 0.5000 0.0707 0.5124 ( 1074 PWs) bands (ev): -57.4049 -57.4049 -29.8185 -29.8071 -26.4836 -26.4593 -26.4274 -26.4195 4.6263 4.7096 9.8342 9.8972 11.0151 11.0889 12.4068 12.4329 13.0038 13.1510 14.5074 14.6314 15.8668 15.9423 17.4508 17.6262 18.9856 19.1744 26.1741 26.2253 k = 0.5000 0.0766 0.5041 ( 1074 PWs) bands (ev): -57.4050 -57.4050 -29.8180 -29.8066 -26.4836 -26.4598 -26.4257 -26.4181 4.6162 4.6989 9.8491 9.9124 10.9728 11.0468 12.3646 12.4076 13.0088 13.1657 14.5204 14.6488 15.8662 15.9459 17.5209 17.6999 19.0095 19.1957 26.1076 26.1593 k = 0.5000 0.0825 0.4957 ( 1076 PWs) bands (ev): -57.4052 -57.4052 -29.8175 -29.8062 -26.4836 -26.4602 -26.4240 -26.4167 4.6055 4.6874 9.8650 9.9285 10.9324 11.0064 12.3050 12.3583 13.0386 13.2002 14.5309 14.6635 15.8613 15.9451 17.5970 17.7782 19.0343 19.2177 26.0329 26.0843 k = 0.5000 0.0884 0.4874 ( 1082 PWs) bands (ev): -57.4053 -57.4053 -29.8170 -29.8058 -26.4836 -26.4607 -26.4222 -26.4152 4.5941 4.6751 9.8817 9.9455 10.8940 10.9679 12.2338 12.2924 13.0857 13.2488 14.5393 14.6758 15.8524 15.9403 17.6782 17.8604 19.0597 19.2403 25.9504 26.0008 k = 0.5000 0.0943 0.4791 ( 1084 PWs) bands (ev): -57.4054 -57.4054 -29.8164 -29.8053 -26.4835 -26.4612 -26.4203 -26.4136 4.5821 4.6622 9.8993 9.9634 10.8576 10.9314 12.1554 12.2163 13.1438 13.3069 14.5460 14.6861 15.8401 15.9320 17.7635 17.9459 19.0856 19.2633 25.8610 25.9098 k = 0.5000 0.1002 0.4707 ( 1080 PWs) bands (ev): -57.4056 -57.4056 -29.8158 -29.8049 -26.4835 -26.4617 -26.4182 -26.4120 4.5696 4.6486 9.9178 9.9820 10.8233 10.8968 12.0730 12.1347 13.2088 13.3715 14.5512 14.6946 15.8246 15.9208 17.8521 18.0338 19.1120 19.2866 25.7655 25.8123 k = 0.5000 0.1060 0.4624 ( 1080 PWs) bands (ev): -57.4057 -57.4057 -29.8151 -29.8044 -26.4834 -26.4622 -26.4162 -26.4103 4.5566 4.6345 9.9369 10.0014 10.7910 10.8642 11.9886 12.0502 13.2776 13.4399 14.5551 14.7015 15.8066 15.9072 17.9429 18.1234 19.1386 19.3101 25.6650 25.7096 k = 0.5000 0.1119 0.4541 ( 1080 PWs) bands (ev): -57.4059 -57.4059 -29.8145 -29.8039 -26.4833 -26.4627 -26.4141 -26.4086 4.5431 4.6197 9.9568 10.0214 10.7607 10.8336 11.9037 11.9646 13.3488 13.5109 14.5580 14.7071 15.7865 15.8915 18.0351 18.2139 19.1653 19.3336 25.5605 25.6027 k = 0.5000 0.1178 0.4457 ( 1078 PWs) bands (ev): -57.4060 -57.4060 -29.8138 -29.8033 -26.4833 -26.4633 -26.4119 -26.4068 4.5292 4.6045 9.9772 10.0419 10.7325 10.8050 11.8191 11.8791 13.4212 13.5833 14.5599 14.7115 15.7648 15.8744 18.1280 18.3048 19.1921 19.3571 25.4531 25.4927 k = 0.5000 0.1237 0.4374 ( 1078 PWs) bands (ev): -57.4062 -57.4062 -29.8131 -29.8028 -26.4832 -26.4638 -26.4097 -26.4050 4.5150 4.5888 9.9981 10.0629 10.7062 10.7784 11.7356 11.7944 13.4939 13.6562 14.5610 14.7148 15.7420 15.8561 18.2209 18.3954 19.2189 19.3804 25.3435 25.3806 k = 0.5000 0.1296 0.4291 ( 1078 PWs) bands (ev): -57.4063 -57.4063 -29.8124 -29.8023 -26.4831 -26.4643 -26.4075 -26.4032 4.5004 4.5726 10.0194 10.0843 10.6819 10.7537 11.6535 11.7110 13.5664 13.7291 14.5615 14.7172 15.7187 15.8372 18.3133 18.4851 19.2454 19.4035 25.2327 25.2672 k = 0.5000 0.1355 0.4207 ( 1078 PWs) bands (ev): -57.4065 -57.4065 -29.8117 -29.8018 -26.4830 -26.4649 -26.4053 -26.4013 4.4856 4.5562 10.0411 10.1061 10.6595 10.7309 11.5734 11.6294 13.6381 13.8012 14.5615 14.7187 15.6951 15.8179 18.4045 18.5736 19.2718 19.4263 25.1214 25.1534 k = 0.5000 0.1414 0.4124 ( 1076 PWs) bands (ev): -57.4066 -57.4066 -29.8109 -29.8013 -26.4829 -26.4654 -26.4031 -26.3994 4.4706 4.5395 10.0631 10.1280 10.6390 10.7099 11.4953 11.5499 13.7086 13.8722 14.5611 14.7196 15.6720 15.7986 18.4943 18.6603 19.2978 19.4486 25.0102 25.0397 k = 0.5000 0.1473 0.4041 ( 1076 PWs) bands (ev): -57.4068 -57.4068 -29.8102 -29.8008 -26.4828 -26.4660 -26.4008 -26.3976 4.4555 4.5225 10.0853 10.1500 10.6203 10.6908 11.4197 11.4728 13.7776 13.9414 14.5604 14.7197 15.6495 15.7797 18.5821 18.7449 19.3235 19.4705 24.8997 24.9269 k = 0.5000 0.1532 0.3958 ( 1080 PWs) bands (ev): -57.4070 -57.4070 -29.8095 -29.8003 -26.4827 -26.4666 -26.3986 -26.3957 4.4404 4.5054 10.1075 10.1720 10.6033 10.6733 11.3465 11.3981 13.8445 14.0086 14.5595 14.7191 15.6280 15.7612 18.6676 18.8270 19.3488 19.4918 24.7903 24.8153 k = 0.5000 0.1591 0.3874 ( 1080 PWs) bands (ev): -57.4071 -57.4071 -29.8087 -29.7999 -26.4825 -26.4671 -26.3964 -26.3938 4.4252 4.4882 10.1298 10.1940 10.5880 10.6576 11.2760 11.3260 13.9092 14.0732 14.5586 14.7180 15.6082 15.7438 18.7506 18.9064 19.3737 19.5126 24.6827 24.7055 k = 0.5000 0.1650 0.3791 ( 1080 PWs) bands (ev): -57.4073 -57.4073 -29.8080 -29.7994 -26.4824 -26.4677 -26.3943 -26.3919 4.4102 4.4710 10.1519 10.2157 10.5743 10.6434 11.2083 11.2568 13.9713 14.1347 14.5577 14.7164 15.5902 15.7276 18.8308 18.9828 19.3980 19.5327 24.5772 24.5980 k = 0.5000 0.1708 0.3708 ( 1084 PWs) bands (ev): -57.4074 -57.4074 -29.8072 -29.7990 -26.4823 -26.4682 -26.3922 -26.3901 4.3953 4.4539 10.1738 10.2371 10.5620 10.6308 11.1435 11.1904 14.0304 14.1926 14.5572 14.7142 15.5745 15.7128 18.9080 19.0559 19.4218 19.5521 24.4741 24.4930 k = 0.5000 0.1767 0.3624 ( 1084 PWs) bands (ev): -57.4076 -57.4076 -29.8065 -29.7985 -26.4821 -26.4687 -26.3901 -26.3883 4.3807 4.4369 10.1955 10.2582 10.5513 10.6195 11.0817 11.1271 14.0864 14.2465 14.5571 14.7116 15.5613 15.6997 18.9821 19.1257 19.4451 19.5708 24.3738 24.3909 k = 0.5000 0.1826 0.3541 ( 1084 PWs) bands (ev): -57.4077 -57.4077 -29.8058 -29.7981 -26.4820 -26.4693 -26.3881 -26.3865 4.3664 4.4202 10.2168 10.2786 10.5418 10.6096 11.0229 11.0668 14.1388 14.2957 14.5578 14.7085 15.5511 15.6885 19.0529 19.1919 19.4677 19.5886 24.2767 24.2922 k = 0.5000 0.1885 0.3458 ( 1084 PWs) bands (ev): -57.4079 -57.4079 -29.8050 -29.7978 -26.4818 -26.4698 -26.3861 -26.3848 4.3525 4.4037 10.2377 10.2985 10.5336 10.6009 10.9672 11.0098 14.1875 14.3399 14.5596 14.7050 15.5440 15.6791 19.1204 19.2545 19.4897 19.6056 24.1830 24.1969 k = 0.5000 0.1944 0.3374 ( 1084 PWs) bands (ev): -57.4080 -57.4080 -29.8043 -29.7974 -26.4816 -26.4703 -26.3842 -26.3831 4.3390 4.3877 10.2580 10.3176 10.5266 10.5933 10.9147 10.9559 14.2323 14.3782 14.5628 14.7012 15.5400 15.6718 19.1843 19.3132 19.5110 19.6216 24.0930 24.1056 k = 0.5000 0.2003 0.3291 ( 1084 PWs) bands (ev): -57.4082 -57.4082 -29.8036 -29.7971 -26.4814 -26.4708 -26.3824 -26.3815 4.3260 4.3720 10.2777 10.3358 10.5206 10.5866 10.8654 10.9055 14.2730 14.4103 14.5681 14.6970 15.5393 15.6666 19.2448 19.3681 19.5316 19.6368 24.0070 24.0183 k = 0.5000 0.2062 0.3208 ( 1080 PWs) bands (ev): -57.4083 -57.4083 -29.8029 -29.7968 -26.4812 -26.4714 -26.3807 -26.3799 4.3137 4.3569 10.2967 10.3529 10.5156 10.5809 10.8195 10.8585 14.3095 14.4358 14.5756 14.6925 15.5419 15.6635 19.3018 19.4191 19.5515 19.6509 23.9252 23.9354 k = 0.5000 0.2121 0.3124 ( 1080 PWs) bands (ev): -57.4084 -57.4084 -29.8023 -29.7965 -26.4811 -26.4719 -26.3790 -26.3784 4.3020 4.3424 10.3147 10.3688 10.5115 10.5758 10.7768 10.8150 14.3418 14.4549 14.5854 14.6879 15.5474 15.6623 19.3552 19.4662 19.5706 19.6640 23.8479 23.8570 k = 0.5000 0.2180 0.3041 ( 1078 PWs) bands (ev): -57.4085 -57.4085 -29.8016 -29.7962 -26.4808 -26.4724 -26.3775 -26.3770 4.2910 4.3285 10.3319 10.3832 10.5083 10.5712 10.7377 10.7751 14.3700 14.4687 14.5966 14.6832 15.5556 15.6629 19.4050 19.5092 19.5888 19.6760 23.7752 23.7834 k = 0.5000 0.2239 0.2958 ( 1078 PWs) bands (ev): -57.4086 -57.4086 -29.8010 -29.7960 -26.4806 -26.4728 -26.3760 -26.3757 4.2807 4.3154 10.3480 10.3959 10.5059 10.5670 10.7020 10.7390 14.3940 14.4784 14.6082 14.6786 15.5660 15.6650 19.4512 19.5481 19.6063 19.6869 23.7075 23.7148 k = 0.5000 0.2298 0.2874 ( 1076 PWs) bands (ev): -57.4087 -57.4087 -29.8004 -29.7959 -26.4804 -26.4733 -26.3747 -26.3744 4.2714 4.3030 10.3631 10.4068 10.5042 10.5630 10.6701 10.7069 14.4142 14.4852 14.6192 14.6743 15.5782 15.6683 19.4939 19.5829 19.6232 19.6967 23.6448 23.6515 k = 0.5000 0.2357 0.2791 ( 1076 PWs) bands (ev): -57.4088 -57.4088 -29.7999 -29.7957 -26.4801 -26.4738 -26.3735 -26.3733 4.2628 4.2915 10.3769 10.4155 10.5031 10.5589 10.6421 10.6787 14.4306 14.4903 14.6290 14.6703 15.5916 15.6725 19.5330 19.6130 19.6396 19.7053 23.5875 23.5935 k = 0.5000 0.2415 0.2708 ( 1074 PWs) bands (ev): -57.4089 -57.4089 -29.7993 -29.7956 -26.4799 -26.4742 -26.3724 -26.3722 4.2553 4.2808 10.3894 10.4220 10.5023 10.5545 10.6183 10.6548 14.4439 14.4942 14.6373 14.6669 15.6057 15.6771 19.5685 19.6377 19.6565 19.7127 23.5357 23.5410 k = 0.5000 0.2474 0.2624 ( 1074 PWs) bands (ev): -57.4090 -57.4090 -29.7988 -29.7956 -26.4796 -26.4747 -26.3714 -26.3713 4.2487 4.2711 10.4004 10.4263 10.5017 10.5493 10.5993 10.6351 14.4544 14.4970 14.6440 14.6641 15.6199 15.6819 19.6003 19.6564 19.6745 19.7189 23.4895 23.4942 k = 0.5000 0.2533 0.2541 ( 1076 PWs) bands (ev): -57.4090 -57.4090 -29.7983 -29.7955 -26.4794 -26.4751 -26.3705 -26.3705 4.2431 4.2624 10.4096 10.4286 10.5007 10.5432 10.5855 10.6194 14.4627 14.4989 14.6493 14.6620 15.6337 15.6864 19.6286 19.6705 19.6919 19.7240 23.4492 23.4532 k = 0.5000 0.2592 0.2458 ( 1074 PWs) bands (ev): -57.4091 -57.4091 -29.7979 -29.7956 -26.4791 -26.4755 -26.3698 -26.3698 4.2386 4.2547 10.4169 10.4294 10.4995 10.5363 10.5770 10.6075 14.4695 14.4997 14.6532 14.6606 15.6468 15.6904 19.6532 19.6821 19.7068 19.7279 23.4149 23.4183 k = 0.5000 0.2651 0.2375 ( 1072 PWs) bands (ev): -57.4091 -57.4091 -29.7975 -29.7956 -26.4788 -26.4759 -26.3692 -26.3692 4.2351 4.2480 10.4221 10.4291 10.4983 10.5292 10.5728 10.5984 14.4751 14.4996 14.6560 14.6598 15.6588 15.6933 19.6739 19.6919 19.7184 19.7310 23.3867 23.3895 k = 0.5000 0.2710 0.2291 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7971 -29.7957 -26.4784 -26.4763 -26.3687 -26.3687 4.2328 4.2425 10.4253 10.4284 10.4980 10.5223 10.5718 10.5916 14.4799 14.4986 14.6578 14.6594 15.6693 15.6950 19.6907 19.7000 19.7263 19.7334 23.3648 23.3669 k = 0.5000 0.2769 0.2208 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7968 -29.7958 -26.4781 -26.4767 -26.3684 -26.3684 4.2315 4.2380 10.4266 10.4276 10.4991 10.5160 10.5728 10.5862 14.4841 14.4968 14.6589 14.6593 15.6782 15.6952 19.7030 19.7064 19.7307 19.7354 23.3491 23.3505 k = 0.5000 0.2828 0.2125 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7965 -29.7960 -26.4778 -26.4771 -26.3682 -26.3682 4.2314 4.2347 10.4269 10.4271 10.5017 10.5104 10.5750 10.5818 14.4879 14.4943 14.6594 14.6594 15.6852 15.6937 19.7103 19.7108 19.7332 19.7362 23.3399 23.3406 k = 0.5000 0.2887 0.2041 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7962 -29.7962 -26.4774 -26.4774 -26.3681 -26.3681 4.2325 4.2325 10.4269 10.4269 10.5056 10.5056 10.5781 10.5781 14.4913 14.4913 14.6595 14.6595 15.6904 15.6904 19.7125 19.7125 19.7353 19.7353 23.3370 23.3370 k = 0.5000 0.2887 0.2041 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7962 -29.7962 -26.4774 -26.4774 -26.3681 -26.3681 4.2325 4.2325 10.4269 10.4269 10.5056 10.5056 10.5781 10.5781 14.4913 14.4913 14.6595 14.6595 15.6904 15.6904 19.7125 19.7125 19.7353 19.7353 23.3370 23.3370 k = 0.4970 0.2870 0.2138 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7965 -29.7960 -26.4778 -26.4771 -26.3682 -26.3682 4.2314 4.2347 10.4270 10.4270 10.5017 10.5104 10.5750 10.5818 14.4879 14.4944 14.6594 14.6594 15.6851 15.6937 19.7103 19.7107 19.7332 19.7362 23.3399 23.3406 k = 0.4940 0.2852 0.2236 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7968 -29.7958 -26.4781 -26.4767 -26.3684 -26.3684 4.2315 4.2381 10.4268 10.4274 10.4991 10.5161 10.5728 10.5863 14.4840 14.4968 14.6590 14.6592 15.6780 15.6952 19.7032 19.7058 19.7310 19.7351 23.3494 23.3508 k = 0.4911 0.2835 0.2333 ( 1068 PWs) bands (ev): -57.4092 -57.4092 -29.7971 -29.7957 -26.4784 -26.4763 -26.3687 -26.3687 4.2328 4.2426 10.4258 10.4276 10.4984 10.5224 10.5719 10.5916 14.4798 14.4986 14.6582 14.6590 15.6690 15.6950 19.6912 19.6982 19.7285 19.7315 23.3654 23.3675 k = 0.4881 0.2818 0.2430 ( 1070 PWs) bands (ev): -57.4091 -57.4091 -29.7975 -29.7956 -26.4788 -26.4759 -26.3692 -26.3692 4.2352 4.2483 10.4230 10.4272 10.5002 10.5290 10.5730 10.5982 14.4750 14.4996 14.6568 14.6588 15.6583 15.6932 19.6749 19.6879 19.7253 19.7254 23.3878 23.3905 k = 0.4851 0.2801 0.2527 ( 1070 PWs) bands (ev): -57.4091 -57.4091 -29.7979 -29.7955 -26.4791 -26.4755 -26.3698 -26.3698 4.2388 4.2551 10.4176 10.4255 10.5050 10.5362 10.5771 10.6063 14.4697 14.4994 14.6549 14.6586 15.6462 15.6902 19.6547 19.6748 19.7171 19.7209 23.4165 23.4200 k = 0.4821 0.2784 0.2624 ( 1074 PWs) bands (ev): -57.4090 -57.4090 -29.7984 -29.7955 -26.4794 -26.4751 -26.3706 -26.3705 4.2434 4.2629 10.4093 10.4215 10.5131 10.5441 10.5846 10.6160 14.4635 14.4980 14.6522 14.6581 15.6330 15.6863 19.6308 19.6586 19.7067 19.7152 23.4516 23.4556 k = 0.4792 0.2766 0.2722 ( 1078 PWs) bands (ev): -57.4090 -57.4090 -29.7989 -29.7956 -26.4797 -26.4746 -26.3715 -26.3714 4.2491 4.2718 10.3982 10.4147 10.5242 10.5536 10.5954 10.6278 14.4564 14.4952 14.6487 14.6575 15.6190 15.6818 19.6032 19.6390 19.6946 19.7081 23.4926 23.4972 k = 0.4762 0.2749 0.2819 ( 1078 PWs) bands (ev): -57.4089 -57.4089 -29.7994 -29.7956 -26.4799 -26.4742 -26.3725 -26.3723 4.2558 4.2816 10.3844 10.4047 10.5382 10.5654 10.6093 10.6417 14.4482 14.4910 14.6443 14.6562 15.6050 15.6772 19.5723 19.6160 19.6810 19.6995 23.5397 23.5448 k = 0.4732 0.2732 0.2916 ( 1078 PWs) bands (ev): -57.4088 -57.4088 -29.7999 -29.7957 -26.4802 -26.4737 -26.3736 -26.3734 4.2636 4.2925 10.3683 10.3917 10.5547 10.5800 10.6259 10.6578 14.4386 14.4853 14.6386 14.6537 15.5913 15.6730 19.5380 19.5893 19.6658 19.6893 23.5926 23.5981 k = 0.4702 0.2715 0.3013 ( 1078 PWs) bands (ev): -57.4087 -57.4087 -29.8005 -29.7959 -26.4804 -26.4733 -26.3748 -26.3746 4.2723 4.3042 10.3500 10.3759 10.5736 10.5973 10.6449 10.6762 14.4274 14.4781 14.6316 14.6494 15.5787 15.6697 19.5004 19.5591 19.6492 19.6775 23.6510 23.6569 k = 0.4673 0.2698 0.3110 ( 1082 PWs) bands (ev): -57.4086 -57.4086 -29.8011 -29.7961 -26.4807 -26.4728 -26.3762 -26.3758 4.2818 4.3168 10.3297 10.3575 10.5948 10.6174 10.6663 10.6969 14.4142 14.4696 14.6231 14.6425 15.5680 15.6677 19.4596 19.5254 19.6311 19.6639 23.7147 23.7210 k = 0.4643 0.2681 0.3208 ( 1080 PWs) bands (ev): -57.4085 -57.4085 -29.8017 -29.7963 -26.4809 -26.4723 -26.3776 -26.3772 4.2923 4.3302 10.3077 10.3371 10.6182 10.6400 10.6899 10.7201 14.3989 14.4597 14.6130 14.6323 15.5599 15.6676 19.4157 19.4882 19.6115 19.6487 23.7836 23.7901 k = 0.4613 0.2663 0.3305 ( 1078 PWs) bands (ev): -57.4084 -57.4084 -29.8023 -29.7965 -26.4811 -26.4718 -26.3792 -26.3786 4.3035 4.3442 10.2841 10.3149 10.6438 10.6651 10.7158 10.7456 14.3810 14.4486 14.6014 14.6182 15.5552 15.6699 19.3688 19.4477 19.5903 19.6317 23.8572 23.8639 k = 0.4583 0.2646 0.3402 ( 1078 PWs) bands (ev): -57.4083 -57.4083 -29.8030 -29.7968 -26.4813 -26.4713 -26.3808 -26.3802 4.3154 4.3590 10.2592 10.2910 10.6715 10.6925 10.7440 10.7734 14.3601 14.4362 14.5883 14.5996 15.5543 15.6748 19.3189 19.4040 19.5674 19.6128 23.9355 23.9422 k = 0.4554 0.2629 0.3499 ( 1082 PWs) bands (ev): -57.4081 -57.4081 -29.8037 -29.7971 -26.4815 -26.4708 -26.3826 -26.3818 4.3279 4.3743 10.2330 10.2656 10.7012 10.7221 10.7744 10.8035 14.3360 14.4226 14.5738 14.5762 15.5579 15.6827 19.2661 19.3571 19.5427 19.5919 24.0179 24.0246 k = 0.4524 0.2612 0.3596 ( 1082 PWs) bands (ev): -57.4080 -57.4080 -29.8044 -29.7974 -26.4817 -26.4703 -26.3844 -26.3834 4.3411 4.3901 10.2057 10.2391 10.7333 10.7538 10.8072 10.8360 14.3081 14.4075 14.5481 14.5584 15.5662 15.6938 19.2105 19.3071 19.5162 19.5692 24.1042 24.1108 k = 0.4494 0.2595 0.3694 ( 1082 PWs) bands (ev): -57.4079 -57.4079 -29.8051 -29.7978 -26.4819 -26.4697 -26.3863 -26.3851 4.3548 4.4063 10.1775 10.2115 10.7675 10.7876 10.8423 10.8707 14.2763 14.3905 14.5158 14.5424 15.5792 15.7081 19.1523 19.2542 19.4880 19.5445 24.1940 24.2004 k = 0.4464 0.2577 0.3791 ( 1080 PWs) bands (ev): -57.4077 -57.4077 -29.8058 -29.7982 -26.4821 -26.4692 -26.3882 -26.3869 4.3689 4.4229 10.1485 10.1831 10.8039 10.8233 10.8799 10.9076 14.2403 14.3707 14.4806 14.5262 15.5968 15.7257 19.0914 19.1986 19.4580 19.5178 24.2869 24.2929 k = 0.4435 0.2560 0.3888 ( 1080 PWs) bands (ev): -57.4076 -57.4076 -29.8066 -29.7986 -26.4822 -26.4687 -26.3903 -26.3886 4.3833 4.4397 10.1189 10.1540 10.8425 10.8608 10.9200 10.9467 14.1999 14.3458 14.4449 14.5100 15.6187 15.7464 19.0281 19.1403 19.4260 19.4890 24.3825 24.3880 k = 0.4405 0.2543 0.3985 ( 1082 PWs) bands (ev): -57.4074 -57.4074 -29.8073 -29.7991 -26.4824 -26.4682 -26.3923 -26.3905 4.3981 4.4567 10.0887 10.1242 10.8832 10.8999 10.9627 10.9879 14.1551 14.3128 14.4123 14.4942 15.6446 15.7700 18.9623 19.0793 19.3922 19.4583 24.4802 24.4851 k = 0.4375 0.2526 0.4082 ( 1081 PWs) bands (ev): -57.4073 -57.4073 -29.8081 -29.7995 -26.4826 -26.4676 -26.3944 -26.3923 4.4130 4.4738 10.0581 10.0939 10.9261 10.9405 11.0082 11.0313 14.1062 14.2698 14.3855 14.4789 15.6741 15.7963 18.8944 19.0160 19.3565 19.4254 24.5796 24.5836 k = 0.4345 0.2509 0.4180 ( 1081 PWs) bands (ev): -57.4071 -57.4071 -29.8088 -29.8000 -26.4828 -26.4671 -26.3965 -26.3941 4.4281 4.4909 10.0273 10.0633 10.9709 10.9823 11.0565 11.0770 14.0533 14.2176 14.3639 14.4644 15.7067 15.8251 18.8244 18.9505 19.3189 19.3906 24.6801 24.6831 k = 0.4315 0.2492 0.4277 ( 1081 PWs) bands (ev): -57.4069 -57.4069 -29.8096 -29.8005 -26.4830 -26.4666 -26.3987 -26.3959 4.4432 4.5079 9.9962 10.0325 11.0175 11.0252 11.1078 11.1250 13.9968 14.1588 14.3458 14.4507 15.7420 15.8559 18.7525 18.8831 19.2794 19.3537 24.7810 24.7829 k = 0.4286 0.2474 0.4374 ( 1081 PWs) bands (ev): -57.4068 -57.4068 -29.8103 -29.8010 -26.4832 -26.4661 -26.4008 -26.3977 4.4582 4.5248 9.9651 10.0016 11.0657 11.0689 11.1622 11.1754 13.9369 14.0950 14.3299 14.4380 15.7795 15.8884 18.6789 18.8140 19.2381 19.3148 24.8816 24.8823 k = 0.4256 0.2457 0.4471 ( 1079 PWs) bands (ev): -57.4066 -57.4066 -29.8110 -29.8015 -26.4833 -26.4657 -26.4029 -26.3995 4.4732 4.5414 9.9341 9.9706 11.1134 11.1151 11.2197 11.2286 13.8741 14.0275 14.3156 14.4263 15.8187 15.9222 18.6040 18.7434 19.1949 19.2739 24.9805 24.9813 k = 0.4226 0.2440 0.4568 ( 1079 PWs) bands (ev): -57.4065 -57.4065 -29.8117 -29.8020 -26.4836 -26.4652 -26.4050 -26.4013 4.4880 4.5578 9.9031 9.9398 11.1584 11.1654 11.2805 11.2847 13.8087 13.9570 14.3027 14.4157 15.8591 15.9568 18.5279 18.6719 19.1500 19.2312 25.0768 25.0793 k = 0.4196 0.2423 0.4666 ( 1081 PWs) bands (ev): -57.4063 -57.4063 -29.8124 -29.8025 -26.4838 -26.4648 -26.4071 -26.4030 4.5026 4.5737 9.8724 9.9090 11.2037 11.2161 11.3440 11.3444 13.7409 13.8841 14.2910 14.4062 15.9002 15.9918 18.4511 18.5996 19.1034 19.1866 25.1705 25.1747 k = 0.4167 0.2406 0.4763 ( 1083 PWs) bands (ev): -57.4061 -57.4061 -29.8131 -29.8031 -26.4840 -26.4644 -26.4091 -26.4046 4.5168 4.5891 9.8419 9.8785 11.2492 11.2669 11.4067 11.4115 13.6712 13.8092 14.2805 14.3980 15.9416 16.0266 18.3741 18.5271 19.0552 19.1402 25.2607 25.2668 k = 0.4137 0.2388 0.4860 ( 1083 PWs) bands (ev): -57.4060 -57.4060 -29.8138 -29.8036 -26.4842 -26.4641 -26.4111 -26.4062 4.5306 4.6040 9.8118 9.8483 11.2947 11.3174 11.4730 11.4819 13.5999 13.7328 14.2715 14.3913 15.9827 16.0607 18.2972 18.4551 19.0055 19.0922 25.3467 25.3547 k = 0.4107 0.2371 0.4957 ( 1079 PWs) bands (ev): -57.4058 -57.4058 -29.8144 -29.8041 -26.4845 -26.4638 -26.4129 -26.4077 4.5440 4.6184 9.7821 9.8184 11.3400 11.3673 11.5429 11.5555 13.5273 13.6553 14.2640 14.3860 16.0228 16.0934 18.2212 18.3841 18.9545 19.0428 25.4277 25.4376 k = 0.4077 0.2354 0.5055 ( 1081 PWs) bands (ev): -57.4057 -57.4057 -29.8150 -29.8046 -26.4847 -26.4636 -26.4147 -26.4091 4.5568 4.6320 9.7528 9.7890 11.3849 11.4163 11.6164 11.6322 13.4536 13.5767 14.2580 14.3823 16.0613 16.1241 18.1467 18.3148 18.9021 18.9918 25.5031 25.5148 k = 0.4048 0.2337 0.5152 ( 1083 PWs) bands (ev): -57.4056 -57.4056 -29.8156 -29.8051 -26.4850 -26.4635 -26.4163 -26.4105 4.5691 4.6450 9.7240 9.7599 11.4291 11.4643 11.6934 11.7120 13.3791 13.4976 14.2536 14.3802 16.0974 16.1520 18.0746 18.2480 18.8486 18.9396 25.5723 25.5858 k = 0.4018 0.2320 0.5249 ( 1087 PWs) bands (ev): -57.4054 -57.4054 -29.8162 -29.8056 -26.4853 -26.4634 -26.4178 -26.4117 4.5808 4.6571 9.6957 9.7314 11.4726 11.5111 11.7737 11.7948 13.3041 13.4180 14.2512 14.3800 16.1303 16.1762 18.0057 18.1848 18.7942 18.8863 25.6351 25.6501 k = 0.3988 0.2303 0.5346 ( 1083 PWs) bands (ev): -57.4053 -57.4053 -29.8167 -29.8061 -26.4856 -26.4634 -26.4192 -26.4128 4.5918 4.6685 9.6680 9.7034 11.5150 11.5566 11.8573 11.8805 13.2289 13.3385 14.2507 14.3817 16.1589 16.1959 17.9413 18.1261 18.7391 18.8322 25.6913 25.7075 k = 0.3958 0.2285 0.5443 ( 1083 PWs) bands (ev): -57.4052 -57.4052 -29.8171 -29.8065 -26.4859 -26.4635 -26.4204 -26.4138 4.6021 4.6790 9.6409 9.6759 11.5561 11.6003 11.9438 11.9691 13.1535 13.2590 14.2524 14.3853 16.1823 16.2101 17.8826 18.0730 18.6834 18.7773 25.7407 25.7580 k = 0.3929 0.2268 0.5541 ( 1080 PWs) bands (ev): -57.4051 -57.4051 -29.8175 -29.8069 -26.4861 -26.4636 -26.4214 -26.4148 4.6116 4.6886 9.6144 9.6490 11.5958 11.6422 12.0332 12.0602 13.0785 13.1800 14.2563 14.3911 16.1993 16.2180 17.8308 18.0267 18.6273 18.7219 25.7836 25.8015 k = 0.3899 0.2251 0.5638 ( 1080 PWs) bands (ev): -57.4050 -57.4050 -29.8179 -29.8073 -26.4864 -26.4639 -26.4222 -26.4156 4.6203 4.6972 9.5885 9.6227 11.6336 11.6821 12.1249 12.1537 13.0039 13.1017 14.2625 14.3991 16.2089 16.2187 17.7872 17.9880 18.5712 18.6662 25.8201 25.8384 k = 0.3869 0.2234 0.5735 ( 1080 PWs) bands (ev): -57.4049 -57.4049 -29.8183 -29.8077 -26.4867 -26.4642 -26.4229 -26.4162 4.6282 4.7048 9.5632 9.5969 11.6696 11.7196 12.2187 12.2493 12.9301 13.0246 14.2711 14.4092 16.2102 16.2117 17.7529 17.9578 18.5152 18.6105 25.8505 25.8690 k = 0.3839 0.2217 0.5832 ( 1076 PWs) bands (ev): -57.4048 -57.4048 -29.8185 -29.8080 -26.4869 -26.4646 -26.4234 -26.4168 4.6352 4.7114 9.5384 9.5717 11.7033 11.7546 12.3137 12.3464 12.8576 12.9492 14.2823 14.4215 16.1968 16.2027 17.7289 17.9367 18.4597 18.5551 25.8751 25.8935 k = 0.3810 0.2199 0.5929 ( 1075 PWs) bands (ev): -57.4047 -57.4047 -29.8188 -29.8083 -26.4872 -26.4651 -26.4237 -26.4173 4.6413 4.7170 9.5143 9.5470 11.7347 11.7870 12.4087 12.4439 12.7873 12.8766 14.2959 14.4361 16.1740 16.1863 17.7155 17.9249 18.4051 18.5003 25.8943 25.9124 k = 0.3780 0.2182 0.6027 ( 1069 PWs) bands (ev): -57.4047 -57.4047 -29.8189 -29.8086 -26.4873 -26.4656 -26.4239 -26.4176 4.6464 4.7215 9.4908 9.5229 11.7636 11.8164 12.5002 12.5378 12.7233 12.8103 14.3121 14.4528 16.1439 16.1616 17.7129 17.9224 18.3516 18.4463 25.9084 25.9259 k = 0.3750 0.2165 0.6124 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8190 -29.8088 -26.4875 -26.4662 -26.4239 -26.4178 4.6506 4.7249 9.4678 9.4993 11.7897 11.8428 12.5742 12.5938 12.6991 12.7637 14.3306 14.4716 16.1073 16.1294 17.7202 17.9284 18.2999 18.3935 25.9176 25.9343 k = 0.6250-0.0722 0.4082 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8190 -29.8088 -26.4875 -26.4662 -26.4239 -26.4178 4.6506 4.7249 9.4678 9.4993 11.7897 11.8428 12.5742 12.5938 12.6991 12.7637 14.3306 14.4716 16.1073 16.1294 17.7202 17.9284 18.2999 18.3935 25.9176 25.9343 k = 0.6200-0.0808 0.4082 ( 1069 PWs) bands (ev): -57.4046 -57.4046 -29.8192 -29.8092 -26.4877 -26.4671 -26.4237 -26.4181 4.6565 4.7293 9.4296 9.4600 11.8311 11.8842 12.5707 12.6471 12.7394 12.7785 14.3637 14.5047 16.0432 16.0722 17.7386 17.9423 18.2160 18.3066 25.9284 25.9436 k = 0.6150-0.0895 0.4082 ( 1069 PWs) bands (ev): -57.4045 -57.4045 -29.8193 -29.8095 -26.4880 -26.4682 -26.4234 -26.4183 4.6619 4.7331 9.3915 9.4208 11.8722 11.9253 12.5357 12.6481 12.7885 12.8715 14.3968 14.5376 15.9838 16.0203 17.7524 17.9484 18.1368 18.2210 25.9380 25.9517 k = 0.6100-0.0981 0.4082 ( 1077 PWs) bands (ev): -57.4045 -57.4045 -29.8194 -29.8099 -26.4882 -26.4693 -26.4230 -26.4184 4.6668 4.7362 9.3537 9.3817 11.9129 11.9659 12.5026 12.6184 12.8687 12.9635 14.4296 14.5701 15.9297 15.9745 17.7611 17.9396 18.0688 18.1369 25.9464 25.9583 k = 0.6050-0.1068 0.4082 ( 1077 PWs) bands (ev): -57.4044 -57.4044 -29.8195 -29.8102 -26.4884 -26.4703 -26.4226 -26.4184 4.6713 4.7387 9.3162 9.3431 11.9532 12.0061 12.4732 12.5883 12.9492 13.0519 14.4626 14.6024 15.8819 15.9355 17.7641 17.9024 18.0260 18.0552 25.9533 25.9634 k = 0.6000-0.1155 0.4082 ( 1073 PWs) bands (ev): -57.4044 -57.4044 -29.8194 -29.8104 -26.4886 -26.4714 -26.4220 -26.4183 4.6754 4.7407 9.2793 9.3049 11.9929 12.0457 12.4480 12.5614 13.0254 13.1352 14.4957 14.6345 15.8414 15.9041 17.7601 17.8387 17.9770 18.0061 25.9587 25.9669 k = 0.5950-0.1241 0.4082 ( 1075 PWs) bands (ev): -57.4044 -57.4044 -29.8194 -29.8107 -26.4888 -26.4725 -26.4215 -26.4182 4.6792 4.7422 9.2430 9.2674 12.0319 12.0844 12.4270 12.5383 13.0957 13.2123 14.5285 14.6659 15.8088 15.8810 17.7465 17.7652 17.9047 17.9925 25.9624 25.9687 k = 0.5900-0.1328 0.4082 ( 1079 PWs) bands (ev): -57.4043 -57.4043 -29.8194 -29.8110 -26.4890 -26.4736 -26.4209 -26.4181 4.6825 4.7431 9.2076 9.2307 12.0699 12.1222 12.4101 12.5190 13.1592 13.2822 14.5611 14.6968 15.7851 15.8669 17.6895 17.7181 17.8437 17.9777 25.9645 25.9689 k = 0.5850-0.1415 0.4082 ( 1087 PWs) bands (ev): -57.4043 -57.4043 -29.8194 -29.8114 -26.4892 -26.4748 -26.4203 -26.4179 4.6856 4.7437 9.1731 9.1949 12.1068 12.1589 12.3975 12.5036 13.2152 13.3441 14.5937 14.7271 15.7712 15.8623 17.6141 17.6706 17.7982 17.9592 25.9649 25.9673 k = 0.5800-0.1501 0.4082 ( 1087 PWs) bands (ev): -57.4043 -57.4043 -29.8193 -29.8116 -26.4894 -26.4759 -26.4197 -26.4176 4.6884 4.7438 9.1398 9.1603 12.1426 12.1945 12.3888 12.4918 13.2634 13.3972 14.6261 14.7568 15.7677 15.8678 17.5401 17.6092 17.7636 17.9362 25.9638 25.9644 k = 0.5750-0.1588 0.4082 ( 1085 PWs) bands (ev): -57.4043 -57.4043 -29.8191 -29.8119 -26.4895 -26.4769 -26.4190 -26.4173 4.6910 4.7436 9.1078 9.1269 12.1769 12.2288 12.3840 12.4833 13.3034 13.4411 14.6584 14.7857 15.7750 15.8834 17.4682 17.5422 17.7314 17.9084 25.9601 25.9612 k = 0.5700-0.1674 0.4082 ( 1085 PWs) bands (ev): -57.4043 -57.4043 -29.8190 -29.8121 -26.4897 -26.4780 -26.4184 -26.4170 4.6934 4.7430 9.0773 9.0950 12.2096 12.2616 12.3829 12.4780 13.3353 13.4755 14.6903 14.8137 15.7934 15.9091 17.3986 17.4742 17.6975 17.8755 25.9546 25.9572 k = 0.5650-0.1761 0.4082 ( 1078 PWs) bands (ev): -57.4043 -57.4043 -29.8188 -29.8124 -26.4898 -26.4790 -26.4177 -26.4166 4.6956 4.7422 9.0482 9.0647 12.2404 12.2928 12.3854 12.4755 13.3596 13.5007 14.7220 14.8409 15.8227 15.9447 17.3320 17.4071 17.6601 17.8376 25.9481 25.9521 k = 0.5600-0.1848 0.4082 ( 1078 PWs) bands (ev): -57.4042 -57.4042 -29.8186 -29.8126 -26.4899 -26.4799 -26.4171 -26.4162 4.6976 4.7411 9.0209 9.0360 12.2691 12.3222 12.3912 12.4754 13.3768 13.5170 14.7530 14.8667 15.8622 15.9896 17.2684 17.3419 17.6184 17.7945 25.9407 25.9459 k = 0.5550-0.1934 0.4082 ( 1078 PWs) bands (ev): -57.4042 -57.4042 -29.8184 -29.8129 -26.4899 -26.4809 -26.4166 -26.4158 4.6996 4.7397 8.9953 9.0092 12.2957 12.3497 12.3999 12.4773 13.3877 13.5251 14.7832 14.8912 15.9113 16.0430 17.2083 17.2793 17.5722 17.7465 25.9328 25.9389 k = 0.5500-0.2021 0.4082 ( 1078 PWs) bands (ev): -57.4042 -57.4042 -29.8182 -29.8132 -26.4900 -26.4818 -26.4160 -26.4155 4.7014 4.7382 8.9717 8.9842 12.3200 12.3752 12.4113 12.4808 13.3933 13.5262 14.8126 14.9141 15.9689 16.1040 17.1521 17.2197 17.5215 17.6936 25.9246 25.9313 k = 0.5450-0.2107 0.4082 ( 1078 PWs) bands (ev): -57.4042 -57.4042 -29.8180 -29.8134 -26.4900 -26.4826 -26.4155 -26.4151 4.7032 4.7366 8.9500 8.9613 12.3423 12.3985 12.4245 12.4855 13.3948 13.5213 14.8409 14.9353 16.0340 16.1718 17.1002 17.1636 17.4663 17.6359 25.9164 25.9234 k = 0.5400-0.2194 0.4082 ( 1078 PWs) bands (ev): -57.4042 -57.4042 -29.8178 -29.8137 -26.4899 -26.4835 -26.4150 -26.4148 4.7049 4.7348 8.9305 8.9405 12.3630 12.4198 12.4387 12.4906 13.3932 13.5116 14.8679 14.9544 16.1054 16.2454 17.0530 17.1113 17.4068 17.5738 25.9084 25.9155 k = 0.5350-0.2281 0.4082 ( 1078 PWs) bands (ev): -57.4042 -57.4042 -29.8176 -29.8139 -26.4899 -26.4842 -26.4146 -26.4144 4.7066 4.7329 8.9131 8.9219 12.3825 12.4387 12.4530 12.4958 13.3899 13.4984 14.8933 14.9714 16.1818 16.3235 17.0108 17.0633 17.3434 17.5075 25.9008 25.9077 k = 0.5300-0.2367 0.4082 ( 1082 PWs) bands (ev): -57.4042 -57.4042 -29.8173 -29.8142 -26.4898 -26.4850 -26.4143 -26.4142 4.7083 4.7309 8.8980 8.9055 12.4008 12.4554 12.4666 12.5002 13.3858 13.4827 14.9170 14.9857 16.2621 16.4051 16.9740 17.0198 17.2762 17.4372 25.8939 25.9003 k = 0.5250-0.2454 0.4082 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8171 -29.8145 -26.4897 -26.4856 -26.4140 -26.4139 4.7100 4.7290 8.8853 8.8915 12.4182 12.4696 12.4790 12.5037 13.3819 13.4657 14.9387 14.9974 16.3454 16.4894 16.9430 16.9812 17.2059 17.3635 25.8878 25.8936 k = 0.5200-0.2540 0.4082 ( 1080 PWs) bands (ev): -57.4042 -57.4042 -29.8168 -29.8147 -26.4895 -26.4863 -26.4137 -26.4137 4.7117 4.7270 8.8748 8.8798 12.4347 12.4812 12.4896 12.5058 13.3793 13.4485 14.9581 15.0060 16.4304 16.5748 16.9183 16.9478 17.1332 17.2865 25.8828 25.8876 k = 0.5150-0.2627 0.4082 ( 1088 PWs) bands (ev): -57.4042 -57.4042 -29.8166 -29.8150 -26.4893 -26.4869 -26.4135 -26.4135 4.7135 4.7249 8.8668 8.8705 12.4498 12.4895 12.4980 12.5066 13.3786 13.4318 14.9748 15.0113 16.5158 16.6594 16.8999 16.9196 17.0600 17.2070 25.8788 25.8826 k = 0.5100-0.2714 0.4082 ( 1092 PWs) bands (ev): -57.4042 -57.4042 -29.8164 -29.8153 -26.4890 -26.4874 -26.4134 -26.4134 4.7152 4.7229 8.8612 8.8637 12.4635 12.4933 12.5042 12.5071 13.3804 13.4165 14.9888 15.0135 16.6006 16.7382 16.8884 16.8967 16.9912 17.1260 25.8761 25.8786 k = 0.5050-0.2800 0.4082 ( 1092 PWs) bands (ev): -57.4042 -57.4042 -29.8161 -29.8156 -26.4887 -26.4879 -26.4133 -26.4133 4.7171 4.7209 8.8581 8.8593 12.4753 12.4912 12.5079 12.5085 13.3851 13.4033 14.9999 15.0123 16.6823 16.7859 16.8840 16.8854 16.9460 17.0453 25.8747 25.8760 k = 0.5000-0.2887 0.4082 ( 1090 PWs) bands (ev): -57.4042 -57.4042 -29.8158 -29.8158 -26.4883 -26.4883 -26.4133 -26.4133 4.7190 4.7190 8.8575 8.8575 12.4847 12.4847 12.5092 12.5092 13.3928 13.3928 15.0078 15.0078 16.7539 16.7539 16.8861 16.8861 16.9725 16.9725 25.8747 25.8747 Writing output data file RuC.save init_run : 3.96s CPU 13.00s WALL ( 1 calls) electrons : 129.67s CPU 133.63s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.36s CPU 1.39s WALL ( 1 calls) Called by electrons: c_bands : 129.65s CPU 133.31s WALL ( 1 calls) v_of_rho : 0.10s CPU 0.79s WALL ( 1 calls) v_h : 0.01s CPU 0.02s WALL ( 1 calls) v_xc : 0.09s CPU 0.47s WALL ( 1 calls) newd : 0.14s CPU 0.38s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.33s WALL ( 455 calls) cegterg : 103.19s CPU 103.91s WALL ( 455 calls) Called by sum_band: Called by *egterg: h_psi : 50.93s CPU 54.22s WALL ( 6822 calls) s_psi : 2.81s CPU 3.38s WALL ( 6822 calls) g_psi : 0.04s CPU 0.10s WALL ( 5912 calls) cdiaghg : 37.77s CPU 36.77s WALL ( 6367 calls) cegterg:over : 9.34s CPU 8.01s WALL ( 5912 calls) cegterg:upda : 0.23s CPU 0.96s WALL ( 5912 calls) cegterg:last : 0.31s CPU 0.72s WALL ( 1365 calls) Called by h_psi: h_psi:vloc : 44.22s CPU 47.18s WALL ( 6822 calls) h_psi:vnl : 6.70s CPU 6.97s WALL ( 6822 calls) add_vuspsi : 0.85s CPU 2.28s WALL ( 6822 calls) General routines calbec : 5.83s CPU 4.65s WALL ( 6822 calls) fft : 0.18s CPU 0.95s WALL ( 19 calls) ffts : 0.01s CPU 0.10s WALL ( 4 calls) fftw : 41.69s CPU 45.08s WALL ( 533336 calls) interpolate : 0.08s CPU 0.18s WALL ( 4 calls) davcio : 0.03s CPU 0.98s WALL ( 910 calls) Parallel routines fft_scatter : 29.44s CPU 31.75s WALL ( 533359 calls) PWSCF : 2m42.30s CPU 3m57.40s WALL This run was terminated on: 4:11: 1 27Aug2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=