Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:14:14 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./TiSb2.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 69 69 19 2338 2338 343 Max 70 70 20 2341 2341 346 Sum 2497 2497 695 84199 84199 12385 bravais-lattice index = 14 lattice parameter (alat) = 10.4603 a.u. unit-cell volume = 870.7404 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 44.00 number of Kohn-Sham states= 52 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.460292 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.276183 celldm(5)= -0.276183 celldm(6)= -0.447633 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.447633 0.894217 0.000000 ) a(3) = ( -0.276183 -0.447109 0.850774 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.500587 0.587700 ) b(2) = ( 0.000000 1.118296 0.587700 ) b(3) = ( 0.000000 0.000000 1.175400 ) PseudoPot. # 1 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 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 Ti read from file: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 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 atomic species valence mass pseudopotential Sb 5.00 121.76000 Sb( 1.00) Ti 12.00 47.86700 Ti( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) 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 = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 1 1 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.7238166 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.4471086 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( -1 -1 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) f =( -0.2761834 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.4471086 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 303 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033003 k( 2) = ( 0.0000000 0.0000000 0.0172853), wk = 0.0033003 k( 3) = ( 0.0000000 0.0000000 0.0345706), wk = 0.0033003 k( 4) = ( 0.0000000 0.0000000 0.0518559), wk = 0.0033003 k( 5) = ( 0.0000000 0.0000000 0.0691412), wk = 0.0033003 k( 6) = ( 0.0000000 0.0000000 0.0864265), wk = 0.0033003 k( 7) = ( 0.0000000 0.0000000 0.1037118), wk = 0.0033003 k( 8) = ( 0.0000000 0.0000000 0.1209971), wk = 0.0033003 k( 9) = ( 0.0000000 0.0000000 0.1382824), wk = 0.0033003 k( 10) = ( 0.0000000 0.0000000 0.1555677), wk = 0.0033003 k( 11) = ( 0.0000000 0.0000000 0.1728530), wk = 0.0033003 k( 12) = ( 0.0000000 0.0000000 0.1901383), wk = 0.0033003 k( 13) = ( 0.0000000 0.0000000 0.2074235), wk = 0.0033003 k( 14) = ( 0.0000000 0.0000000 0.2247088), wk = 0.0033003 k( 15) = ( 0.0000000 0.0000000 0.2419941), wk = 0.0033003 k( 16) = ( 0.0000000 0.0000000 0.2592794), wk = 0.0033003 k( 17) = ( 0.0000000 0.0000000 0.2765647), wk = 0.0033003 k( 18) = ( 0.0000000 0.0000000 0.2938500), wk = 0.0033003 k( 19) = ( 0.0000000 0.0000000 0.3111353), wk = 0.0033003 k( 20) = ( 0.0000000 0.0000000 0.3284206), wk = 0.0033003 k( 21) = ( 0.0000000 0.0000000 0.3457059), wk = 0.0033003 k( 22) = ( 0.0000000 0.0000000 0.3629912), wk = 0.0033003 k( 23) = ( 0.0000000 0.0000000 0.3802765), wk = 0.0033003 k( 24) = ( 0.0000000 0.0000000 0.3975618), wk = 0.0033003 k( 25) = ( 0.0000000 0.0000000 0.4148471), wk = 0.0033003 k( 26) = ( 0.0000000 0.0000000 0.4321324), wk = 0.0033003 k( 27) = ( 0.0000000 0.0000000 0.4494177), wk = 0.0033003 k( 28) = ( 0.0000000 0.0000000 0.4667030), wk = 0.0033003 k( 29) = ( 0.0000000 0.0000000 0.4839883), wk = 0.0033003 k( 30) = ( 0.0000000 0.0000000 0.5012736), wk = 0.0033003 k( 31) = ( 0.0000000 0.0000000 0.5185589), wk = 0.0033003 k( 32) = ( 0.0000000 0.0000000 0.5358442), wk = 0.0033003 k( 33) = ( 0.0000000 0.0000000 0.5531295), wk = 0.0033003 k( 34) = ( 0.0000000 0.0000000 0.5704148), wk = 0.0033003 k( 35) = ( 0.0000000 0.0000000 0.5877000), wk = 0.0033003 k( 36) = ( 0.0000000 0.0000000 0.5877000), wk = 0.0033003 k( 37) = ( -0.0147059 0.0090840 0.5877000), wk = 0.0033003 k( 38) = ( -0.0294118 0.0181679 0.5877000), wk = 0.0033003 k( 39) = ( -0.0441177 0.0272519 0.5877000), wk = 0.0033003 k( 40) = ( -0.0588235 0.0363359 0.5877000), wk = 0.0033003 k( 41) = ( -0.0735294 0.0454198 0.5877000), wk = 0.0033003 k( 42) = ( -0.0882353 0.0545038 0.5877000), wk = 0.0033003 k( 43) = ( -0.1029412 0.0635878 0.5877000), wk = 0.0033003 k( 44) = ( -0.1176471 0.0726717 0.5877000), wk = 0.0033003 k( 45) = ( -0.1323529 0.0817557 0.5877000), wk = 0.0033003 k( 46) = ( -0.1470588 0.0908397 0.5877000), wk = 0.0033003 k( 47) = ( -0.1617647 0.0999236 0.5877000), wk = 0.0033003 k( 48) = ( -0.1764706 0.1090076 0.5877000), wk = 0.0033003 k( 49) = ( -0.1911765 0.1180916 0.5877000), wk = 0.0033003 k( 50) = ( -0.2058823 0.1271755 0.5877000), wk = 0.0033003 k( 51) = ( -0.2205882 0.1362595 0.5877000), wk = 0.0033003 k( 52) = ( -0.2352941 0.1453435 0.5877000), wk = 0.0033003 k( 53) = ( -0.2500000 0.1544274 0.5877000), wk = 0.0033003 k( 54) = ( -0.2647059 0.1635114 0.5877000), wk = 0.0033003 k( 55) = ( -0.2794118 0.1725954 0.5877000), wk = 0.0033003 k( 56) = ( -0.2941177 0.1816794 0.5877000), wk = 0.0033003 k( 57) = ( -0.3088235 0.1907633 0.5877000), wk = 0.0033003 k( 58) = ( -0.3235294 0.1998473 0.5877000), wk = 0.0033003 k( 59) = ( -0.3382353 0.2089313 0.5877000), wk = 0.0033003 k( 60) = ( -0.3529412 0.2180152 0.5877000), wk = 0.0033003 k( 61) = ( -0.3676471 0.2270992 0.5877000), wk = 0.0033003 k( 62) = ( -0.3823529 0.2361832 0.5877000), wk = 0.0033003 k( 63) = ( -0.3970588 0.2452671 0.5877000), wk = 0.0033003 k( 64) = ( -0.4117647 0.2543511 0.5877000), wk = 0.0033003 k( 65) = ( -0.4264706 0.2634351 0.5877000), wk = 0.0033003 k( 66) = ( -0.4411765 0.2725190 0.5877000), wk = 0.0033003 k( 67) = ( -0.4558823 0.2816030 0.5877000), wk = 0.0033003 k( 68) = ( -0.4705882 0.2906870 0.5877000), wk = 0.0033003 k( 69) = ( -0.4852941 0.2997709 0.5877000), wk = 0.0033003 k( 70) = ( -0.5000000 0.3088549 0.5877000), wk = 0.0033003 k( 71) = ( -0.5000000 0.3088549 0.5877000), wk = 0.0033003 k( 72) = ( -0.4895833 0.3024204 0.5754563), wk = 0.0033003 k( 73) = ( -0.4791667 0.2959859 0.5632126), wk = 0.0033003 k( 74) = ( -0.4687500 0.2895515 0.5509688), wk = 0.0033003 k( 75) = ( -0.4583333 0.2831170 0.5387250), wk = 0.0033003 k( 76) = ( -0.4479167 0.2766825 0.5264813), wk = 0.0033003 k( 77) = ( -0.4375000 0.2702480 0.5142375), wk = 0.0033003 k( 78) = ( -0.4270833 0.2638136 0.5019938), wk = 0.0033003 k( 79) = ( -0.4166667 0.2573791 0.4897500), wk = 0.0033003 k( 80) = ( -0.4062500 0.2509446 0.4775063), wk = 0.0033003 k( 81) = ( -0.3958333 0.2445101 0.4652625), wk = 0.0033003 k( 82) = ( -0.3854167 0.2380757 0.4530188), wk = 0.0033003 k( 83) = ( -0.3750000 0.2316412 0.4407750), wk = 0.0033003 k( 84) = ( -0.3645833 0.2252067 0.4285313), wk = 0.0033003 k( 85) = ( -0.3541667 0.2187722 0.4162875), wk = 0.0033003 k( 86) = ( -0.3437500 0.2123377 0.4040438), wk = 0.0033003 k( 87) = ( -0.3333333 0.2059033 0.3918000), wk = 0.0033003 k( 88) = ( -0.3229167 0.1994688 0.3795563), wk = 0.0033003 k( 89) = ( -0.3125000 0.1930343 0.3673125), wk = 0.0033003 k( 90) = ( -0.3020833 0.1865998 0.3550688), wk = 0.0033003 k( 91) = ( -0.2916667 0.1801654 0.3428250), wk = 0.0033003 k( 92) = ( -0.2812500 0.1737309 0.3305813), wk = 0.0033003 k( 93) = ( -0.2708333 0.1672964 0.3183375), wk = 0.0033003 k( 94) = ( -0.2604167 0.1608619 0.3060938), wk = 0.0033003 k( 95) = ( -0.2500000 0.1544274 0.2938500), wk = 0.0033003 k( 96) = ( -0.2395833 0.1479930 0.2816063), wk = 0.0033003 k( 97) = ( -0.2291667 0.1415585 0.2693625), wk = 0.0033003 k( 98) = ( -0.2187500 0.1351240 0.2571188), wk = 0.0033003 k( 99) = ( -0.2083333 0.1286895 0.2448750), wk = 0.0033003 k( 100) = ( -0.1979167 0.1222551 0.2326313), wk = 0.0033003 k( 101) = ( -0.1875000 0.1158206 0.2203875), wk = 0.0033003 k( 102) = ( -0.1770833 0.1093861 0.2081438), wk = 0.0033003 k( 103) = ( -0.1666667 0.1029516 0.1959000), wk = 0.0033003 k( 104) = ( -0.1562500 0.0965172 0.1836563), wk = 0.0033003 k( 105) = ( -0.1458333 0.0900827 0.1714125), wk = 0.0033003 k( 106) = ( -0.1354167 0.0836482 0.1591688), wk = 0.0033003 k( 107) = ( -0.1250000 0.0772137 0.1469250), wk = 0.0033003 k( 108) = ( -0.1145833 0.0707792 0.1346813), wk = 0.0033003 k( 109) = ( -0.1041667 0.0643448 0.1224375), wk = 0.0033003 k( 110) = ( -0.0937500 0.0579103 0.1101938), wk = 0.0033003 k( 111) = ( -0.0833333 0.0514758 0.0979500), wk = 0.0033003 k( 112) = ( -0.0729167 0.0450413 0.0857063), wk = 0.0033003 k( 113) = ( -0.0625000 0.0386069 0.0734625), wk = 0.0033003 k( 114) = ( -0.0520833 0.0321724 0.0612188), wk = 0.0033003 k( 115) = ( -0.0416667 0.0257379 0.0489750), wk = 0.0033003 k( 116) = ( -0.0312500 0.0193034 0.0367313), wk = 0.0033003 k( 117) = ( -0.0208333 0.0128690 0.0244875), wk = 0.0033003 k( 118) = ( -0.0104167 0.0064345 0.0122438), wk = 0.0033003 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033003 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033003 k( 121) = ( 0.0091830 0.0148662 -0.0000000), wk = 0.0033003 k( 122) = ( 0.0183659 0.0297323 -0.0000000), wk = 0.0033003 k( 123) = ( 0.0275489 0.0445985 -0.0000000), wk = 0.0033003 k( 124) = ( 0.0367319 0.0594646 -0.0000000), wk = 0.0033003 k( 125) = ( 0.0459149 0.0743308 -0.0000000), wk = 0.0033003 k( 126) = ( 0.0550978 0.0891970 -0.0000000), wk = 0.0033003 k( 127) = ( 0.0642808 0.1040631 -0.0000000), wk = 0.0033003 k( 128) = ( 0.0734638 0.1189293 -0.0000000), wk = 0.0033003 k( 129) = ( 0.0826468 0.1337954 -0.0000000), wk = 0.0033003 k( 130) = ( 0.0918297 0.1486616 0.0000000), wk = 0.0033003 k( 131) = ( 0.1010127 0.1635278 -0.0000000), wk = 0.0033003 k( 132) = ( 0.1101957 0.1783939 0.0000000), wk = 0.0033003 k( 133) = ( 0.1193787 0.1932601 0.0000000), wk = 0.0033003 k( 134) = ( 0.1285616 0.2081262 -0.0000000), wk = 0.0033003 k( 135) = ( 0.1377446 0.2229924 -0.0000000), wk = 0.0033003 k( 136) = ( 0.1469276 0.2378586 0.0000000), wk = 0.0033003 k( 137) = ( 0.1561105 0.2527247 0.0000000), wk = 0.0033003 k( 138) = ( 0.1652935 0.2675909 -0.0000000), wk = 0.0033003 k( 139) = ( 0.1744765 0.2824570 -0.0000000), wk = 0.0033003 k( 140) = ( 0.1836595 0.2973232 0.0000000), wk = 0.0033003 k( 141) = ( 0.1928424 0.3121894 0.0000000), wk = 0.0033003 k( 142) = ( 0.2020254 0.3270555 -0.0000000), wk = 0.0033003 k( 143) = ( 0.2112084 0.3419217 0.0000000), wk = 0.0033003 k( 144) = ( 0.2203914 0.3567878 -0.0000000), wk = 0.0033003 k( 145) = ( 0.2295743 0.3716540 -0.0000000), wk = 0.0033003 k( 146) = ( 0.2387573 0.3865202 0.0000000), wk = 0.0033003 k( 147) = ( 0.2479403 0.4013863 -0.0000000), wk = 0.0033003 k( 148) = ( 0.2571232 0.4162525 -0.0000000), wk = 0.0033003 k( 149) = ( 0.2663062 0.4311186 0.0000000), wk = 0.0033003 k( 150) = ( 0.2754892 0.4459848 -0.0000000), wk = 0.0033003 k( 151) = ( 0.2846722 0.4608510 -0.0000000), wk = 0.0033003 k( 152) = ( 0.2938551 0.4757171 0.0000000), wk = 0.0033003 k( 153) = ( 0.3030381 0.4905833 -0.0000000), wk = 0.0033003 k( 154) = ( 0.3122211 0.5054495 0.0000000), wk = 0.0033003 k( 155) = ( 0.3214040 0.5203156 0.0000000), wk = 0.0033003 k( 156) = ( 0.3305870 0.5351818 -0.0000000), wk = 0.0033003 k( 157) = ( 0.3397700 0.5500479 0.0000000), wk = 0.0033003 k( 158) = ( 0.3489530 0.5649141 0.0000000), wk = 0.0033003 k( 159) = ( 0.3581359 0.5797802 -0.0000000), wk = 0.0033003 k( 160) = ( 0.3673189 0.5946464 0.0000000), wk = 0.0033003 k( 161) = ( 0.3765019 0.6095126 -0.0000000), wk = 0.0033003 k( 162) = ( 0.3856849 0.6243787 0.0000000), wk = 0.0033003 k( 163) = ( 0.3948678 0.6392449 0.0000000), wk = 0.0033003 k( 164) = ( 0.4040508 0.6541111 -0.0000000), wk = 0.0033003 k( 165) = ( 0.4132338 0.6689772 0.0000000), wk = 0.0033003 k( 166) = ( 0.4224168 0.6838434 -0.0000000), wk = 0.0033003 k( 167) = ( 0.4315997 0.6987095 -0.0000000), wk = 0.0033003 k( 168) = ( 0.4407827 0.7135757 -0.0000000), wk = 0.0033003 k( 169) = ( 0.4407827 0.7135757 -0.0000000), wk = 0.0033003 k( 170) = ( 0.4360131 0.7058543 0.0146925), wk = 0.0033003 k( 171) = ( 0.4312436 0.6981329 0.0293850), wk = 0.0033003 k( 172) = ( 0.4264740 0.6904116 0.0440775), wk = 0.0033003 k( 173) = ( 0.4217044 0.6826902 0.0587700), wk = 0.0033003 k( 174) = ( 0.4169349 0.6749688 0.0734625), wk = 0.0033003 k( 175) = ( 0.4121653 0.6672475 0.0881550), wk = 0.0033003 k( 176) = ( 0.4073957 0.6595261 0.1028475), wk = 0.0033003 k( 177) = ( 0.4026262 0.6518047 0.1175400), wk = 0.0033003 k( 178) = ( 0.3978566 0.6440833 0.1322325), wk = 0.0033003 k( 179) = ( 0.3930870 0.6363620 0.1469250), wk = 0.0033003 k( 180) = ( 0.3883175 0.6286406 0.1616175), wk = 0.0033003 k( 181) = ( 0.3835479 0.6209192 0.1763100), wk = 0.0033003 k( 182) = ( 0.3787783 0.6131979 0.1910025), wk = 0.0033003 k( 183) = ( 0.3740088 0.6054765 0.2056950), wk = 0.0033003 k( 184) = ( 0.3692392 0.5977551 0.2203875), wk = 0.0033003 k( 185) = ( 0.3644696 0.5900337 0.2350800), wk = 0.0033003 k( 186) = ( 0.3597000 0.5823124 0.2497725), wk = 0.0033003 k( 187) = ( 0.3549305 0.5745910 0.2644650), wk = 0.0033003 k( 188) = ( 0.3501609 0.5668696 0.2791575), wk = 0.0033003 k( 189) = ( 0.3453913 0.5591482 0.2938500), wk = 0.0033003 k( 190) = ( 0.3406218 0.5514269 0.3085425), wk = 0.0033003 k( 191) = ( 0.3358522 0.5437055 0.3232350), wk = 0.0033003 k( 192) = ( 0.3310826 0.5359841 0.3379275), wk = 0.0033003 k( 193) = ( 0.3263131 0.5282628 0.3526200), wk = 0.0033003 k( 194) = ( 0.3215435 0.5205414 0.3673125), wk = 0.0033003 k( 195) = ( 0.3167739 0.5128200 0.3820050), wk = 0.0033003 k( 196) = ( 0.3120044 0.5050986 0.3966975), wk = 0.0033003 k( 197) = ( 0.3072348 0.4973773 0.4113900), wk = 0.0033003 k( 198) = ( 0.3024652 0.4896559 0.4260825), wk = 0.0033003 k( 199) = ( 0.2976957 0.4819345 0.4407750), wk = 0.0033003 k( 200) = ( 0.2929261 0.4742132 0.4554675), wk = 0.0033003 k( 201) = ( 0.2881565 0.4664918 0.4701600), wk = 0.0033003 k( 202) = ( 0.2833870 0.4587704 0.4848525), wk = 0.0033003 k( 203) = ( 0.2786174 0.4510490 0.4995450), wk = 0.0033003 k( 204) = ( 0.2738478 0.4433277 0.5142375), wk = 0.0033003 k( 205) = ( 0.2690783 0.4356063 0.5289300), wk = 0.0033003 k( 206) = ( 0.2643087 0.4278849 0.5436225), wk = 0.0033003 k( 207) = ( 0.2595391 0.4201635 0.5583150), wk = 0.0033003 k( 208) = ( 0.2547696 0.4124422 0.5730075), wk = 0.0033003 k( 209) = ( 0.2500000 0.4047208 0.5877000), wk = 0.0033003 k( 210) = ( 0.2500000 0.4047208 0.5877000), wk = 0.0033003 k( 211) = ( 0.2395833 0.4111553 0.5754563), wk = 0.0033003 k( 212) = ( 0.2291667 0.4175897 0.5632126), wk = 0.0033003 k( 213) = ( 0.2187500 0.4240242 0.5509688), wk = 0.0033003 k( 214) = ( 0.2083333 0.4304587 0.5387250), wk = 0.0033003 k( 215) = ( 0.1979167 0.4368932 0.5264813), wk = 0.0033003 k( 216) = ( 0.1875000 0.4433277 0.5142375), wk = 0.0033003 k( 217) = ( 0.1770833 0.4497621 0.5019938), wk = 0.0033003 k( 218) = ( 0.1666667 0.4561966 0.4897500), wk = 0.0033003 k( 219) = ( 0.1562500 0.4626311 0.4775063), wk = 0.0033003 k( 220) = ( 0.1458333 0.4690656 0.4652625), wk = 0.0033003 k( 221) = ( 0.1354167 0.4755000 0.4530188), wk = 0.0033003 k( 222) = ( 0.1250000 0.4819345 0.4407750), wk = 0.0033003 k( 223) = ( 0.1145833 0.4883690 0.4285313), wk = 0.0033003 k( 224) = ( 0.1041667 0.4948035 0.4162875), wk = 0.0033003 k( 225) = ( 0.0937500 0.5012380 0.4040438), wk = 0.0033003 k( 226) = ( 0.0833333 0.5076724 0.3918000), wk = 0.0033003 k( 227) = ( 0.0729167 0.5141069 0.3795563), wk = 0.0033003 k( 228) = ( 0.0625000 0.5205414 0.3673125), wk = 0.0033003 k( 229) = ( 0.0520833 0.5269759 0.3550688), wk = 0.0033003 k( 230) = ( 0.0416667 0.5334103 0.3428250), wk = 0.0033003 k( 231) = ( 0.0312500 0.5398448 0.3305813), wk = 0.0033003 k( 232) = ( 0.0208333 0.5462793 0.3183375), wk = 0.0033003 k( 233) = ( 0.0104167 0.5527138 0.3060938), wk = 0.0033003 k( 234) = ( 0.0000000 0.5591482 0.2938500), wk = 0.0033003 k( 235) = ( 0.0000000 0.5591482 0.2938500), wk = 0.0033003 k( 236) = ( -0.0137745 0.5543224 0.3030328), wk = 0.0033003 k( 237) = ( -0.0275489 0.5494965 0.3122157), wk = 0.0033003 k( 238) = ( -0.0413234 0.5446707 0.3213985), wk = 0.0033003 k( 239) = ( -0.0550978 0.5398448 0.3305813), wk = 0.0033003 k( 240) = ( -0.0688723 0.5350189 0.3397641), wk = 0.0033003 k( 241) = ( -0.0826468 0.5301931 0.3489469), wk = 0.0033003 k( 242) = ( -0.0964212 0.5253672 0.3581297), wk = 0.0033003 k( 243) = ( -0.1101957 0.5205414 0.3673125), wk = 0.0033003 k( 244) = ( -0.1239701 0.5157155 0.3764953), wk = 0.0033003 k( 245) = ( -0.1377446 0.5108897 0.3856782), wk = 0.0033003 k( 246) = ( -0.1515190 0.5060638 0.3948610), wk = 0.0033003 k( 247) = ( -0.1652935 0.5012380 0.4040438), wk = 0.0033003 k( 248) = ( -0.1790680 0.4964121 0.4132266), wk = 0.0033003 k( 249) = ( -0.1928424 0.4915862 0.4224094), wk = 0.0033003 k( 250) = ( -0.2066169 0.4867604 0.4315922), wk = 0.0033003 k( 251) = ( -0.2203914 0.4819345 0.4407750), wk = 0.0033003 k( 252) = ( -0.2341658 0.4771087 0.4499579), wk = 0.0033003 k( 253) = ( -0.2479403 0.4722828 0.4591407), wk = 0.0033003 k( 254) = ( -0.2617147 0.4674569 0.4683235), wk = 0.0033003 k( 255) = ( -0.2754892 0.4626311 0.4775063), wk = 0.0033003 k( 256) = ( -0.2892636 0.4578052 0.4866891), wk = 0.0033003 k( 257) = ( -0.3030381 0.4529794 0.4958719), wk = 0.0033003 k( 258) = ( -0.3168126 0.4481535 0.5050547), wk = 0.0033003 k( 259) = ( -0.3305870 0.4433277 0.5142375), wk = 0.0033003 k( 260) = ( -0.3443615 0.4385018 0.5234204), wk = 0.0033003 k( 261) = ( -0.3581359 0.4336759 0.5326032), wk = 0.0033003 k( 262) = ( -0.3719104 0.4288501 0.5417860), wk = 0.0033003 k( 263) = ( -0.3856849 0.4240242 0.5509688), wk = 0.0033003 k( 264) = ( -0.3994593 0.4191984 0.5601516), wk = 0.0033003 k( 265) = ( -0.4132338 0.4143725 0.5693344), wk = 0.0033003 k( 266) = ( -0.4270082 0.4095466 0.5785172), wk = 0.0033003 k( 267) = ( -0.4407827 0.4047208 0.5877000), wk = 0.0033003 k( 268) = ( -0.4407827 0.4047208 0.5877000), wk = 0.0033003 k( 269) = ( -0.4492423 0.3910257 0.5877000), wk = 0.0033003 k( 270) = ( -0.4577019 0.3773305 0.5877000), wk = 0.0033003 k( 271) = ( -0.4661615 0.3636354 0.5877000), wk = 0.0033003 k( 272) = ( -0.4746212 0.3499403 0.5877000), wk = 0.0033003 k( 273) = ( -0.4830808 0.3362452 0.5877000), wk = 0.0033003 k( 274) = ( -0.4915404 0.3225500 0.5877000), wk = 0.0033003 k( 275) = ( -0.5000000 0.3088549 0.5877000), wk = 0.0033003 k( 276) = ( 0.0000000 0.0000000 0.5877000), wk = 0.0033003 k( 277) = ( 0.0092593 0.0149897 0.5877000), wk = 0.0033003 k( 278) = ( 0.0185185 0.0299793 0.5877000), wk = 0.0033003 k( 279) = ( 0.0277778 0.0449690 0.5877000), wk = 0.0033003 k( 280) = ( 0.0370370 0.0599586 0.5877000), wk = 0.0033003 k( 281) = ( 0.0462963 0.0749483 0.5877000), wk = 0.0033003 k( 282) = ( 0.0555556 0.0899380 0.5877000), wk = 0.0033003 k( 283) = ( 0.0648148 0.1049276 0.5877000), wk = 0.0033003 k( 284) = ( 0.0740741 0.1199173 0.5877000), wk = 0.0033003 k( 285) = ( 0.0833333 0.1349069 0.5877000), wk = 0.0033003 k( 286) = ( 0.0925926 0.1498966 0.5877000), wk = 0.0033003 k( 287) = ( 0.1018518 0.1648862 0.5877000), wk = 0.0033003 k( 288) = ( 0.1111111 0.1798759 0.5877000), wk = 0.0033003 k( 289) = ( 0.1203704 0.1948656 0.5877000), wk = 0.0033003 k( 290) = ( 0.1296296 0.2098552 0.5877000), wk = 0.0033003 k( 291) = ( 0.1388889 0.2248449 0.5877000), wk = 0.0033003 k( 292) = ( 0.1481482 0.2398345 0.5877000), wk = 0.0033003 k( 293) = ( 0.1574074 0.2548242 0.5877000), wk = 0.0033003 k( 294) = ( 0.1666667 0.2698139 0.5877000), wk = 0.0033003 k( 295) = ( 0.1759259 0.2848035 0.5877000), wk = 0.0033003 k( 296) = ( 0.1851852 0.2997932 0.5877000), wk = 0.0033003 k( 297) = ( 0.1944444 0.3147828 0.5877000), wk = 0.0033003 k( 298) = ( 0.2037037 0.3297725 0.5877000), wk = 0.0033003 k( 299) = ( 0.2129630 0.3447622 0.5877000), wk = 0.0033003 k( 300) = ( 0.2222222 0.3597518 0.5877000), wk = 0.0033003 k( 301) = ( 0.2314815 0.3747415 0.5877000), wk = 0.0033003 k( 302) = ( 0.2407407 0.3897311 0.5877000), wk = 0.0033003 k( 303) = ( 0.2500000 0.4047208 0.5877000), wk = 0.0033003 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033003 k( 2) = ( 0.0000000 0.0000000 0.0147059), wk = 0.0033003 k( 3) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0033003 k( 4) = ( 0.0000000 0.0000000 0.0441177), wk = 0.0033003 k( 5) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0033003 k( 6) = ( 0.0000000 0.0000000 0.0735294), wk = 0.0033003 k( 7) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0033003 k( 8) = ( 0.0000000 0.0000000 0.1029412), wk = 0.0033003 k( 9) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0033003 k( 10) = ( 0.0000000 0.0000000 0.1323529), wk = 0.0033003 k( 11) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0033003 k( 12) = ( 0.0000000 0.0000000 0.1617647), wk = 0.0033003 k( 13) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0033003 k( 14) = ( 0.0000000 0.0000000 0.1911765), wk = 0.0033003 k( 15) = ( 0.0000000 0.0000000 0.2058824), wk = 0.0033003 k( 16) = ( 0.0000000 0.0000000 0.2205882), wk = 0.0033003 k( 17) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0033003 k( 18) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0033003 k( 19) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0033003 k( 20) = ( 0.0000000 0.0000000 0.2794118), wk = 0.0033003 k( 21) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0033003 k( 22) = ( 0.0000000 0.0000000 0.3088235), wk = 0.0033003 k( 23) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0033003 k( 24) = ( 0.0000000 0.0000000 0.3382353), wk = 0.0033003 k( 25) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0033003 k( 26) = ( 0.0000000 0.0000000 0.3676471), wk = 0.0033003 k( 27) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0033003 k( 28) = ( 0.0000000 0.0000000 0.3970588), wk = 0.0033003 k( 29) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0033003 k( 30) = ( 0.0000000 0.0000000 0.4264706), wk = 0.0033003 k( 31) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0033003 k( 32) = ( 0.0000000 0.0000000 0.4558824), wk = 0.0033003 k( 33) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0033003 k( 34) = ( 0.0000000 0.0000000 0.4852941), wk = 0.0033003 k( 35) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033003 k( 36) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033003 k( 37) = ( -0.0147059 0.0147059 0.5000000), wk = 0.0033003 k( 38) = ( -0.0294118 0.0294118 0.5000000), wk = 0.0033003 k( 39) = ( -0.0441177 0.0441177 0.5000000), wk = 0.0033003 k( 40) = ( -0.0588235 0.0588235 0.5000000), wk = 0.0033003 k( 41) = ( -0.0735294 0.0735294 0.5000000), wk = 0.0033003 k( 42) = ( -0.0882353 0.0882353 0.5000000), wk = 0.0033003 k( 43) = ( -0.1029412 0.1029412 0.5000000), wk = 0.0033003 k( 44) = ( -0.1176471 0.1176471 0.5000000), wk = 0.0033003 k( 45) = ( -0.1323529 0.1323529 0.5000000), wk = 0.0033003 k( 46) = ( -0.1470588 0.1470588 0.5000000), wk = 0.0033003 k( 47) = ( -0.1617647 0.1617647 0.5000000), wk = 0.0033003 k( 48) = ( -0.1764706 0.1764706 0.5000000), wk = 0.0033003 k( 49) = ( -0.1911765 0.1911765 0.5000000), wk = 0.0033003 k( 50) = ( -0.2058823 0.2058824 0.5000000), wk = 0.0033003 k( 51) = ( -0.2205882 0.2205882 0.5000000), wk = 0.0033003 k( 52) = ( -0.2352941 0.2352941 0.5000000), wk = 0.0033003 k( 53) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0033003 k( 54) = ( -0.2647059 0.2647059 0.5000000), wk = 0.0033003 k( 55) = ( -0.2794118 0.2794118 0.5000000), wk = 0.0033003 k( 56) = ( -0.2941177 0.2941177 0.5000000), wk = 0.0033003 k( 57) = ( -0.3088235 0.3088235 0.5000000), wk = 0.0033003 k( 58) = ( -0.3235294 0.3235294 0.5000000), wk = 0.0033003 k( 59) = ( -0.3382353 0.3382353 0.5000000), wk = 0.0033003 k( 60) = ( -0.3529412 0.3529412 0.5000000), wk = 0.0033003 k( 61) = ( -0.3676471 0.3676471 0.5000000), wk = 0.0033003 k( 62) = ( -0.3823529 0.3823529 0.5000000), wk = 0.0033003 k( 63) = ( -0.3970588 0.3970588 0.5000000), wk = 0.0033003 k( 64) = ( -0.4117647 0.4117647 0.5000000), wk = 0.0033003 k( 65) = ( -0.4264706 0.4264706 0.5000000), wk = 0.0033003 k( 66) = ( -0.4411765 0.4411765 0.5000000), wk = 0.0033003 k( 67) = ( -0.4558823 0.4558824 0.5000000), wk = 0.0033003 k( 68) = ( -0.4705882 0.4705882 0.5000000), wk = 0.0033003 k( 69) = ( -0.4852941 0.4852941 0.5000000), wk = 0.0033003 k( 70) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033003 k( 71) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033003 k( 72) = ( -0.4895833 0.4895833 0.4895833), wk = 0.0033003 k( 73) = ( -0.4791667 0.4791667 0.4791667), wk = 0.0033003 k( 74) = ( -0.4687500 0.4687500 0.4687500), wk = 0.0033003 k( 75) = ( -0.4583333 0.4583333 0.4583333), wk = 0.0033003 k( 76) = ( -0.4479167 0.4479167 0.4479167), wk = 0.0033003 k( 77) = ( -0.4375000 0.4375000 0.4375000), wk = 0.0033003 k( 78) = ( -0.4270833 0.4270833 0.4270833), wk = 0.0033003 k( 79) = ( -0.4166667 0.4166667 0.4166667), wk = 0.0033003 k( 80) = ( -0.4062500 0.4062500 0.4062500), wk = 0.0033003 k( 81) = ( -0.3958333 0.3958333 0.3958333), wk = 0.0033003 k( 82) = ( -0.3854167 0.3854167 0.3854167), wk = 0.0033003 k( 83) = ( -0.3750000 0.3750000 0.3750000), wk = 0.0033003 k( 84) = ( -0.3645833 0.3645833 0.3645833), wk = 0.0033003 k( 85) = ( -0.3541667 0.3541667 0.3541667), wk = 0.0033003 k( 86) = ( -0.3437500 0.3437500 0.3437500), wk = 0.0033003 k( 87) = ( -0.3333333 0.3333333 0.3333333), wk = 0.0033003 k( 88) = ( -0.3229167 0.3229167 0.3229167), wk = 0.0033003 k( 89) = ( -0.3125000 0.3125000 0.3125000), wk = 0.0033003 k( 90) = ( -0.3020833 0.3020833 0.3020833), wk = 0.0033003 k( 91) = ( -0.2916667 0.2916667 0.2916667), wk = 0.0033003 k( 92) = ( -0.2812500 0.2812500 0.2812500), wk = 0.0033003 k( 93) = ( -0.2708333 0.2708333 0.2708333), wk = 0.0033003 k( 94) = ( -0.2604167 0.2604167 0.2604167), wk = 0.0033003 k( 95) = ( -0.2500000 0.2500000 0.2500000), wk = 0.0033003 k( 96) = ( -0.2395833 0.2395833 0.2395833), wk = 0.0033003 k( 97) = ( -0.2291667 0.2291667 0.2291667), wk = 0.0033003 k( 98) = ( -0.2187500 0.2187500 0.2187500), wk = 0.0033003 k( 99) = ( -0.2083333 0.2083333 0.2083333), wk = 0.0033003 k( 100) = ( -0.1979167 0.1979167 0.1979167), wk = 0.0033003 k( 101) = ( -0.1875000 0.1875000 0.1875000), wk = 0.0033003 k( 102) = ( -0.1770833 0.1770833 0.1770833), wk = 0.0033003 k( 103) = ( -0.1666667 0.1666667 0.1666667), wk = 0.0033003 k( 104) = ( -0.1562500 0.1562500 0.1562500), wk = 0.0033003 k( 105) = ( -0.1458333 0.1458333 0.1458333), wk = 0.0033003 k( 106) = ( -0.1354167 0.1354167 0.1354167), wk = 0.0033003 k( 107) = ( -0.1250000 0.1250000 0.1250000), wk = 0.0033003 k( 108) = ( -0.1145833 0.1145833 0.1145833), wk = 0.0033003 k( 109) = ( -0.1041667 0.1041667 0.1041667), wk = 0.0033003 k( 110) = ( -0.0937500 0.0937500 0.0937500), wk = 0.0033003 k( 111) = ( -0.0833333 0.0833333 0.0833333), wk = 0.0033003 k( 112) = ( -0.0729167 0.0729167 0.0729167), wk = 0.0033003 k( 113) = ( -0.0625000 0.0625000 0.0625000), wk = 0.0033003 k( 114) = ( -0.0520833 0.0520833 0.0520833), wk = 0.0033003 k( 115) = ( -0.0416667 0.0416667 0.0416667), wk = 0.0033003 k( 116) = ( -0.0312500 0.0312500 0.0312500), wk = 0.0033003 k( 117) = ( -0.0208333 0.0208333 0.0208333), wk = 0.0033003 k( 118) = ( -0.0104167 0.0104167 0.0104167), wk = 0.0033003 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033003 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033003 k( 121) = ( 0.0091830 0.0091830 -0.0091830), wk = 0.0033003 k( 122) = ( 0.0183659 0.0183660 -0.0183660), wk = 0.0033003 k( 123) = ( 0.0275489 0.0275489 -0.0275489), wk = 0.0033003 k( 124) = ( 0.0367319 0.0367319 -0.0367319), wk = 0.0033003 k( 125) = ( 0.0459149 0.0459149 -0.0459149), wk = 0.0033003 k( 126) = ( 0.0550978 0.0550978 -0.0550978), wk = 0.0033003 k( 127) = ( 0.0642808 0.0642808 -0.0642808), wk = 0.0033003 k( 128) = ( 0.0734638 0.0734638 -0.0734638), wk = 0.0033003 k( 129) = ( 0.0826468 0.0826468 -0.0826468), wk = 0.0033003 k( 130) = ( 0.0918297 0.0918297 -0.0918297), wk = 0.0033003 k( 131) = ( 0.1010127 0.1010127 -0.1010127), wk = 0.0033003 k( 132) = ( 0.1101957 0.1101957 -0.1101957), wk = 0.0033003 k( 133) = ( 0.1193787 0.1193787 -0.1193787), wk = 0.0033003 k( 134) = ( 0.1285616 0.1285616 -0.1285616), wk = 0.0033003 k( 135) = ( 0.1377446 0.1377446 -0.1377446), wk = 0.0033003 k( 136) = ( 0.1469276 0.1469276 -0.1469276), wk = 0.0033003 k( 137) = ( 0.1561105 0.1561105 -0.1561105), wk = 0.0033003 k( 138) = ( 0.1652935 0.1652935 -0.1652935), wk = 0.0033003 k( 139) = ( 0.1744765 0.1744765 -0.1744765), wk = 0.0033003 k( 140) = ( 0.1836595 0.1836595 -0.1836595), wk = 0.0033003 k( 141) = ( 0.1928424 0.1928424 -0.1928424), wk = 0.0033003 k( 142) = ( 0.2020254 0.2020254 -0.2020254), wk = 0.0033003 k( 143) = ( 0.2112084 0.2112084 -0.2112084), wk = 0.0033003 k( 144) = ( 0.2203914 0.2203914 -0.2203914), wk = 0.0033003 k( 145) = ( 0.2295743 0.2295743 -0.2295743), wk = 0.0033003 k( 146) = ( 0.2387573 0.2387573 -0.2387573), wk = 0.0033003 k( 147) = ( 0.2479403 0.2479403 -0.2479403), wk = 0.0033003 k( 148) = ( 0.2571232 0.2571232 -0.2571232), wk = 0.0033003 k( 149) = ( 0.2663062 0.2663062 -0.2663062), wk = 0.0033003 k( 150) = ( 0.2754892 0.2754892 -0.2754892), wk = 0.0033003 k( 151) = ( 0.2846722 0.2846722 -0.2846722), wk = 0.0033003 k( 152) = ( 0.2938551 0.2938551 -0.2938551), wk = 0.0033003 k( 153) = ( 0.3030381 0.3030381 -0.3030381), wk = 0.0033003 k( 154) = ( 0.3122211 0.3122211 -0.3122211), wk = 0.0033003 k( 155) = ( 0.3214040 0.3214041 -0.3214041), wk = 0.0033003 k( 156) = ( 0.3305870 0.3305870 -0.3305870), wk = 0.0033003 k( 157) = ( 0.3397700 0.3397700 -0.3397700), wk = 0.0033003 k( 158) = ( 0.3489530 0.3489530 -0.3489530), wk = 0.0033003 k( 159) = ( 0.3581359 0.3581359 -0.3581359), wk = 0.0033003 k( 160) = ( 0.3673189 0.3673189 -0.3673189), wk = 0.0033003 k( 161) = ( 0.3765019 0.3765019 -0.3765019), wk = 0.0033003 k( 162) = ( 0.3856849 0.3856849 -0.3856849), wk = 0.0033003 k( 163) = ( 0.3948678 0.3948678 -0.3948678), wk = 0.0033003 k( 164) = ( 0.4040508 0.4040508 -0.4040508), wk = 0.0033003 k( 165) = ( 0.4132338 0.4132338 -0.4132338), wk = 0.0033003 k( 166) = ( 0.4224168 0.4224168 -0.4224168), wk = 0.0033003 k( 167) = ( 0.4315997 0.4315997 -0.4315997), wk = 0.0033003 k( 168) = ( 0.4407827 0.4407827 -0.4407827), wk = 0.0033003 k( 169) = ( 0.4407827 0.4407827 -0.4407827), wk = 0.0033003 k( 170) = ( 0.4360131 0.4360131 -0.4235131), wk = 0.0033003 k( 171) = ( 0.4312436 0.4312436 -0.4062436), wk = 0.0033003 k( 172) = ( 0.4264740 0.4264740 -0.3889740), wk = 0.0033003 k( 173) = ( 0.4217044 0.4217044 -0.3717044), wk = 0.0033003 k( 174) = ( 0.4169349 0.4169349 -0.3544349), wk = 0.0033003 k( 175) = ( 0.4121653 0.4121653 -0.3371653), wk = 0.0033003 k( 176) = ( 0.4073957 0.4073957 -0.3198957), wk = 0.0033003 k( 177) = ( 0.4026262 0.4026262 -0.3026262), wk = 0.0033003 k( 178) = ( 0.3978566 0.3978566 -0.2853566), wk = 0.0033003 k( 179) = ( 0.3930870 0.3930870 -0.2680870), wk = 0.0033003 k( 180) = ( 0.3883175 0.3883175 -0.2508175), wk = 0.0033003 k( 181) = ( 0.3835479 0.3835479 -0.2335479), wk = 0.0033003 k( 182) = ( 0.3787783 0.3787783 -0.2162783), wk = 0.0033003 k( 183) = ( 0.3740088 0.3740088 -0.1990088), wk = 0.0033003 k( 184) = ( 0.3692392 0.3692392 -0.1817392), wk = 0.0033003 k( 185) = ( 0.3644696 0.3644696 -0.1644696), wk = 0.0033003 k( 186) = ( 0.3597000 0.3597001 -0.1472001), wk = 0.0033003 k( 187) = ( 0.3549305 0.3549305 -0.1299305), wk = 0.0033003 k( 188) = ( 0.3501609 0.3501609 -0.1126609), wk = 0.0033003 k( 189) = ( 0.3453913 0.3453913 -0.0953913), wk = 0.0033003 k( 190) = ( 0.3406218 0.3406218 -0.0781218), wk = 0.0033003 k( 191) = ( 0.3358522 0.3358522 -0.0608522), wk = 0.0033003 k( 192) = ( 0.3310826 0.3310827 -0.0435826), wk = 0.0033003 k( 193) = ( 0.3263131 0.3263131 -0.0263131), wk = 0.0033003 k( 194) = ( 0.3215435 0.3215435 -0.0090435), wk = 0.0033003 k( 195) = ( 0.3167739 0.3167739 0.0082261), wk = 0.0033003 k( 196) = ( 0.3120044 0.3120044 0.0254956), wk = 0.0033003 k( 197) = ( 0.3072348 0.3072348 0.0427652), wk = 0.0033003 k( 198) = ( 0.3024652 0.3024652 0.0600348), wk = 0.0033003 k( 199) = ( 0.2976957 0.2976957 0.0773043), wk = 0.0033003 k( 200) = ( 0.2929261 0.2929261 0.0945739), wk = 0.0033003 k( 201) = ( 0.2881565 0.2881565 0.1118435), wk = 0.0033003 k( 202) = ( 0.2833870 0.2833870 0.1291130), wk = 0.0033003 k( 203) = ( 0.2786174 0.2786174 0.1463826), wk = 0.0033003 k( 204) = ( 0.2738478 0.2738478 0.1636522), wk = 0.0033003 k( 205) = ( 0.2690783 0.2690783 0.1809217), wk = 0.0033003 k( 206) = ( 0.2643087 0.2643087 0.1981913), wk = 0.0033003 k( 207) = ( 0.2595391 0.2595391 0.2154609), wk = 0.0033003 k( 208) = ( 0.2547696 0.2547696 0.2327304), wk = 0.0033003 k( 209) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033003 k( 210) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033003 k( 211) = ( 0.2395833 0.2604167 0.2395833), wk = 0.0033003 k( 212) = ( 0.2291667 0.2708333 0.2291667), wk = 0.0033003 k( 213) = ( 0.2187500 0.2812500 0.2187500), wk = 0.0033003 k( 214) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0033003 k( 215) = ( 0.1979167 0.3020833 0.1979167), wk = 0.0033003 k( 216) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0033003 k( 217) = ( 0.1770833 0.3229167 0.1770833), wk = 0.0033003 k( 218) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0033003 k( 219) = ( 0.1562500 0.3437500 0.1562500), wk = 0.0033003 k( 220) = ( 0.1458333 0.3541667 0.1458333), wk = 0.0033003 k( 221) = ( 0.1354167 0.3645833 0.1354167), wk = 0.0033003 k( 222) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0033003 k( 223) = ( 0.1145833 0.3854167 0.1145833), wk = 0.0033003 k( 224) = ( 0.1041667 0.3958333 0.1041667), wk = 0.0033003 k( 225) = ( 0.0937500 0.4062500 0.0937500), wk = 0.0033003 k( 226) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0033003 k( 227) = ( 0.0729167 0.4270833 0.0729167), wk = 0.0033003 k( 228) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0033003 k( 229) = ( 0.0520833 0.4479167 0.0520833), wk = 0.0033003 k( 230) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0033003 k( 231) = ( 0.0312500 0.4687500 0.0312500), wk = 0.0033003 k( 232) = ( 0.0208333 0.4791667 0.0208333), wk = 0.0033003 k( 233) = ( 0.0104167 0.4895833 0.0104167), wk = 0.0033003 k( 234) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033003 k( 235) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033003 k( 236) = ( -0.0137745 0.5018505 0.0137745), wk = 0.0033003 k( 237) = ( -0.0275489 0.5037011 0.0275489), wk = 0.0033003 k( 238) = ( -0.0413234 0.5055516 0.0413234), wk = 0.0033003 k( 239) = ( -0.0550978 0.5074022 0.0550978), wk = 0.0033003 k( 240) = ( -0.0688723 0.5092527 0.0688723), wk = 0.0033003 k( 241) = ( -0.0826468 0.5111032 0.0826468), wk = 0.0033003 k( 242) = ( -0.0964212 0.5129538 0.0964212), wk = 0.0033003 k( 243) = ( -0.1101957 0.5148043 0.1101957), wk = 0.0033003 k( 244) = ( -0.1239701 0.5166549 0.1239701), wk = 0.0033003 k( 245) = ( -0.1377446 0.5185054 0.1377446), wk = 0.0033003 k( 246) = ( -0.1515190 0.5203560 0.1515191), wk = 0.0033003 k( 247) = ( -0.1652935 0.5222065 0.1652935), wk = 0.0033003 k( 248) = ( -0.1790680 0.5240570 0.1790680), wk = 0.0033003 k( 249) = ( -0.1928424 0.5259076 0.1928424), wk = 0.0033003 k( 250) = ( -0.2066169 0.5277581 0.2066169), wk = 0.0033003 k( 251) = ( -0.2203914 0.5296087 0.2203914), wk = 0.0033003 k( 252) = ( -0.2341658 0.5314592 0.2341658), wk = 0.0033003 k( 253) = ( -0.2479403 0.5333097 0.2479403), wk = 0.0033003 k( 254) = ( -0.2617147 0.5351603 0.2617147), wk = 0.0033003 k( 255) = ( -0.2754892 0.5370108 0.2754892), wk = 0.0033003 k( 256) = ( -0.2892636 0.5388614 0.2892636), wk = 0.0033003 k( 257) = ( -0.3030381 0.5407119 0.3030381), wk = 0.0033003 k( 258) = ( -0.3168126 0.5425624 0.3168126), wk = 0.0033003 k( 259) = ( -0.3305870 0.5444130 0.3305870), wk = 0.0033003 k( 260) = ( -0.3443615 0.5462635 0.3443615), wk = 0.0033003 k( 261) = ( -0.3581359 0.5481141 0.3581359), wk = 0.0033003 k( 262) = ( -0.3719104 0.5499646 0.3719104), wk = 0.0033003 k( 263) = ( -0.3856849 0.5518151 0.3856849), wk = 0.0033003 k( 264) = ( -0.3994593 0.5536657 0.3994593), wk = 0.0033003 k( 265) = ( -0.4132338 0.5555162 0.4132338), wk = 0.0033003 k( 266) = ( -0.4270082 0.5573668 0.4270082), wk = 0.0033003 k( 267) = ( -0.4407827 0.5592173 0.4407827), wk = 0.0033003 k( 268) = ( -0.4407827 0.5592173 0.4407827), wk = 0.0033003 k( 269) = ( -0.4492423 0.5507577 0.4492423), wk = 0.0033003 k( 270) = ( -0.4577019 0.5422981 0.4577019), wk = 0.0033003 k( 271) = ( -0.4661615 0.5338385 0.4661615), wk = 0.0033003 k( 272) = ( -0.4746212 0.5253788 0.4746212), wk = 0.0033003 k( 273) = ( -0.4830808 0.5169192 0.4830808), wk = 0.0033003 k( 274) = ( -0.4915404 0.5084596 0.4915404), wk = 0.0033003 k( 275) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033003 k( 276) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033003 k( 277) = ( 0.0092593 0.0092593 0.4907407), wk = 0.0033003 k( 278) = ( 0.0185185 0.0185185 0.4814815), wk = 0.0033003 k( 279) = ( 0.0277778 0.0277778 0.4722222), wk = 0.0033003 k( 280) = ( 0.0370370 0.0370370 0.4629630), wk = 0.0033003 k( 281) = ( 0.0462963 0.0462963 0.4537037), wk = 0.0033003 k( 282) = ( 0.0555556 0.0555556 0.4444444), wk = 0.0033003 k( 283) = ( 0.0648148 0.0648148 0.4351852), wk = 0.0033003 k( 284) = ( 0.0740741 0.0740741 0.4259259), wk = 0.0033003 k( 285) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0033003 k( 286) = ( 0.0925926 0.0925926 0.4074074), wk = 0.0033003 k( 287) = ( 0.1018518 0.1018519 0.3981482), wk = 0.0033003 k( 288) = ( 0.1111111 0.1111111 0.3888889), wk = 0.0033003 k( 289) = ( 0.1203704 0.1203704 0.3796296), wk = 0.0033003 k( 290) = ( 0.1296296 0.1296296 0.3703704), wk = 0.0033003 k( 291) = ( 0.1388889 0.1388889 0.3611111), wk = 0.0033003 k( 292) = ( 0.1481482 0.1481482 0.3518519), wk = 0.0033003 k( 293) = ( 0.1574074 0.1574074 0.3425926), wk = 0.0033003 k( 294) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0033003 k( 295) = ( 0.1759259 0.1759259 0.3240741), wk = 0.0033003 k( 296) = ( 0.1851852 0.1851852 0.3148148), wk = 0.0033003 k( 297) = ( 0.1944444 0.1944444 0.3055556), wk = 0.0033003 k( 298) = ( 0.2037037 0.2037037 0.2962963), wk = 0.0033003 k( 299) = ( 0.2129630 0.2129630 0.2870370), wk = 0.0033003 k( 300) = ( 0.2222222 0.2222222 0.2777778), wk = 0.0033003 k( 301) = ( 0.2314815 0.2314815 0.2685185), wk = 0.0033003 k( 302) = ( 0.2407407 0.2407407 0.2592593), wk = 0.0033003 k( 303) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033003 Dense grid: 84199 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.49 Mb ( 622, 52) NL pseudopotentials 0.97 Mb ( 311, 204) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2341) G-vector shells 0.01 Mb ( 1036) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.97 Mb ( 622, 208) Each subspace H/S matrix 0.04 Mb ( 52, 52) Each matrix 0.32 Mb ( 204, 2, 52) The potential is recalculated from file : ./TiSb2.save/charge-density.dat Starting wfc are 32 randomized atomic wfcs + 20 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 7.5 secs Computing kpt #: 2 total cpu time spent up to now is 8.9 secs Computing kpt #: 3 total cpu time spent up to now is 10.4 secs Computing kpt #: 4 total cpu time spent up to now is 12.0 secs Computing kpt #: 5 total cpu time spent up to now is 13.5 secs Computing kpt #: 6 total cpu time spent up to now is 15.0 secs Computing kpt #: 7 total cpu time spent up to now is 16.5 secs Computing kpt #: 8 total cpu time spent up to now is 18.1 secs Computing kpt #: 9 total cpu time spent up to now is 19.6 secs Computing kpt #: 10 total cpu time spent up to now is 21.9 secs Computing kpt #: 11 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 24.6 secs Computing kpt #: 12 total cpu time spent up to now is 26.9 secs Computing kpt #: 13 total cpu time spent up to now is 28.9 secs Computing kpt #: 14 total cpu time spent up to now is 30.6 secs Computing kpt #: 15 total cpu time spent up to now is 32.5 secs Computing kpt #: 16 total cpu time spent up to now is 34.5 secs Computing kpt #: 17 total cpu time spent up to now is 36.5 secs Computing kpt #: 18 total cpu time spent up to now is 38.3 secs Computing kpt #: 19 total cpu time spent up to now is 40.0 secs Computing kpt #: 20 total cpu time spent up to now is 41.7 secs Computing kpt #: 21 total cpu time spent up to now is 43.5 secs Computing kpt #: 22 total cpu time spent up to now is 45.2 secs Computing kpt #: 23 total cpu time spent up to now is 47.0 secs Computing kpt #: 24 total cpu time spent up to now is 48.9 secs Computing kpt #: 25 total cpu time spent up to now is 50.7 secs Computing kpt #: 26 total cpu time spent up to now is 52.4 secs Computing kpt #: 27 total cpu time spent up to now is 54.3 secs Computing kpt #: 28 total cpu time spent up to now is 56.2 secs Computing kpt #: 29 total cpu time spent up to now is 58.0 secs Computing kpt #: 30 total cpu time spent up to now is 59.7 secs Computing kpt #: 31 total cpu time spent up to now is 61.4 secs Computing kpt #: 32 total cpu time spent up to now is 63.1 secs Computing kpt #: 33 total cpu time spent up to now is 64.8 secs Computing kpt #: 34 total cpu time spent up to now is 66.4 secs Computing kpt #: 35 total cpu time spent up to now is 68.0 secs Computing kpt #: 36 total cpu time spent up to now is 69.7 secs Computing kpt #: 37 total cpu time spent up to now is 71.6 secs Computing kpt #: 38 total cpu time spent up to now is 73.6 secs Computing kpt #: 39 total cpu time spent up to now is 75.8 secs Computing kpt #: 40 total cpu time spent up to now is 77.5 secs Computing kpt #: 41 total cpu time spent up to now is 79.1 secs Computing kpt #: 42 total cpu time spent up to now is 80.6 secs Computing kpt #: 43 total cpu time spent up to now is 82.0 secs Computing kpt #: 44 total cpu time spent up to now is 83.4 secs Computing kpt #: 45 total cpu time spent up to now is 84.7 secs Computing kpt #: 46 total cpu time spent up to now is 86.3 secs Computing kpt #: 47 total cpu time spent up to now is 87.9 secs Computing kpt #: 48 total cpu time spent up to now is 89.5 secs Computing kpt #: 49 total cpu time spent up to now is 91.0 secs Computing kpt #: 50 total cpu time spent up to now is 93.0 secs Computing kpt #: 51 total cpu time spent up to now is 94.9 secs Computing kpt #: 52 total cpu time spent up to now is 97.0 secs Computing kpt #: 53 total cpu time spent up to now is 99.2 secs Computing kpt #: 54 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 101.9 secs Computing kpt #: 55 total cpu time spent up to now is 104.2 secs Computing kpt #: 56 total cpu time spent up to now is 106.2 secs Computing kpt #: 57 total cpu time spent up to now is 107.9 secs Computing kpt #: 58 total cpu time spent up to now is 109.5 secs Computing kpt #: 59 total cpu time spent up to now is 111.2 secs Computing kpt #: 60 total cpu time spent up to now is 113.2 secs Computing kpt #: 61 total cpu time spent up to now is 115.1 secs Computing kpt #: 62 total cpu time spent up to now is 117.1 secs Computing kpt #: 63 total cpu time spent up to now is 118.8 secs Computing kpt #: 64 total cpu time spent up to now is 120.6 secs Computing kpt #: 65 total cpu time spent up to now is 122.3 secs Computing kpt #: 66 total cpu time spent up to now is 124.0 secs Computing kpt #: 67 total cpu time spent up to now is 125.7 secs Computing kpt #: 68 total cpu time spent up to now is 127.7 secs Computing kpt #: 69 total cpu time spent up to now is 130.1 secs Computing kpt #: 70 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 132.8 secs Computing kpt #: 71 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 135.4 secs Computing kpt #: 72 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 138.1 secs Computing kpt #: 73 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 140.7 secs Computing kpt #: 74 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 143.4 secs Computing kpt #: 75 total cpu time spent up to now is 145.6 secs Computing kpt #: 76 total cpu time spent up to now is 147.6 secs Computing kpt #: 77 total cpu time spent up to now is 149.9 secs Computing kpt #: 78 total cpu time spent up to now is 152.2 secs Computing kpt #: 79 total cpu time spent up to now is 154.6 secs Computing kpt #: 80 total cpu time spent up to now is 156.5 secs Computing kpt #: 81 total cpu time spent up to now is 158.8 secs Computing kpt #: 82 total cpu time spent up to now is 160.9 secs Computing kpt #: 83 total cpu time spent up to now is 163.1 secs Computing kpt #: 84 total cpu time spent up to now is 165.1 secs Computing kpt #: 85 total cpu time spent up to now is 167.4 secs Computing kpt #: 86 total cpu time spent up to now is 169.3 secs Computing kpt #: 87 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 172.0 secs Computing kpt #: 88 total cpu time spent up to now is 174.0 secs Computing kpt #: 89 total cpu time spent up to now is 176.3 secs Computing kpt #: 90 total cpu time spent up to now is 178.1 secs Computing kpt #: 91 total cpu time spent up to now is 179.8 secs Computing kpt #: 92 total cpu time spent up to now is 181.6 secs Computing kpt #: 93 total cpu time spent up to now is 183.3 secs Computing kpt #: 94 total cpu time spent up to now is 184.9 secs Computing kpt #: 95 total cpu time spent up to now is 186.7 secs Computing kpt #: 96 total cpu time spent up to now is 188.3 secs Computing kpt #: 97 total cpu time spent up to now is 189.9 secs Computing kpt #: 98 total cpu time spent up to now is 191.5 secs Computing kpt #: 99 total cpu time spent up to now is 193.1 secs Computing kpt #: 100 total cpu time spent up to now is 194.7 secs Computing kpt #: 101 total cpu time spent up to now is 196.3 secs Computing kpt #: 102 total cpu time spent up to now is 198.1 secs Computing kpt #: 103 total cpu time spent up to now is 199.7 secs Computing kpt #: 104 total cpu time spent up to now is 201.4 secs Computing kpt #: 105 total cpu time spent up to now is 203.2 secs Computing kpt #: 106 total cpu time spent up to now is 204.8 secs Computing kpt #: 107 total cpu time spent up to now is 206.5 secs Computing kpt #: 108 total cpu time spent up to now is 208.2 secs Computing kpt #: 109 total cpu time spent up to now is 209.8 secs Computing kpt #: 110 total cpu time spent up to now is 211.3 secs Computing kpt #: 111 total cpu time spent up to now is 212.9 secs Computing kpt #: 112 total cpu time spent up to now is 214.4 secs Computing kpt #: 113 total cpu time spent up to now is 215.9 secs Computing kpt #: 114 total cpu time spent up to now is 217.4 secs Computing kpt #: 115 total cpu time spent up to now is 218.9 secs Computing kpt #: 116 total cpu time spent up to now is 220.4 secs Computing kpt #: 117 total cpu time spent up to now is 221.8 secs Computing kpt #: 118 total cpu time spent up to now is 223.3 secs Computing kpt #: 119 total cpu time spent up to now is 224.7 secs Computing kpt #: 120 total cpu time spent up to now is 226.2 secs Computing kpt #: 121 total cpu time spent up to now is 227.7 secs Computing kpt #: 122 total cpu time spent up to now is 229.2 secs Computing kpt #: 123 total cpu time spent up to now is 230.8 secs Computing kpt #: 124 total cpu time spent up to now is 232.3 secs Computing kpt #: 125 total cpu time spent up to now is 233.8 secs Computing kpt #: 126 total cpu time spent up to now is 235.3 secs Computing kpt #: 127 total cpu time spent up to now is 236.8 secs Computing kpt #: 128 total cpu time spent up to now is 238.6 secs Computing kpt #: 129 total cpu time spent up to now is 240.1 secs Computing kpt #: 130 total cpu time spent up to now is 241.5 secs Computing kpt #: 131 total cpu time spent up to now is 243.0 secs Computing kpt #: 132 total cpu time spent up to now is 244.4 secs Computing kpt #: 133 total cpu time spent up to now is 245.8 secs Computing kpt #: 134 total cpu time spent up to now is 247.2 secs Computing kpt #: 135 total cpu time spent up to now is 249.1 secs Computing kpt #: 136 total cpu time spent up to now is 250.5 secs Computing kpt #: 137 total cpu time spent up to now is 251.9 secs Computing kpt #: 138 total cpu time spent up to now is 253.4 secs Computing kpt #: 139 total cpu time spent up to now is 254.9 secs Computing kpt #: 140 total cpu time spent up to now is 256.4 secs Computing kpt #: 141 total cpu time spent up to now is 257.9 secs Computing kpt #: 142 total cpu time spent up to now is 259.4 secs Computing kpt #: 143 total cpu time spent up to now is 260.9 secs Computing kpt #: 144 total cpu time spent up to now is 262.4 secs Computing kpt #: 145 total cpu time spent up to now is 263.9 secs Computing kpt #: 146 total cpu time spent up to now is 265.4 secs Computing kpt #: 147 total cpu time spent up to now is 266.8 secs Computing kpt #: 148 total cpu time spent up to now is 268.3 secs Computing kpt #: 149 total cpu time spent up to now is 269.8 secs Computing kpt #: 150 total cpu time spent up to now is 271.2 secs Computing kpt #: 151 total cpu time spent up to now is 272.6 secs Computing kpt #: 152 total cpu time spent up to now is 274.1 secs Computing kpt #: 153 total cpu time spent up to now is 275.5 secs Computing kpt #: 154 total cpu time spent up to now is 277.0 secs Computing kpt #: 155 total cpu time spent up to now is 278.4 secs Computing kpt #: 156 total cpu time spent up to now is 280.0 secs Computing kpt #: 157 total cpu time spent up to now is 281.7 secs Computing kpt #: 158 total cpu time spent up to now is 284.2 secs Computing kpt #: 159 total cpu time spent up to now is 285.9 secs Computing kpt #: 160 total cpu time spent up to now is 287.6 secs Computing kpt #: 161 total cpu time spent up to now is 289.3 secs Computing kpt #: 162 total cpu time spent up to now is 291.1 secs Computing kpt #: 163 total cpu time spent up to now is 292.8 secs Computing kpt #: 164 total cpu time spent up to now is 294.6 secs Computing kpt #: 165 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 297.2 secs Computing kpt #: 166 total cpu time spent up to now is 299.1 secs Computing kpt #: 167 total cpu time spent up to now is 300.8 secs Computing kpt #: 168 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 303.5 secs Computing kpt #: 169 total cpu time spent up to now is 305.3 secs Computing kpt #: 170 total cpu time spent up to now is 307.0 secs Computing kpt #: 171 total cpu time spent up to now is 308.7 secs Computing kpt #: 172 total cpu time spent up to now is 310.7 secs Computing kpt #: 173 total cpu time spent up to now is 312.4 secs Computing kpt #: 174 total cpu time spent up to now is 314.3 secs Computing kpt #: 175 total cpu time spent up to now is 316.1 secs Computing kpt #: 176 total cpu time spent up to now is 317.8 secs Computing kpt #: 177 total cpu time spent up to now is 319.7 secs Computing kpt #: 178 total cpu time spent up to now is 321.5 secs Computing kpt #: 179 total cpu time spent up to now is 323.3 secs Computing kpt #: 180 total cpu time spent up to now is 324.9 secs Computing kpt #: 181 total cpu time spent up to now is 326.6 secs Computing kpt #: 182 total cpu time spent up to now is 328.3 secs Computing kpt #: 183 total cpu time spent up to now is 330.0 secs Computing kpt #: 184 total cpu time spent up to now is 331.7 secs Computing kpt #: 185 total cpu time spent up to now is 333.2 secs Computing kpt #: 186 total cpu time spent up to now is 334.8 secs Computing kpt #: 187 total cpu time spent up to now is 336.3 secs Computing kpt #: 188 total cpu time spent up to now is 338.0 secs Computing kpt #: 189 total cpu time spent up to now is 339.7 secs Computing kpt #: 190 total cpu time spent up to now is 341.4 secs Computing kpt #: 191 total cpu time spent up to now is 343.1 secs Computing kpt #: 192 total cpu time spent up to now is 344.9 secs Computing kpt #: 193 total cpu time spent up to now is 346.7 secs Computing kpt #: 194 total cpu time spent up to now is 348.5 secs Computing kpt #: 195 total cpu time spent up to now is 350.3 secs Computing kpt #: 196 total cpu time spent up to now is 351.9 secs Computing kpt #: 197 total cpu time spent up to now is 353.6 secs Computing kpt #: 198 total cpu time spent up to now is 355.3 secs Computing kpt #: 199 total cpu time spent up to now is 357.1 secs Computing kpt #: 200 total cpu time spent up to now is 358.9 secs Computing kpt #: 201 total cpu time spent up to now is 360.7 secs Computing kpt #: 202 total cpu time spent up to now is 362.5 secs Computing kpt #: 203 total cpu time spent up to now is 364.4 secs Computing kpt #: 204 total cpu time spent up to now is 366.2 secs Computing kpt #: 205 total cpu time spent up to now is 368.0 secs Computing kpt #: 206 total cpu time spent up to now is 369.8 secs Computing kpt #: 207 total cpu time spent up to now is 371.5 secs Computing kpt #: 208 total cpu time spent up to now is 373.2 secs Computing kpt #: 209 total cpu time spent up to now is 374.9 secs Computing kpt #: 210 total cpu time spent up to now is 376.6 secs Computing kpt #: 211 total cpu time spent up to now is 378.2 secs Computing kpt #: 212 total cpu time spent up to now is 379.9 secs Computing kpt #: 213 total cpu time spent up to now is 381.5 secs Computing kpt #: 214 total cpu time spent up to now is 383.2 secs Computing kpt #: 215 total cpu time spent up to now is 384.9 secs Computing kpt #: 216 total cpu time spent up to now is 386.6 secs Computing kpt #: 217 total cpu time spent up to now is 388.3 secs Computing kpt #: 218 total cpu time spent up to now is 390.1 secs Computing kpt #: 219 total cpu time spent up to now is 391.9 secs Computing kpt #: 220 total cpu time spent up to now is 393.7 secs Computing kpt #: 221 total cpu time spent up to now is 395.4 secs Computing kpt #: 222 total cpu time spent up to now is 397.2 secs Computing kpt #: 223 total cpu time spent up to now is 398.9 secs Computing kpt #: 224 total cpu time spent up to now is 400.7 secs Computing kpt #: 225 total cpu time spent up to now is 402.4 secs Computing kpt #: 226 total cpu time spent up to now is 404.0 secs Computing kpt #: 227 total cpu time spent up to now is 405.5 secs Computing kpt #: 228 total cpu time spent up to now is 407.1 secs Computing kpt #: 229 total cpu time spent up to now is 408.6 secs Computing kpt #: 230 total cpu time spent up to now is 410.1 secs Computing kpt #: 231 total cpu time spent up to now is 411.6 secs Computing kpt #: 232 total cpu time spent up to now is 413.1 secs Computing kpt #: 233 total cpu time spent up to now is 414.5 secs Computing kpt #: 234 total cpu time spent up to now is 416.0 secs Computing kpt #: 235 total cpu time spent up to now is 417.5 secs Computing kpt #: 236 total cpu time spent up to now is 419.0 secs Computing kpt #: 237 total cpu time spent up to now is 420.5 secs Computing kpt #: 238 total cpu time spent up to now is 422.0 secs Computing kpt #: 239 total cpu time spent up to now is 423.5 secs Computing kpt #: 240 total cpu time spent up to now is 425.0 secs Computing kpt #: 241 total cpu time spent up to now is 426.6 secs Computing kpt #: 242 total cpu time spent up to now is 428.3 secs Computing kpt #: 243 total cpu time spent up to now is 429.8 secs Computing kpt #: 244 total cpu time spent up to now is 431.4 secs Computing kpt #: 245 total cpu time spent up to now is 433.1 secs Computing kpt #: 246 total cpu time spent up to now is 434.7 secs Computing kpt #: 247 total cpu time spent up to now is 436.3 secs Computing kpt #: 248 total cpu time spent up to now is 438.1 secs Computing kpt #: 249 total cpu time spent up to now is 439.8 secs Computing kpt #: 250 total cpu time spent up to now is 441.5 secs Computing kpt #: 251 total cpu time spent up to now is 443.2 secs Computing kpt #: 252 total cpu time spent up to now is 444.8 secs Computing kpt #: 253 total cpu time spent up to now is 446.3 secs Computing kpt #: 254 total cpu time spent up to now is 447.8 secs Computing kpt #: 255 total cpu time spent up to now is 449.5 secs Computing kpt #: 256 total cpu time spent up to now is 451.2 secs Computing kpt #: 257 total cpu time spent up to now is 452.9 secs Computing kpt #: 258 total cpu time spent up to now is 454.6 secs Computing kpt #: 259 total cpu time spent up to now is 456.3 secs Computing kpt #: 260 total cpu time spent up to now is 458.2 secs Computing kpt #: 261 total cpu time spent up to now is 460.1 secs Computing kpt #: 262 total cpu time spent up to now is 461.9 secs Computing kpt #: 263 total cpu time spent up to now is 463.8 secs Computing kpt #: 264 total cpu time spent up to now is 465.6 secs Computing kpt #: 265 total cpu time spent up to now is 467.3 secs Computing kpt #: 266 total cpu time spent up to now is 469.1 secs Computing kpt #: 267 total cpu time spent up to now is 471.1 secs Computing kpt #: 268 total cpu time spent up to now is 473.5 secs Computing kpt #: 269 total cpu time spent up to now is 475.9 secs Computing kpt #: 270 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 478.6 secs Computing kpt #: 271 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 481.3 secs Computing kpt #: 272 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 484.0 secs Computing kpt #: 273 total cpu time spent up to now is 485.7 secs Computing kpt #: 274 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 488.4 secs Computing kpt #: 275 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 491.1 secs Computing kpt #: 276 total cpu time spent up to now is 492.7 secs Computing kpt #: 277 total cpu time spent up to now is 494.5 secs Computing kpt #: 278 total cpu time spent up to now is 496.4 secs Computing kpt #: 279 total cpu time spent up to now is 498.4 secs Computing kpt #: 280 total cpu time spent up to now is 500.4 secs Computing kpt #: 281 total cpu time spent up to now is 502.5 secs Computing kpt #: 282 total cpu time spent up to now is 504.4 secs Computing kpt #: 283 total cpu time spent up to now is 506.2 secs Computing kpt #: 284 total cpu time spent up to now is 507.8 secs Computing kpt #: 285 total cpu time spent up to now is 509.5 secs Computing kpt #: 286 total cpu time spent up to now is 511.2 secs Computing kpt #: 287 total cpu time spent up to now is 512.9 secs Computing kpt #: 288 total cpu time spent up to now is 514.5 secs Computing kpt #: 289 total cpu time spent up to now is 516.2 secs Computing kpt #: 290 total cpu time spent up to now is 517.9 secs Computing kpt #: 291 total cpu time spent up to now is 519.6 secs Computing kpt #: 292 total cpu time spent up to now is 521.4 secs Computing kpt #: 293 total cpu time spent up to now is 523.1 secs Computing kpt #: 294 total cpu time spent up to now is 525.1 secs Computing kpt #: 295 total cpu time spent up to now is 527.1 secs Computing kpt #: 296 total cpu time spent up to now is 528.9 secs Computing kpt #: 297 total cpu time spent up to now is 530.9 secs Computing kpt #: 298 total cpu time spent up to now is 532.6 secs Computing kpt #: 299 total cpu time spent up to now is 534.6 secs Computing kpt #: 300 total cpu time spent up to now is 536.4 secs Computing kpt #: 301 total cpu time spent up to now is 538.6 secs Computing kpt #: 302 total cpu time spent up to now is 540.3 secs Computing kpt #: 303 total cpu time spent up to now is 542.0 secs ethr = 2.27E-08, avg # of iterations = 51.7 total cpu time spent up to now is 542.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 10503 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5151 -22.5151 -22.4727 -22.4727 -22.3014 -22.3014 -2.0938 -2.0938 1.9030 1.9030 2.8595 2.8595 2.8617 2.8617 5.8147 5.8147 6.4238 6.4238 6.6780 6.6780 6.8687 6.8687 7.1193 7.1193 7.6718 7.6718 7.6787 7.6787 8.1881 8.1881 9.0577 9.0577 9.7848 9.7848 11.0090 11.0090 11.4470 11.4470 12.0696 12.0696 12.1171 12.1171 k = 0.0000 0.0000 0.0173 ( 10515 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5151 -22.5151 -22.4727 -22.4727 -22.3014 -22.3014 -2.0924 -2.0924 1.9014 1.9014 2.8560 2.8560 2.8610 2.8610 5.8179 5.8179 6.4152 6.4152 6.6555 6.6555 6.9012 6.9012 7.1165 7.1165 7.6719 7.6719 7.6869 7.6869 8.1881 8.1881 9.0562 9.0562 9.7835 9.7835 11.0139 11.0139 11.4479 11.4479 12.0693 12.0693 12.1171 12.1171 k = 0.0000 0.0000 0.0346 ( 10521 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5151 -22.5151 -22.4727 -22.4727 -22.3014 -22.3014 -2.0882 -2.0882 1.8964 1.8964 2.8430 2.8430 2.8615 2.8615 5.8275 5.8275 6.3891 6.3891 6.6182 6.6182 6.9579 6.9579 7.1205 7.1205 7.6651 7.6651 7.7170 7.7170 8.1881 8.1881 9.0516 9.0516 9.7796 9.7796 11.0282 11.0282 11.4508 11.4508 12.0675 12.0675 12.1180 12.1180 k = 0.0000 0.0000 0.0519 ( 10517 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5152 -22.5152 -22.4726 -22.4726 -22.3014 -22.3014 -2.0812 -2.0812 1.8881 1.8881 2.8213 2.8213 2.8625 2.8625 5.8432 5.8432 6.3482 6.3482 6.5907 6.5907 6.9766 6.9766 7.1699 7.1699 7.6537 7.6537 7.7630 7.7630 8.1883 8.1883 9.0439 9.0439 9.7730 9.7730 11.0514 11.0514 11.4561 11.4561 12.0620 12.0620 12.1221 12.1221 k = 0.0000 0.0000 0.0691 ( 10509 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0972 -23.0972 -22.5486 -22.5486 -22.5152 -22.5152 -22.4726 -22.4726 -22.3014 -22.3014 -2.0715 -2.0715 1.8767 1.8767 2.7912 2.7912 2.8639 2.8639 5.8645 5.8645 6.3001 6.3001 6.5741 6.5741 6.9530 6.9530 7.2629 7.2629 7.6397 7.6397 7.8202 7.8202 8.1891 8.1891 9.0333 9.0333 9.7637 9.7637 11.0823 11.0823 11.4645 11.4645 12.0510 12.0510 12.1310 12.1310 k = 0.0000 0.0000 0.0864 ( 10499 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0973 -23.0973 -22.5486 -22.5486 -22.5152 -22.5152 -22.4726 -22.4726 -22.3014 -22.3014 -2.0589 -2.0589 1.8622 1.8622 2.7529 2.7529 2.8657 2.8657 5.8905 5.8905 6.2531 6.2531 6.5638 6.5638 6.9143 6.9143 7.3678 7.3678 7.6279 7.6279 7.8849 7.8849 8.1911 8.1911 9.0200 9.0200 9.7515 9.7515 11.1190 11.1190 11.4775 11.4775 12.0347 12.0347 12.1446 12.1446 k = 0.0000 0.0000 0.1037 ( 10489 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0973 -23.0973 -22.5486 -22.5486 -22.5153 -22.5153 -22.4725 -22.4725 -22.3014 -22.3014 -2.0436 -2.0436 1.8447 1.8447 2.7069 2.7069 2.8678 2.8678 5.9196 5.9196 6.2133 6.2133 6.5560 6.5560 6.8717 6.8717 7.4564 7.4564 7.6358 7.6358 7.9538 7.9538 8.1957 8.1957 9.0039 9.0039 9.7365 9.7365 11.1588 11.1588 11.4970 11.4970 12.0136 12.0136 12.1621 12.1621 k = 0.0000 0.0000 0.1210 ( 10485 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0973 -23.0973 -22.5485 -22.5485 -22.5153 -22.5153 -22.4725 -22.4725 -22.3014 -22.3014 -2.0256 -2.0256 1.8245 1.8245 2.6537 2.6537 2.8704 2.8704 5.9482 5.9482 6.1863 6.1863 6.5477 6.5477 6.8302 6.8302 7.4873 7.4873 7.7004 7.7004 8.0239 8.0239 8.2055 8.2055 8.9855 8.9855 9.7185 9.7185 11.1984 11.1984 11.5258 11.5258 11.9887 11.9887 12.1830 12.1830 k = 0.0000 0.0000 0.1383 ( 10499 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0974 -23.0974 -22.5485 -22.5485 -22.5154 -22.5154 -22.4725 -22.4725 -22.3014 -22.3014 -2.0049 -2.0049 1.8014 1.8014 2.5939 2.5939 2.8732 2.8732 5.9712 5.9712 6.1784 6.1784 6.5362 6.5362 6.7933 6.7933 7.4730 7.4730 7.8052 7.8052 8.0903 8.0903 8.2267 8.2267 8.9648 8.9648 9.6975 9.6975 11.2339 11.2339 11.5669 11.5669 11.9605 11.9605 12.2063 12.2063 k = 0.0000 0.0000 0.1556 ( 10499 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0974 -23.0974 -22.5485 -22.5485 -22.5155 -22.5155 -22.4724 -22.4724 -22.3014 -22.3014 -1.9815 -1.9815 1.7758 1.7758 2.5283 2.5283 2.8764 2.8764 5.9838 5.9838 6.1945 6.1945 6.5192 6.5192 6.7640 6.7640 7.4435 7.4435 7.9130 7.9130 8.1492 8.1492 8.2684 8.2684 8.9424 8.9424 9.6736 9.6736 11.2627 11.2627 11.6223 11.6223 11.9298 11.9298 12.2306 12.2306 k = 0.0000 0.0000 0.1729 ( 10493 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1674 -23.1674 -23.0975 -23.0975 -22.5485 -22.5485 -22.5156 -22.5156 -22.4723 -22.4723 -22.3014 -22.3014 -1.9554 -1.9554 1.7474 1.7474 2.4578 2.4578 2.8798 2.8798 5.9876 5.9876 6.2326 6.2326 6.4954 6.4954 6.7440 6.7440 7.4081 7.4081 7.9998 7.9998 8.2120 8.2120 8.3321 8.3321 8.9185 8.9185 9.6468 9.6468 11.2843 11.2843 11.6917 11.6917 11.8974 11.8974 12.2402 12.2403 k = 0.0000 0.0000 0.1901 ( 10503 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1674 -23.1674 -23.0975 -23.0975 -22.5485 -22.5485 -22.5156 -22.5156 -22.4723 -22.4723 -22.3014 -22.3014 -1.9268 -1.9268 1.7162 1.7162 2.3835 2.3835 2.8835 2.8835 5.9887 5.9887 6.2858 6.2858 6.4655 6.4655 6.7332 6.7332 7.3698 7.3698 8.0501 8.0501 8.2980 8.2980 8.4089 8.4089 8.8941 8.8941 9.6174 9.6174 11.2996 11.2996 11.7734 11.7734 11.8640 11.8640 12.2209 12.2210 k = 0.0000 0.0000 0.2074 ( 10503 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1674 -23.1674 -23.0976 -23.0976 -22.5485 -22.5485 -22.5157 -22.5157 -22.4722 -22.4722 -22.3014 -22.3014 -1.8955 -1.8955 1.6821 1.6821 2.3065 2.3065 2.8875 2.8875 5.9916 5.9916 6.3468 6.3468 6.4329 6.4329 6.7302 6.7302 7.3300 7.3300 8.0730 8.0730 8.4002 8.4002 8.4926 8.4926 8.8702 8.8702 9.5861 9.5861 11.3103 11.3103 11.8302 11.8302 11.8651 11.8651 12.1970 12.1970 k = 0.0000 0.0000 0.2247 ( 10505 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1674 -23.1674 -23.0977 -23.0977 -22.5485 -22.5485 -22.5158 -22.5158 -22.4722 -22.4722 -22.3014 -22.3014 -1.8618 -1.8618 1.6445 1.6445 2.2282 2.2282 2.8916 2.8916 5.9985 5.9985 6.3782 6.3782 6.4342 6.4342 6.7331 6.7331 7.2898 7.2898 8.0829 8.0829 8.5001 8.5001 8.5817 8.5817 8.8498 8.8498 9.5541 9.5541 11.3178 11.3178 11.7969 11.7969 11.9641 11.9641 12.1712 12.1712 k = 0.0000 0.0000 0.2420 ( 10509 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1673 -23.1673 -23.0977 -23.0977 -22.5484 -22.5484 -22.5159 -22.5159 -22.4721 -22.4721 -22.3014 -22.3014 -1.8255 -1.8255 1.6030 1.6030 2.1501 2.1501 2.8959 2.8959 6.0102 6.0102 6.3456 6.3456 6.5031 6.5031 6.7407 6.7407 7.2502 7.2502 8.0869 8.0869 8.5819 8.5819 8.6749 8.6749 8.8395 8.8395 9.5231 9.5231 11.3229 11.3229 11.7644 11.7644 12.0684 12.0684 12.1442 12.1442 k = 0.0000 0.0000 0.2593 ( 10517 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1673 -23.1673 -23.0978 -23.0978 -22.5484 -22.5484 -22.5160 -22.5160 -22.4720 -22.4720 -22.3014 -22.3014 -1.7869 -1.7869 1.5568 1.5568 2.0739 2.0739 2.9003 2.9003 6.0267 6.0267 6.3073 6.3073 6.5803 6.5803 6.7524 6.7524 7.2122 7.2122 8.0880 8.0880 8.6318 8.6318 8.7634 8.7634 8.8549 8.8549 9.4964 9.4964 11.3265 11.3265 11.7329 11.7329 12.1152 12.1152 12.1759 12.1759 k = 0.0000 0.0000 0.2766 ( 10519 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1673 -23.1673 -23.0979 -23.0979 -22.5484 -22.5484 -22.5161 -22.5161 -22.4719 -22.4719 -22.3014 -22.3014 -1.7461 -1.7461 1.5051 1.5051 2.0012 2.0012 2.9048 2.9048 6.0475 6.0475 6.2696 6.2696 6.6568 6.6568 6.7696 6.7696 7.1772 7.1772 8.0875 8.0875 8.6432 8.6432 8.8328 8.8328 8.9098 8.9098 9.4787 9.4787 11.3289 11.3289 11.7025 11.7025 12.0861 12.0861 12.2762 12.2762 k = 0.0000 0.0000 0.2939 ( 10521 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1672 -23.1672 -23.0979 -23.0979 -22.5484 -22.5484 -22.5162 -22.5162 -22.4719 -22.4719 -22.3014 -22.3014 -1.7030 -1.7030 1.4470 1.4470 1.9337 1.9337 2.9093 2.9093 6.0715 6.0715 6.2345 6.2345 6.7219 6.7219 6.7987 6.7987 7.1480 7.1480 8.0862 8.0862 8.6291 8.6291 8.8796 8.8796 8.9875 8.9875 9.4760 9.4760 11.3305 11.3305 11.6726 11.6726 12.0560 12.0560 12.3424 12.3424 k = 0.0000 0.0000 0.3111 ( 10527 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1672 -23.1672 -23.0980 -23.0980 -22.5484 -22.5484 -22.5163 -22.5163 -22.4718 -22.4718 -22.3014 -22.3014 -1.6578 -1.6578 1.3824 1.3824 1.8725 1.8725 2.9139 2.9139 6.0951 6.0951 6.2057 6.2057 6.7613 6.7613 6.8477 6.8477 7.1301 7.1301 8.0843 8.0843 8.6035 8.6035 8.9022 8.9022 9.0703 9.0703 9.4927 9.4927 11.3314 11.3314 11.6428 11.6428 12.0251 12.0251 12.3648 12.3648 k = 0.0000 0.0000 0.3284 ( 10523 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1672 -23.1672 -23.0981 -23.0981 -22.5484 -22.5484 -22.5164 -22.5164 -22.4717 -22.4717 -22.3014 -22.3014 -1.6108 -1.6108 1.3113 1.3113 1.8181 1.8181 2.9184 2.9184 6.1071 6.1071 6.1943 6.1943 6.7845 6.7845 6.8943 6.8943 7.1352 7.1352 8.0822 8.0822 8.5728 8.5728 8.8988 8.8988 9.1545 9.1545 9.5279 9.5279 11.3319 11.3319 11.6118 11.6118 11.9937 11.9937 12.3729 12.3729 k = 0.0000 0.0000 0.3457 ( 10517 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1672 -23.1672 -23.0981 -23.0981 -22.5483 -22.5483 -22.5165 -22.5165 -22.4716 -22.4716 -22.3014 -22.3014 -1.5620 -1.5620 1.2347 1.2347 1.7705 1.7705 2.9228 2.9228 6.0952 6.0952 6.2122 6.2122 6.8029 6.8029 6.9148 6.9148 7.1747 7.1747 8.0800 8.0800 8.5393 8.5393 8.8744 8.8744 9.2388 9.2388 9.5755 9.5755 11.3321 11.3321 11.5786 11.5786 11.9620 11.9620 12.3771 12.3771 k = 0.0000 0.0000 0.3630 ( 10509 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1671 -23.1671 -23.0982 -23.0982 -22.5483 -22.5483 -22.5166 -22.5166 -22.4716 -22.4716 -22.3014 -22.3014 -1.5116 -1.5116 1.1537 1.1537 1.7289 1.7289 2.9271 2.9271 6.0711 6.0711 6.2476 6.2476 6.8191 6.8191 6.9121 6.9121 7.2421 7.2421 8.0778 8.0778 8.5042 8.5042 8.8364 8.8364 9.3224 9.3224 9.6285 9.6285 11.3320 11.3320 11.5420 11.5420 11.9300 11.9300 12.3799 12.3799 k = 0.0000 0.0000 0.3803 ( 10517 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1671 -23.1671 -23.0983 -23.0983 -22.5483 -22.5483 -22.5167 -22.5167 -22.4715 -22.4715 -22.3014 -22.3014 -1.4600 -1.4600 1.0700 1.0700 1.6928 1.6928 2.9313 2.9313 6.0447 6.0447 6.2899 6.2899 6.8325 6.8325 6.9009 6.9009 7.3219 7.3219 8.0758 8.0758 8.4679 8.4679 8.7914 8.7914 9.4046 9.4046 9.6817 9.6817 11.3318 11.3318 11.5007 11.5007 11.8979 11.8979 12.3820 12.3820 k = 0.0000 0.0000 0.3976 ( 10528 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1671 -23.1671 -23.0983 -23.0983 -22.5483 -22.5483 -22.5168 -22.5168 -22.4714 -22.4714 -22.3014 -22.3014 -1.4074 -1.4074 0.9848 0.9848 1.6613 1.6613 2.9353 2.9353 6.0188 6.0188 6.3355 6.3355 6.8394 6.8394 6.8929 6.8929 7.4047 7.4047 8.0742 8.0742 8.4306 8.4306 8.7448 8.7448 9.4845 9.4845 9.7319 9.7319 11.3313 11.3313 11.4539 11.4539 11.8659 11.8659 12.3837 12.3837 k = 0.0000 0.0000 0.4148 ( 10540 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1671 -23.1671 -23.0984 -23.0984 -22.5483 -22.5483 -22.5169 -22.5169 -22.4714 -22.4714 -22.3014 -22.3014 -1.3543 -1.3543 0.8997 0.8997 1.6338 1.6338 2.9391 2.9391 5.9945 5.9945 6.3827 6.3827 6.8360 6.8360 6.8957 6.8957 7.4845 7.4845 8.0732 8.0732 8.3921 8.3921 8.7010 8.7010 9.5616 9.5616 9.7774 9.7774 11.3308 11.3308 11.4013 11.4013 11.8342 11.8342 12.3850 12.3850 k = 0.0000 0.0000 0.4321 ( 10546 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1670 -23.1670 -23.0984 -23.0984 -22.5483 -22.5483 -22.5169 -22.5169 -22.4713 -22.4713 -22.3014 -22.3014 -1.3011 -1.3011 0.8158 0.8158 1.6099 1.6099 2.9426 2.9426 5.9721 5.9721 6.4296 6.4296 6.8274 6.8274 6.9063 6.9063 7.5572 7.5572 8.0728 8.0728 8.3529 8.3529 8.6641 8.6641 9.6351 9.6351 9.8176 9.8176 11.3290 11.3290 11.3443 11.3443 11.8029 11.8029 12.3862 12.3862 k = 0.0000 0.0000 0.4494 ( 10552 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1670 -23.1670 -23.0985 -23.0985 -22.5483 -22.5483 -22.5170 -22.5170 -22.4713 -22.4713 -22.3014 -22.3014 -1.2485 -1.2485 0.7345 0.7345 1.5890 1.5890 2.9459 2.9459 5.9519 5.9519 6.4743 6.4743 6.8206 6.8206 6.9194 6.9194 7.6186 7.6186 8.0731 8.0731 8.3138 8.3138 8.6372 8.6372 9.7043 9.7043 9.8520 9.8520 11.2795 11.2795 11.3305 11.3305 11.7726 11.7726 12.3873 12.3873 k = 0.0000 0.0000 0.4667 ( 10536 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1670 -23.1670 -23.0985 -23.0985 -22.5482 -22.5482 -22.5171 -22.5171 -22.4712 -22.4712 -22.3014 -22.3014 -1.1972 -1.1972 0.6570 0.6570 1.5710 1.5710 2.9488 2.9488 5.9338 5.9338 6.5143 6.5143 6.8197 6.8197 6.9328 6.9328 7.6650 7.6650 8.0739 8.0739 8.2768 8.2768 8.6224 8.6224 9.7684 9.7684 9.8808 9.8808 11.2141 11.2141 11.3298 11.3298 11.7435 11.7435 12.3881 12.3882 k = 0.0000 0.0000 0.4840 ( 10524 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1670 -23.1670 -23.0986 -23.0986 -22.5482 -22.5482 -22.5171 -22.5171 -22.4712 -22.4712 -22.3014 -22.3014 -1.1483 -1.1483 0.5846 0.5846 1.5557 1.5557 2.9514 2.9514 5.9181 5.9181 6.5469 6.5469 6.8273 6.8273 6.9454 6.9454 7.6941 7.6941 8.0742 8.0742 8.2447 8.2447 8.6205 8.6205 9.8265 9.8265 9.9042 9.9042 11.1480 11.1480 11.3293 11.3293 11.7162 11.7162 12.3889 12.3889 k = 0.0000 0.0000 0.5013 ( 10532 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1670 -23.1670 -23.0986 -23.0986 -22.5482 -22.5482 -22.5172 -22.5172 -22.4711 -22.4711 -22.3014 -22.3014 -1.1028 -1.1028 0.5190 0.5190 1.5430 1.5430 2.9537 2.9537 5.9047 5.9047 6.5703 6.5703 6.8441 6.8441 6.9568 6.9568 7.7060 7.7060 8.0727 8.0727 8.2197 8.2197 8.6300 8.6300 9.8778 9.8778 9.9225 9.9225 11.0843 11.0843 11.3289 11.3289 11.6915 11.6915 12.3895 12.3895 k = 0.0000 0.0000 0.5186 ( 10536 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0986 -23.0986 -22.5482 -22.5482 -22.5172 -22.5172 -22.4711 -22.4711 -22.3014 -22.3014 -1.0622 -1.0622 0.4616 0.4616 1.5326 1.5326 2.9556 2.9556 5.8937 5.8937 6.5850 6.5850 6.8683 6.8683 6.9664 6.9664 7.7034 7.7034 8.0691 8.0691 8.2026 8.2026 8.6478 8.6478 9.9213 9.9213 9.9362 9.9362 11.0259 11.0259 11.3285 11.3285 11.6699 11.6699 12.3900 12.3901 k = 0.0000 0.0000 0.5358 ( 10540 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5172 -22.5172 -22.4711 -22.4711 -22.3014 -22.3014 -1.0281 -1.0281 0.4142 0.4142 1.5246 1.5246 2.9570 2.9570 5.8851 5.8851 6.5930 6.5930 6.8956 6.8956 6.9739 6.9739 7.6918 7.6918 8.0642 8.0642 8.1921 8.1921 8.6692 8.6692 9.9458 9.9458 9.9564 9.9564 10.9763 10.9763 11.3282 11.3282 11.6522 11.6522 12.3904 12.3905 k = 0.0000 0.0000 0.5531 ( 10548 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4711 -22.4711 -22.3014 -22.3014 -1.0021 -1.0021 0.3787 0.3787 1.5190 1.5190 2.9581 2.9581 5.8790 5.8790 6.5968 6.5968 6.9209 6.9209 6.9788 6.9788 7.6772 7.6772 8.0596 8.0596 8.1861 8.1861 8.6891 8.6891 9.9521 9.9521 9.9820 9.9820 10.9383 10.9383 11.3280 11.3280 11.6390 11.6390 12.3907 12.3907 k = 0.0000 0.0000 0.5704 ( 10560 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4710 -22.4710 -22.3014 -22.3014 -0.9858 -0.9858 0.3566 0.3566 1.5156 1.5156 2.9587 2.9587 5.8753 5.8753 6.5984 6.5984 6.9391 6.9391 6.9812 6.9812 7.6655 7.6655 8.0565 8.0565 8.1831 8.1831 8.7031 8.7031 9.9555 9.9555 9.9976 9.9976 10.9144 10.9144 11.3279 11.3279 11.6308 11.6308 12.3909 12.3909 k = 0.0000 0.0000 0.5877 ( 10542 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4710 -22.4710 -22.3014 -22.3014 -0.9803 -0.9803 0.3491 0.3491 1.5144 1.5144 2.9589 2.9589 5.8741 5.8741 6.5989 6.5989 6.9459 6.9459 6.9817 6.9817 7.6611 7.6611 8.0554 8.0554 8.1822 8.1822 8.7081 8.7081 9.9565 9.9565 10.0029 10.0029 10.9062 10.9062 11.3279 11.3279 11.6281 11.6281 12.3910 12.3910 k = 0.0000 0.0000 0.5877 ( 10542 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4710 -22.4710 -22.3014 -22.3014 -0.9803 -0.9803 0.3491 0.3491 1.5144 1.5144 2.9589 2.9589 5.8741 5.8741 6.5989 6.5989 6.9459 6.9459 6.9817 6.9817 7.6611 7.6611 8.0554 8.0554 8.1822 8.1822 8.7081 8.7081 9.9565 9.9565 10.0029 10.0029 10.9062 10.9062 11.3279 11.3279 11.6281 11.6281 12.3910 12.3910 k =-0.0147 0.0091 0.5877 ( 10562 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4710 -22.4710 -22.3014 -22.3014 -0.9789 -0.9789 0.3503 0.3503 1.5130 1.5130 2.9571 2.9571 5.8643 5.8643 6.5906 6.5906 6.8760 6.8760 7.0772 7.0772 7.6367 7.6367 8.0539 8.0539 8.2041 8.2041 8.7110 8.7110 9.9571 9.9571 10.0041 10.0041 10.9088 10.9088 11.3191 11.3191 11.6365 11.6365 12.3903 12.3903 k =-0.0294 0.0182 0.5877 ( 10566 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4710 -22.4710 -22.3014 -22.3014 -0.9750 -0.9750 0.3536 0.3536 1.5088 1.5088 2.9516 2.9516 5.8366 5.8366 6.5555 6.5555 6.8370 6.8370 7.2013 7.2013 7.5735 7.5735 8.0494 8.0494 8.2601 8.2601 8.7196 8.7196 9.9586 9.9586 10.0076 10.0076 10.9163 10.9163 11.2957 11.2957 11.6590 11.6590 12.3884 12.3884 k =-0.0441 0.0273 0.5877 ( 10566 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4710 -22.4710 -22.3014 -22.3014 -0.9685 -0.9685 0.3592 0.3592 1.5019 1.5019 2.9422 2.9422 5.7945 5.7945 6.4899 6.4899 6.8495 6.8495 7.3304 7.3304 7.4909 7.4909 8.0423 8.0423 8.3331 8.3331 8.7347 8.7347 9.9612 9.9612 10.0134 10.0134 10.9286 10.9286 11.2630 11.2630 11.6903 11.6903 12.3851 12.3852 k =-0.0588 0.0363 0.5877 ( 10570 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5174 -22.5174 -22.4710 -22.4710 -22.3014 -22.3014 -0.9594 -0.9594 0.3669 0.3669 1.4923 1.4923 2.9285 2.9285 5.7422 5.7422 6.4109 6.4109 6.8947 6.8947 7.3701 7.3701 7.4905 7.4905 8.0331 8.0331 8.4112 8.4112 8.7577 8.7577 9.9647 9.9647 10.0216 10.0216 10.9450 10.9450 11.2261 11.2261 11.7261 11.7261 12.3269 12.3270 k =-0.0735 0.0454 0.5877 ( 10558 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1669 -23.1669 -23.0988 -23.0988 -22.5482 -22.5482 -22.5174 -22.5174 -22.4710 -22.4710 -22.3014 -22.3014 -0.9477 -0.9477 0.3768 0.3768 1.4804 1.4804 2.9103 2.9103 5.6831 5.6831 6.3318 6.3318 6.9568 6.9568 7.2725 7.2725 7.6237 7.6237 8.0235 8.0235 8.4869 8.4869 8.7905 8.7905 9.9692 9.9692 10.0320 10.0320 10.9644 10.9644 11.1889 11.1889 11.7634 11.7634 12.2235 12.2236 k =-0.0882 0.0545 0.5877 ( 10548 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1669 -23.1669 -23.0988 -23.0988 -22.5482 -22.5482 -22.5174 -22.5174 -22.4709 -22.4709 -22.3014 -22.3014 -0.9334 -0.9334 0.3888 0.3888 1.4663 1.4663 2.8870 2.8870 5.6199 5.6199 6.2588 6.2588 7.0230 7.0230 7.1700 7.1700 7.7598 7.7598 8.0183 8.0183 8.5553 8.5553 8.8351 8.8351 9.9744 9.9744 10.0448 10.0448 10.9836 10.9836 11.1563 11.1563 11.8001 11.8001 12.1153 12.1153 k =-0.1029 0.0636 0.5877 ( 10544 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1669 -23.1669 -23.0988 -23.0988 -22.5482 -22.5482 -22.5175 -22.5175 -22.4709 -22.4709 -22.3014 -22.3014 -0.9165 -0.9165 0.4029 0.4029 1.4502 1.4502 2.8582 2.8582 5.5545 5.5545 6.1945 6.1945 7.0212 7.0212 7.1387 7.1387 7.8708 7.8708 8.0389 8.0389 8.6141 8.6141 8.8921 8.8921 9.9804 9.9804 10.0599 10.0599 10.9952 10.9952 11.1366 11.1366 11.8331 11.8331 12.0067 12.0067 k =-0.1176 0.0727 0.5877 ( 10550 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1668 -23.1668 -23.0989 -23.0989 -22.5482 -22.5482 -22.5176 -22.5176 -22.4708 -22.4708 -22.3014 -22.3014 -0.8970 -0.8970 0.4190 0.4190 1.4324 1.4324 2.8236 2.8236 5.4881 5.4881 6.1404 6.1404 6.9182 6.9182 7.2107 7.2107 7.9099 7.9099 8.1305 8.1305 8.6644 8.6644 8.9598 8.9598 9.9871 9.9871 10.0773 10.0773 10.9890 10.9890 11.1408 11.1408 11.8407 11.8407 11.9211 11.9211 k =-0.1324 0.0818 0.5877 ( 10556 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1668 -23.1668 -23.0989 -23.0989 -22.5481 -22.5481 -22.5176 -22.5176 -22.4708 -22.4708 -22.3014 -22.3014 -0.8750 -0.8750 0.4370 0.4370 1.4132 1.4132 2.7828 2.7828 5.4217 5.4217 6.0973 6.0973 6.8042 6.8042 7.2951 7.2951 7.9048 7.9048 8.2641 8.2641 8.7094 8.7094 9.0343 9.0343 9.9943 9.9943 10.0969 10.0969 10.9666 10.9666 11.1676 11.1676 11.7584 11.7584 11.9243 11.9243 k =-0.1471 0.0908 0.5877 ( 10544 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1668 -23.1668 -23.0990 -23.0990 -22.5481 -22.5481 -22.5177 -22.5177 -22.4707 -22.4707 -22.3014 -22.3014 -0.8505 -0.8505 0.4568 0.4568 1.3928 1.3928 2.7358 2.7358 5.3559 5.3559 6.0657 6.0657 6.6884 6.6884 7.3817 7.3817 7.8887 7.8887 8.4052 8.4052 8.7530 8.7530 9.1123 9.1123 10.0019 10.0019 10.1188 10.1188 10.9375 10.9375 11.2072 11.2072 11.6524 11.6524 11.9523 11.9523 k =-0.1618 0.0999 0.5877 ( 10538 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1668 -23.1668 -23.0990 -23.0990 -22.5481 -22.5481 -22.5178 -22.5178 -22.4707 -22.4707 -22.3014 -22.3014 -0.8234 -0.8234 0.4785 0.4785 1.3715 1.3715 2.6825 2.6825 5.2914 5.2914 6.0457 6.0457 6.5726 6.5726 7.4676 7.4676 7.8702 7.8702 8.5424 8.5424 8.7994 8.7994 9.1913 9.1913 10.0099 10.0099 10.1430 10.1430 10.9075 10.9075 11.2521 11.2521 11.5495 11.5495 11.9817 11.9817 k =-0.1765 0.1090 0.5877 ( 10534 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1667 -23.1667 -23.0991 -23.0991 -22.5481 -22.5481 -22.5179 -22.5179 -22.4706 -22.4706 -22.3014 -22.3014 -0.7939 -0.7939 0.5017 0.5017 1.3495 1.3495 2.6231 2.6231 5.2283 5.2283 6.0371 6.0371 6.4575 6.4575 7.5494 7.5494 7.8538 7.8538 8.6663 8.6663 8.8554 8.8554 9.2697 9.2697 10.0182 10.0182 10.1694 10.1694 10.8791 10.8791 11.2910 11.2910 11.4629 11.4629 12.0101 12.0102 k =-0.1912 0.1181 0.5877 ( 10546 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1667 -23.1667 -23.0991 -23.0991 -22.5481 -22.5481 -22.5179 -22.5179 -22.4705 -22.4705 -22.3014 -22.3014 -0.7618 -0.7618 0.5265 0.5265 1.3272 1.3272 2.5580 2.5580 5.1670 5.1670 6.0392 6.0392 6.3440 6.3440 7.6207 7.6207 7.8461 7.8461 8.7637 8.7637 8.9321 8.9321 9.3465 9.3465 10.0266 10.0266 10.1980 10.1980 10.8536 10.8536 11.2817 11.2817 11.4360 11.4360 12.0373 12.0374 k =-0.2059 0.1272 0.5877 ( 10554 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1667 -23.1667 -23.0992 -23.0992 -22.5480 -22.5480 -22.5180 -22.5180 -22.4705 -22.4705 -22.3014 -22.3014 -0.7274 -0.7274 0.5526 0.5526 1.3046 1.3046 2.4876 2.4876 5.1078 5.1078 6.0506 6.0506 6.2335 6.2335 7.6679 7.6679 7.8605 7.8605 8.8310 8.8310 9.0301 9.0301 9.4210 9.4210 10.0352 10.0352 10.2288 10.2288 10.8320 10.8320 11.2157 11.2157 11.4789 11.4789 12.0632 12.0632 k =-0.2206 0.1363 0.5877 ( 10552 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1667 -23.1667 -23.0993 -23.0993 -22.5480 -22.5480 -22.5181 -22.5181 -22.4704 -22.4704 -22.3014 -22.3014 -0.6905 -0.6905 0.5800 0.5800 1.2820 1.2820 2.4124 2.4124 5.0507 5.0507 6.0613 6.0613 6.1358 6.1358 7.6813 7.6813 7.9066 7.9066 8.8810 8.8810 9.1333 9.1333 9.4931 9.4931 10.0439 10.0439 10.2618 10.2618 10.8148 10.8148 11.1434 11.1434 11.5435 11.5435 12.0879 12.0879 k =-0.2353 0.1453 0.5877 ( 10548 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1666 -23.1666 -23.0993 -23.0993 -22.5480 -22.5480 -22.5182 -22.5182 -22.4703 -22.4703 -22.3014 -22.3014 -0.6513 -0.6513 0.6084 0.6084 1.2597 1.2597 2.3330 2.3330 4.9960 4.9960 5.9983 5.9983 6.1237 6.1237 7.6724 7.6724 7.9725 7.9725 8.9229 8.9229 9.2284 9.2284 9.5625 9.5625 10.0525 10.0525 10.2969 10.2969 10.8030 10.8030 11.0806 11.0806 11.6162 11.6162 12.1114 12.1114 k =-0.2500 0.1544 0.5877 ( 10552 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1666 -23.1666 -23.0994 -23.0994 -22.5480 -22.5480 -22.5183 -22.5183 -22.4702 -22.4702 -22.3014 -22.3014 -0.6098 -0.6098 0.6377 0.6377 1.2377 1.2377 2.2502 2.2502 4.9438 4.9438 5.8972 5.8972 6.1611 6.1611 7.6541 7.6541 8.0450 8.0450 8.9593 8.9593 9.3086 9.3086 9.6291 9.6291 10.0612 10.0612 10.3340 10.3340 10.7973 10.7973 11.0326 11.0326 11.6938 11.6938 12.1332 12.1332 k =-0.2647 0.1635 0.5877 ( 10552 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1666 -23.1666 -23.0995 -23.0995 -22.5480 -22.5480 -22.5184 -22.5184 -22.4702 -22.4702 -22.3014 -22.3014 -0.5661 -0.5661 0.6677 0.6677 1.2163 1.2163 2.1644 2.1644 4.8942 4.8942 5.7956 5.7956 6.2102 6.2102 7.6324 7.6324 8.1178 8.1178 8.9899 8.9899 9.3707 9.3707 9.6925 9.6925 10.0698 10.0698 10.3732 10.3732 10.7989 10.7989 11.0020 11.0020 11.7750 11.7750 12.1413 12.1415 k =-0.2794 0.1726 0.5877 ( 10560 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1665 -23.1665 -23.0995 -23.0995 -22.5479 -22.5479 -22.5185 -22.5185 -22.4701 -22.4701 -22.3014 -22.3014 -0.5203 -0.5203 0.6981 0.6981 1.1955 1.1955 2.0765 2.0765 4.8473 4.8473 5.6965 5.6965 6.2674 6.2674 7.6095 7.6095 8.1883 8.1883 9.0127 9.0127 9.4150 9.4150 9.7524 9.7524 10.0784 10.0784 10.4143 10.4143 10.8082 10.8082 10.9900 10.9900 11.8589 11.8589 12.1117 12.1118 k =-0.2941 0.1817 0.5877 ( 10552 PWs) bands (ev): -46.4271 -46.4271 -46.3863 -46.3863 -23.1665 -23.1665 -23.0996 -23.0996 -22.5479 -22.5479 -22.5186 -22.5186 -22.4700 -22.4700 -22.3014 -22.3014 -0.4724 -0.4724 0.7286 0.7286 1.1756 1.1756 1.9871 1.9871 4.8031 4.8031 5.6009 5.6009 6.3316 6.3316 7.5865 7.5865 8.2551 8.2551 9.0241 9.0241 9.4449 9.4449 9.8085 9.8085 10.0867 10.0867 10.4572 10.4572 10.8248 10.8248 10.9958 10.9958 11.9437 11.9437 12.0751 12.0751 k =-0.3088 0.1908 0.5877 ( 10536 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1665 -23.1665 -23.0997 -23.0997 -22.5479 -22.5479 -22.5187 -22.5187 -22.4700 -22.4700 -22.3015 -22.3015 -0.4225 -0.4225 0.7591 0.7591 1.1566 1.1566 1.8967 1.8967 4.7617 4.7617 5.5092 5.5092 6.4019 6.4019 7.5641 7.5641 8.3175 8.3175 9.0200 9.0200 9.4667 9.4667 9.8607 9.8607 10.0948 10.0948 10.5020 10.5020 10.8475 10.8475 11.0176 11.0176 12.0098 12.0098 12.0542 12.0542 k =-0.3235 0.1998 0.5877 ( 10526 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1664 -23.1664 -23.0997 -23.0997 -22.5479 -22.5479 -22.5188 -22.5188 -22.4699 -22.4699 -22.3015 -22.3015 -0.3710 -0.3710 0.7893 0.7893 1.1386 1.1386 1.8060 1.8060 4.7232 4.7232 5.4221 5.4221 6.4775 6.4775 7.5426 7.5426 8.3749 8.3749 8.9972 8.9972 9.4872 9.4872 9.9089 9.9089 10.1025 10.1025 10.5485 10.5485 10.8747 10.8747 11.0518 11.0518 11.9779 11.9779 12.1276 12.1276 k =-0.3382 0.2089 0.5877 ( 10526 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1664 -23.1664 -23.0998 -23.0998 -22.5479 -22.5479 -22.5189 -22.5189 -22.4698 -22.4698 -22.3015 -22.3015 -0.3179 -0.3179 0.8187 0.8187 1.1218 1.1218 1.7155 1.7155 4.6876 4.6876 5.3397 5.3397 6.5578 6.5578 7.5222 7.5222 8.4268 8.4268 8.9551 8.9551 9.5106 9.5106 9.9534 9.9534 10.1098 10.1098 10.5970 10.5970 10.9057 10.9057 11.0939 11.0939 11.9284 11.9284 12.2130 12.2130 k =-0.3529 0.2180 0.5877 ( 10528 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1664 -23.1664 -23.0998 -23.0998 -22.5478 -22.5478 -22.5189 -22.5189 -22.4698 -22.4698 -22.3015 -22.3015 -0.2635 -0.2635 0.8472 0.8472 1.1061 1.1061 1.6260 1.6260 4.6550 4.6550 5.2627 5.2627 6.6420 6.6420 7.5034 7.5034 8.4732 8.4732 8.8958 8.8958 9.5385 9.5385 9.9942 9.9942 10.1168 10.1168 10.6472 10.6472 10.9397 10.9397 11.1396 11.1396 11.8743 11.8743 12.2831 12.2831 k =-0.3676 0.2271 0.5877 ( 10540 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1664 -23.1664 -23.0999 -23.0999 -22.5478 -22.5478 -22.5190 -22.5190 -22.4697 -22.4697 -22.3015 -22.3015 -0.2082 -0.2082 0.8744 0.8744 1.0918 1.0918 1.5381 1.5381 4.6253 4.6253 5.1913 5.1913 6.7293 6.7293 7.4861 7.4861 8.5139 8.5139 8.8232 8.8232 9.5698 9.5698 10.0312 10.0312 10.1233 10.1233 10.6992 10.6992 10.9760 10.9760 11.1854 11.1854 11.8168 11.8168 12.3186 12.3186 k =-0.3824 0.2362 0.5877 ( 10534 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.0999 -23.0999 -22.5478 -22.5478 -22.5191 -22.5191 -22.4696 -22.4696 -22.3015 -22.3015 -0.1524 -0.1524 0.8999 0.8999 1.0787 1.0787 1.4525 1.4525 4.5987 4.5987 5.1261 5.1261 6.8190 6.8190 7.4706 7.4706 8.5482 8.5482 8.7416 8.7416 9.6032 9.6032 10.0642 10.0642 10.1296 10.1296 10.7530 10.7530 11.0139 11.0139 11.2286 11.2286 11.7566 11.7566 12.3484 12.3484 k =-0.3971 0.2453 0.5877 ( 10524 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1000 -23.1000 -22.5478 -22.5478 -22.5191 -22.5191 -22.4696 -22.4696 -22.3015 -22.3015 -0.0967 -0.0967 0.9235 0.9235 1.0671 1.0671 1.3701 1.3701 4.5752 4.5752 5.0674 5.0674 6.9099 6.9099 7.4571 7.4571 8.5724 8.5724 8.6586 8.6586 9.6368 9.6368 10.0930 10.0930 10.1359 10.1359 10.8083 10.8083 11.0519 11.0519 11.2678 11.2678 11.6944 11.6944 12.3787 12.3787 k =-0.4118 0.2544 0.5877 ( 10520 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1000 -23.1000 -22.5478 -22.5478 -22.5192 -22.5192 -22.4696 -22.4696 -22.3015 -22.3015 -0.0421 -0.0421 0.9447 0.9447 1.0568 1.0568 1.2920 1.2920 4.5548 4.5548 5.0155 5.0155 7.0008 7.0008 7.4459 7.4459 8.5421 8.5421 8.6218 8.6218 9.6692 9.6692 10.1164 10.1164 10.1433 10.1433 10.8652 10.8652 11.0888 11.0888 11.3020 11.3020 11.6306 11.6306 12.4102 12.4102 k =-0.4265 0.2634 0.5877 ( 10510 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1000 -23.1000 -22.5478 -22.5478 -22.5192 -22.5192 -22.4695 -22.4695 -22.3015 -22.3015 0.0103 0.0103 0.9632 0.9632 1.0479 1.0479 1.2197 1.2197 4.5375 4.5375 4.9710 4.9710 7.0897 7.0897 7.4374 7.4374 8.4562 8.4562 8.6356 8.6356 9.6991 9.6991 10.1318 10.1318 10.1544 10.1544 10.9236 10.9236 11.1232 11.1232 11.3308 11.3308 11.5659 11.5659 12.4425 12.4425 k =-0.4412 0.2725 0.5877 ( 10506 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4695 -22.4695 -22.3015 -22.3015 0.0589 0.0589 0.9788 0.9788 1.0403 1.0403 1.1550 1.1550 4.5233 4.5233 4.9340 4.9340 7.1735 7.1735 7.4326 7.4326 8.3673 8.3673 8.6509 8.6509 9.7252 9.7252 10.1396 10.1396 10.1684 10.1684 10.9833 10.9833 11.1536 11.1536 11.3540 11.3540 11.5007 11.5007 12.4746 12.4746 k =-0.4559 0.2816 0.5877 ( 10500 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4695 -22.4695 -22.3015 -22.3015 0.1014 0.1014 0.9909 0.9909 1.0336 1.0336 1.1007 1.1007 4.5122 4.5122 4.9049 4.9049 7.2468 7.2468 7.4331 7.4331 8.2845 8.2845 8.6631 8.6631 9.7466 9.7466 10.1439 10.1439 10.1813 10.1813 11.0442 11.0442 11.1788 11.1788 11.3710 11.3710 11.4363 11.4363 12.5047 12.5047 k =-0.4706 0.2907 0.5877 ( 10488 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4694 -22.4694 -22.3015 -22.3015 0.1351 0.1351 0.9992 0.9992 1.0267 1.0267 1.0613 1.0613 4.5043 4.5043 4.8840 4.8840 7.3014 7.3014 7.4416 7.4416 8.2144 8.2144 8.6718 8.6718 9.7625 9.7625 10.1466 10.1466 10.1909 10.1909 11.1058 11.1058 11.1976 11.1976 11.3629 11.3629 11.3921 11.3921 12.5297 12.5298 k =-0.4853 0.2998 0.5877 ( 10480 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4694 -22.4694 -22.3015 -22.3015 0.1570 0.1570 1.0019 1.0019 1.0185 1.0185 1.0423 1.0423 4.4996 4.4996 4.8714 4.8714 7.3312 7.3312 7.4562 7.4562 8.1658 8.1658 8.6770 8.6770 9.7723 9.7723 10.1482 10.1482 10.1969 10.1969 11.1671 11.1671 11.2094 11.2094 11.3035 11.3035 11.3955 11.3955 12.5452 12.5454 k =-0.5000 0.3089 0.5877 ( 10484 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4694 -22.4694 -22.3015 -22.3015 0.1647 0.1647 1.0004 1.0004 1.0157 1.0157 1.0381 1.0381 4.4980 4.4980 4.8671 4.8671 7.3396 7.3396 7.4640 7.4640 8.1481 8.1481 8.6787 8.6787 9.7756 9.7756 10.1487 10.1487 10.1988 10.1988 11.2080 11.2080 11.2182 11.2182 11.2574 11.2574 11.3976 11.3976 12.5489 12.5489 k =-0.5000 0.3089 0.5877 ( 10484 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4694 -22.4694 -22.3015 -22.3015 0.1647 0.1647 1.0004 1.0004 1.0157 1.0157 1.0381 1.0381 4.4980 4.4980 4.8671 4.8671 7.3396 7.3396 7.4640 7.4640 8.1481 8.1481 8.6787 8.6787 9.7756 9.7756 10.1487 10.1487 10.1988 10.1988 11.2080 11.2080 11.2182 11.2182 11.2574 11.2574 11.3976 11.3976 12.5489 12.5500 k =-0.4896 0.3024 0.5755 ( 10484 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4694 -22.4694 -22.3015 -22.3015 0.1570 0.1570 1.0023 1.0023 1.0189 1.0189 1.0416 1.0416 4.4996 4.4996 4.8714 4.8714 7.3313 7.3313 7.4560 7.4560 8.1659 8.1659 8.6770 8.6770 9.7722 9.7722 10.1482 10.1482 10.1968 10.1968 11.1633 11.1633 11.2149 11.2149 11.3018 11.3018 11.3954 11.3954 12.5461 12.5464 k =-0.4792 0.2960 0.5632 ( 10488 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4694 -22.4694 -22.3015 -22.3015 0.1346 0.1346 1.0025 1.0025 1.0347 1.0347 1.0505 1.0505 4.5043 4.5043 4.8840 4.8840 7.3036 7.3036 7.4388 7.4388 8.2151 8.2151 8.6718 8.6718 9.7622 9.7622 10.1467 10.1467 10.1909 10.1909 11.0924 11.0924 11.2196 11.2196 11.3560 11.3560 11.3904 11.3904 12.5366 12.5368 k =-0.4688 0.2896 0.5510 ( 10508 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4695 -22.4695 -22.3015 -22.3015 0.0995 0.0995 1.0011 1.0011 1.0593 1.0593 1.0668 1.0668 4.5123 4.5123 4.9050 4.9050 7.2543 7.2543 7.4234 7.4234 8.2870 8.2870 8.6635 8.6635 9.7454 9.7454 10.1441 10.1441 10.1810 10.1810 11.0155 11.0155 11.2277 11.2277 11.3721 11.3721 11.4151 11.4151 12.5205 12.5212 k =-0.4583 0.2831 0.5387 ( 10516 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4695 -22.4695 -22.3015 -22.3015 0.0539 0.0539 1.0004 1.0004 1.0758 1.0758 1.1029 1.1029 4.5234 4.5234 4.9340 4.9340 7.1886 7.1886 7.4124 7.4124 8.3733 8.3733 8.6521 8.6521 9.7216 9.7216 10.1405 10.1405 10.1675 10.1675 10.9341 10.9341 11.2389 11.2389 11.3577 11.3577 11.4621 11.4621 12.5005 12.5006 k =-0.4479 0.2767 0.5265 ( 10516 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1000 -23.1000 -22.5478 -22.5478 -22.5192 -22.5192 -22.4695 -22.4695 -22.3015 -22.3015 0.0001 0.0001 1.0010 1.0010 1.0930 1.0930 1.1472 1.1472 4.5376 4.5376 4.9706 4.9706 7.1138 7.1138 7.4040 7.4040 8.4678 8.4678 8.6388 8.6388 9.6907 9.6907 10.1354 10.1354 10.1506 10.1506 10.8488 10.8488 11.2529 11.2529 11.3385 11.3385 11.5061 11.5061 12.4788 12.4788 k =-0.4375 0.2702 0.5142 ( 10526 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1000 -23.1000 -22.5478 -22.5478 -22.5192 -22.5192 -22.4696 -22.4696 -22.3015 -22.3015 -0.0598 -0.0598 1.0033 1.0033 1.1121 1.1121 1.1962 1.1962 4.5550 4.5550 5.0144 5.0144 7.0352 7.0352 7.3966 7.3966 8.5604 8.5604 8.6298 8.6298 9.6528 9.6528 10.1251 10.1251 10.1342 10.1342 10.7602 10.7602 11.2688 11.2688 11.3169 11.3169 11.5464 11.5464 12.4570 12.4570 k =-0.4271 0.2638 0.5020 ( 10538 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1000 -23.1000 -22.5478 -22.5478 -22.5191 -22.5191 -22.4696 -22.4696 -22.3015 -22.3015 -0.1244 -0.1244 1.0072 1.0072 1.1332 1.1332 1.2486 1.2486 4.5755 4.5755 5.0648 5.0648 6.9561 6.9561 7.3894 7.3894 8.5873 8.5873 8.6865 8.6865 9.6079 9.6079 10.1018 10.1018 10.1257 10.1257 10.6689 10.6689 11.2791 11.2791 11.3013 11.3013 11.5833 11.5833 12.4359 12.4359 k =-0.4167 0.2574 0.4898 ( 10538 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.0999 -23.0999 -22.5478 -22.5478 -22.5191 -22.5191 -22.4697 -22.4697 -22.3015 -22.3015 -0.1924 -0.1924 1.0128 1.0128 1.1564 1.1564 1.3032 1.3032 4.5991 4.5991 5.1209 5.1209 6.8787 6.8787 7.3817 7.3817 8.5691 8.5691 8.7866 8.7866 9.5565 9.5565 10.0726 10.0726 10.1180 10.1180 10.5754 10.5754 11.2604 11.2604 11.3158 11.3158 11.6171 11.6171 12.4161 12.4161 k =-0.4062 0.2509 0.4775 ( 10532 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1664 -23.1664 -23.0999 -23.0999 -22.5478 -22.5478 -22.5190 -22.5190 -22.4697 -22.4697 -22.3015 -22.3015 -0.2629 -0.2629 1.0202 1.0202 1.1816 1.1816 1.3593 1.3593 4.6258 4.6258 5.1819 5.1819 6.8048 6.8048 7.3735 7.3735 8.5453 8.5453 8.8887 8.8887 9.4994 9.4994 10.0385 10.0385 10.1094 10.1094 10.4804 10.4804 11.2350 11.2350 11.3389 11.3389 11.6480 11.6480 12.3979 12.3979 k =-0.3958 0.2445 0.4653 ( 10530 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1664 -23.1664 -23.0998 -23.0998 -22.5478 -22.5478 -22.5189 -22.5189 -22.4698 -22.4698 -22.3015 -22.3015 -0.3352 -0.3352 1.0293 1.0293 1.2088 1.2088 1.4165 1.4165 4.6556 4.6556 5.2463 5.2463 6.7361 6.7361 7.3645 7.3645 8.5191 8.5191 8.9876 8.9876 9.4377 9.4377 9.9991 9.9991 10.0996 10.0996 10.3845 10.3845 11.2098 11.2098 11.3645 11.3645 11.6764 11.6764 12.3814 12.3814 k =-0.3854 0.2381 0.4530 ( 10538 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1664 -23.1664 -23.0998 -23.0998 -22.5479 -22.5479 -22.5188 -22.5188 -22.4698 -22.4698 -22.3015 -22.3015 -0.4086 -0.4086 1.0401 1.0401 1.2379 1.2379 1.4744 1.4744 4.6884 4.6884 5.3126 5.3126 6.6744 6.6744 7.3545 7.3545 8.4911 8.4911 9.0790 9.0790 9.3746 9.3746 9.9540 9.9540 10.0884 10.0884 10.2884 10.2884 11.1869 11.1869 11.3917 11.3917 11.7025 11.7025 12.3665 12.3665 k =-0.3750 0.2316 0.4408 ( 10542 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1665 -23.1665 -23.0997 -23.0997 -22.5479 -22.5479 -22.5187 -22.5187 -22.4699 -22.4699 -22.3015 -22.3015 -0.4827 -0.4827 1.0525 1.0525 1.2691 1.2691 1.5327 1.5327 4.7241 4.7241 5.3786 5.3786 6.6217 6.6217 7.3435 7.3435 8.4617 8.4617 9.1505 9.1505 9.3212 9.3212 9.9026 9.9026 10.0745 10.0745 10.1938 10.1938 11.1679 11.1679 11.4202 11.4202 11.7266 11.7266 12.3531 12.3532 k =-0.3646 0.2252 0.4285 ( 10534 PWs) bands (ev): -46.4271 -46.4271 -46.3863 -46.3863 -23.1665 -23.1665 -23.0996 -23.0996 -22.5479 -22.5479 -22.5186 -22.5186 -22.4700 -22.4700 -22.3015 -22.3015 -0.5570 -0.5570 1.0666 1.0666 1.3022 1.3022 1.5913 1.5913 4.7629 4.7629 5.4418 5.4418 6.5805 6.5805 7.3314 7.3314 8.4313 8.4313 9.1584 9.1584 9.3198 9.3198 9.8446 9.8446 10.0500 10.0500 10.1089 10.1089 11.1544 11.1544 11.4494 11.4494 11.7490 11.7490 12.3413 12.3413 k =-0.3542 0.2188 0.4163 ( 10542 PWs) bands (ev): -46.4271 -46.4271 -46.3863 -46.3863 -23.1665 -23.1665 -23.0995 -23.0995 -22.5479 -22.5479 -22.5185 -22.5185 -22.4701 -22.4701 -22.3014 -22.3014 -0.6313 -0.6313 1.0823 1.0823 1.3372 1.3372 1.6500 1.6500 4.8045 4.8045 5.4988 5.4988 6.5539 6.5539 7.3179 7.3179 8.4000 8.4000 9.1014 9.1014 9.3706 9.3706 9.7797 9.7797 9.9826 9.9826 10.0664 10.0664 11.1481 11.1481 11.4791 11.4791 11.7696 11.7696 12.3307 12.3307 k =-0.3438 0.2123 0.4040 ( 10536 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1666 -23.1666 -23.0995 -23.0995 -22.5480 -22.5480 -22.5184 -22.5184 -22.4702 -22.4702 -22.3014 -22.3014 -0.7052 -0.7052 1.0996 1.0996 1.3741 1.3741 1.7088 1.7088 4.8490 4.8490 5.5463 5.5463 6.5451 6.5451 7.3029 7.3029 8.3683 8.3683 9.0264 9.0264 9.4247 9.4247 9.7084 9.7084 9.8922 9.8922 10.0469 10.0469 11.1506 11.1506 11.5090 11.5090 11.7888 11.7888 12.3213 12.3214 k =-0.3333 0.2059 0.3918 ( 10520 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1666 -23.1666 -23.0994 -23.0994 -22.5480 -22.5480 -22.5183 -22.5183 -22.4702 -22.4702 -22.3014 -22.3014 -0.7785 -0.7785 1.1183 1.1183 1.4128 1.4128 1.7675 1.7675 4.8963 4.8963 5.5812 5.5812 6.5566 6.5566 7.2863 7.2863 8.3362 8.3362 8.9464 8.9464 9.4664 9.4664 9.6323 9.6323 9.7997 9.7997 10.0302 10.0302 11.1631 11.1631 11.5385 11.5385 11.8064 11.8064 12.3127 12.3129 k =-0.3229 0.1995 0.3796 ( 10528 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1666 -23.1666 -23.0993 -23.0993 -22.5480 -22.5480 -22.5182 -22.5182 -22.4703 -22.4703 -22.3014 -22.3014 -0.8510 -0.8510 1.1386 1.1386 1.4534 1.4534 1.8261 1.8261 4.9464 4.9464 5.6022 5.6022 6.5894 6.5894 7.2681 7.2681 8.3039 8.3039 8.8650 8.8650 9.4804 9.4804 9.5615 9.5615 9.7091 9.7091 10.0135 10.0135 11.1863 11.1863 11.5674 11.5674 11.8227 11.8227 12.3016 12.3018 k =-0.3125 0.1930 0.3673 ( 10520 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1667 -23.1667 -23.0992 -23.0992 -22.5480 -22.5480 -22.5181 -22.5181 -22.4704 -22.4704 -22.3014 -22.3014 -0.9224 -0.9224 1.1603 1.1603 1.4958 1.4958 1.8845 1.8845 4.9991 4.9991 5.6098 5.6098 6.6422 6.6422 7.2483 7.2483 8.2716 8.2716 8.7839 8.7839 9.4272 9.4272 9.5288 9.5288 9.6268 9.6268 9.9967 9.9967 11.2201 11.2201 11.5952 11.5952 11.8375 11.8375 12.2786 12.2787 k =-0.3021 0.1866 0.3551 ( 10520 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1667 -23.1667 -23.0991 -23.0991 -22.5480 -22.5480 -22.5179 -22.5179 -22.4705 -22.4705 -22.3014 -22.3014 -0.9927 -0.9927 1.1833 1.1833 1.5400 1.5400 1.9426 1.9426 5.0544 5.0544 5.6064 5.6064 6.7115 6.7115 7.2273 7.2273 8.2394 8.2394 8.7044 8.7044 9.3355 9.3355 9.4849 9.4849 9.5738 9.5738 9.9798 9.9798 11.2635 11.2635 11.6216 11.6216 11.8508 11.8508 12.2533 12.2534 k =-0.2917 0.1802 0.3428 ( 10520 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1667 -23.1667 -23.0990 -23.0990 -22.5481 -22.5481 -22.5178 -22.5178 -22.4706 -22.4706 -22.3014 -22.3014 -1.0616 -1.0616 1.2077 1.2077 1.5859 1.5859 2.0003 2.0003 5.1122 5.1122 5.5952 5.5952 6.7919 6.7919 7.2067 7.2067 8.2074 8.2074 8.6276 8.6276 9.2332 9.2332 9.4074 9.4074 9.5462 9.5462 9.9628 9.9628 11.3149 11.3149 11.6461 11.6461 11.8626 11.8626 12.2284 12.2284 k =-0.2812 0.1737 0.3306 ( 10512 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1668 -23.1668 -23.0989 -23.0989 -22.5481 -22.5481 -22.5177 -22.5177 -22.4707 -22.4707 -22.3014 -22.3014 -1.1289 -1.1289 1.2333 1.2333 1.6333 1.6333 2.0575 2.0575 5.1724 5.1724 5.5794 5.5794 6.8752 6.8752 7.1910 7.1910 8.1757 8.1757 8.5543 8.5543 9.1248 9.1248 9.3218 9.3218 9.5158 9.5158 9.9456 9.9456 11.3721 11.3721 11.6680 11.6680 11.8726 11.8726 12.2046 12.2046 k =-0.2708 0.1673 0.3183 ( 10510 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1668 -23.1668 -23.0989 -23.0989 -22.5481 -22.5481 -22.5175 -22.5175 -22.4709 -22.4709 -22.3014 -22.3014 -1.1947 -1.1947 1.2600 1.2600 1.6824 1.6824 2.1139 2.1139 5.2347 5.2347 5.5617 5.5617 6.9448 6.9448 7.1933 7.1933 8.1444 8.1444 8.4856 8.4856 9.0117 9.0117 9.2357 9.2357 9.4762 9.4762 9.9282 9.9282 11.4329 11.4329 11.6869 11.6869 11.8807 11.8807 12.1826 12.1826 k =-0.2604 0.1609 0.3061 ( 10504 PWs) bands (ev): -46.4271 -46.4271 -46.3862 -46.3862 -23.1669 -23.1669 -23.0988 -23.0988 -22.5482 -22.5482 -22.5174 -22.5174 -22.4710 -22.4710 -22.3014 -22.3014 -1.2587 -1.2587 1.2879 1.2879 1.7330 1.7330 2.1695 2.1695 5.2987 5.2987 5.5444 5.5444 6.9745 6.9745 7.2370 7.2370 8.1137 8.1137 8.4218 8.4218 8.8952 8.8952 9.1507 9.1507 9.4271 9.4271 9.9104 9.9104 11.4949 11.4949 11.7022 11.7022 11.8866 11.8866 12.1632 12.1632 k =-0.2500 0.1544 0.2939 ( 10498 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4711 -22.4711 -22.3014 -22.3014 -1.3209 -1.3209 1.3168 1.3168 1.7849 1.7849 2.2240 2.2240 5.3635 5.3635 5.5299 5.5299 6.9619 6.9619 7.3222 7.3222 8.0838 8.0838 8.3635 8.3635 8.7762 8.7762 9.0675 9.0675 9.3692 9.3692 9.8924 9.8924 11.5559 11.5559 11.7132 11.7132 11.8900 11.8900 12.1471 12.1471 k =-0.2396 0.1480 0.2816 ( 10498 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1670 -23.1670 -23.0986 -23.0986 -22.5482 -22.5482 -22.5171 -22.5171 -22.4712 -22.4712 -22.3014 -22.3014 -1.3811 -1.3811 1.3465 1.3465 1.8382 1.8382 2.2772 2.2772 5.4255 5.4255 5.5230 5.5230 6.9266 6.9266 7.4270 7.4270 8.0553 8.0553 8.3103 8.3103 8.6563 8.6563 8.9865 8.9865 9.3036 9.3036 9.8740 9.8740 11.6141 11.6141 11.7196 11.7196 11.8903 11.8903 12.1351 12.1351 k =-0.2292 0.1416 0.2694 ( 10494 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1670 -23.1670 -23.0985 -23.0985 -22.5482 -22.5482 -22.5170 -22.5170 -22.4713 -22.4713 -22.3014 -22.3014 -1.4392 -1.4392 1.3771 1.3771 1.8926 1.8926 2.3290 2.3290 5.4675 5.4675 5.5417 5.5417 6.8797 6.8797 7.5381 7.5381 8.0295 8.0295 8.2612 8.2612 8.5374 8.5374 8.9076 8.9076 9.2311 9.2311 9.8554 9.8554 11.6676 11.6676 11.7213 11.7213 11.8872 11.8872 12.1276 12.1276 k =-0.2188 0.1351 0.2571 ( 10506 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1670 -23.1670 -23.0984 -23.0984 -22.5483 -22.5483 -22.5168 -22.5168 -22.4714 -22.4714 -22.3014 -22.3014 -1.4953 -1.4953 1.4083 1.4083 1.9481 1.9481 2.3791 2.3791 5.4772 5.4772 5.5988 5.5988 6.8256 6.8256 7.6468 7.6468 8.0094 8.0094 8.2131 8.2131 8.4235 8.4235 8.8311 8.8311 9.1524 9.1524 9.8368 9.8368 11.7092 11.7092 11.7246 11.7246 11.8800 11.8800 12.1245 12.1245 k =-0.2083 0.1287 0.2449 ( 10510 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1671 -23.1671 -23.0983 -23.0983 -22.5483 -22.5483 -22.5167 -22.5167 -22.4715 -22.4715 -22.3014 -22.3014 -1.5491 -1.5491 1.4401 1.4401 2.0046 2.0046 2.4273 2.4273 5.4801 5.4801 5.6693 5.6693 6.7664 6.7664 7.7418 7.7418 8.0025 8.0025 8.1591 8.1591 8.3230 8.3230 8.7571 8.7571 9.0684 9.0684 9.8184 9.8184 11.7070 11.7070 11.7614 11.7614 11.8680 11.8680 12.1256 12.1256 k =-0.1979 0.1223 0.2326 ( 10514 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1671 -23.1671 -23.0982 -23.0982 -22.5483 -22.5483 -22.5166 -22.5166 -22.4716 -22.4716 -22.3014 -22.3014 -1.6007 -1.6007 1.4723 1.4723 2.0617 2.0617 2.4733 2.4733 5.4857 5.4857 5.7441 5.7441 6.7035 6.7035 7.8020 7.8020 8.0175 8.0175 8.0963 8.0963 8.2493 8.2493 8.6857 8.6857 8.9794 8.9794 9.8004 9.8004 11.6955 11.6955 11.7975 11.7975 11.8509 11.8509 12.1303 12.1303 k =-0.1875 0.1158 0.2204 ( 10526 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1672 -23.1672 -23.0981 -23.0981 -22.5483 -22.5483 -22.5164 -22.5164 -22.4717 -22.4717 -22.3014 -22.3014 -1.6500 -1.6500 1.5048 1.5048 2.1194 2.1194 2.5171 2.5171 5.4961 5.4961 5.8211 5.8211 6.6380 6.6380 7.8156 7.8156 7.9684 7.9684 8.1202 8.1202 8.2033 8.2033 8.6173 8.6173 8.8863 8.8863 9.7833 9.7833 11.6807 11.6807 11.8206 11.8206 11.8355 11.8355 12.1377 12.1377 k =-0.1771 0.1094 0.2081 ( 10522 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1672 -23.1672 -23.0980 -23.0980 -22.5484 -22.5484 -22.5163 -22.5163 -22.4718 -22.4718 -22.3014 -22.3014 -1.6968 -1.6968 1.5374 1.5374 2.1775 2.1775 2.5583 2.5583 5.5122 5.5122 5.8997 5.8997 6.5707 6.5707 7.7936 7.7936 7.8765 7.8765 8.1728 8.1728 8.2084 8.2084 8.5525 8.5525 8.7898 8.7898 9.7674 9.7674 11.6637 11.6637 11.7950 11.7950 11.8574 11.8574 12.1468 12.1468 k =-0.1667 0.1030 0.1959 ( 10508 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1672 -23.1672 -23.0979 -23.0979 -22.5484 -22.5484 -22.5162 -22.5162 -22.4719 -22.4719 -22.3014 -22.3014 -1.7413 -1.7413 1.5700 1.5700 2.2356 2.2356 2.5968 2.5968 5.5344 5.5344 5.9792 5.9792 6.5027 6.5027 7.7205 7.7205 7.8202 7.8202 8.1499 8.1499 8.3013 8.3013 8.4941 8.4941 8.6911 8.6911 9.7529 9.7529 11.6452 11.6452 11.7580 11.7580 11.8797 11.8797 12.1564 12.1564 k =-0.1562 0.0965 0.1837 ( 10508 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1673 -23.1673 -23.0979 -23.0979 -22.5484 -22.5484 -22.5161 -22.5161 -22.4720 -22.4720 -22.3014 -22.3014 -1.7833 -1.7833 1.6023 1.6023 2.2936 2.2936 2.6326 2.6326 5.5630 5.5630 6.0595 6.0595 6.4346 6.4346 7.6160 7.6160 7.7920 7.7920 8.1302 8.1302 8.3668 8.3668 8.4619 8.4619 8.5940 8.5940 9.7403 9.7403 11.6260 11.6260 11.7139 11.7139 11.8995 11.8995 12.1652 12.1652 k =-0.1458 0.0901 0.1714 ( 10516 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1673 -23.1673 -23.0978 -23.0978 -22.5484 -22.5484 -22.5160 -22.5160 -22.4720 -22.4720 -22.3014 -22.3014 -1.8227 -1.8227 1.6342 1.6342 2.3511 2.3511 2.6655 2.6655 5.5980 5.5980 6.1400 6.1400 6.3674 6.3674 7.5077 7.5077 7.7689 7.7689 8.1110 8.1110 8.3461 8.3461 8.4633 8.4633 8.5478 8.5478 9.7300 9.7300 11.6064 11.6064 11.6632 11.6632 11.9175 11.9175 12.1720 12.1720 k =-0.1354 0.0836 0.1592 ( 10500 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1673 -23.1673 -23.0977 -23.0977 -22.5485 -22.5485 -22.5159 -22.5159 -22.4721 -22.4721 -22.3014 -22.3014 -1.8596 -1.8596 1.6653 1.6653 2.4078 2.4078 2.6956 2.6956 5.6394 5.6394 6.2202 6.2202 6.3017 6.3017 7.4015 7.4015 7.7470 7.7470 8.0890 8.0890 8.2955 8.2955 8.3796 8.3796 8.6159 8.6159 9.7222 9.7222 11.5864 11.5864 11.6074 11.6074 11.9343 11.9343 12.1757 12.1757 k =-0.1250 0.0772 0.1469 ( 10498 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1674 -23.1674 -23.0976 -23.0976 -22.5485 -22.5485 -22.5158 -22.5158 -22.4722 -22.4722 -22.3014 -22.3014 -1.8939 -1.8939 1.6956 1.6956 2.4633 2.4633 2.7227 2.7227 5.6871 5.6871 6.2377 6.2377 6.3003 6.3003 7.2994 7.2994 7.7252 7.7252 8.0598 8.0598 8.2327 8.2327 8.3023 8.3023 8.6924 8.6924 9.7174 9.7174 11.5440 11.5440 11.5700 11.5700 11.9507 11.9507 12.1761 12.1761 k =-0.1146 0.0708 0.1347 ( 10500 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1674 -23.1674 -23.0976 -23.0976 -22.5485 -22.5485 -22.5157 -22.5157 -22.4723 -22.4723 -22.3014 -22.3014 -1.9255 -1.9255 1.7248 1.7248 2.5172 2.5172 2.7471 2.7471 5.7410 5.7410 6.1771 6.1771 6.3781 6.3781 7.2030 7.2030 7.7025 7.7025 8.0173 8.0173 8.1545 8.1545 8.2549 8.2549 8.7630 8.7630 9.7157 9.7157 11.4806 11.4806 11.5513 11.5513 11.9668 11.9668 12.1733 12.1733 k =-0.1042 0.0643 0.1224 ( 10498 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1674 -23.1674 -23.0975 -23.0975 -22.5485 -22.5485 -22.5156 -22.5156 -22.4723 -22.4723 -22.3014 -22.3014 -1.9545 -1.9545 1.7526 1.7526 2.5691 2.5691 2.7686 2.7686 5.8006 5.8006 6.1198 6.1198 6.4533 6.4533 7.1139 7.1139 7.6767 7.6767 7.9562 7.9562 8.0803 8.0803 8.2273 8.2273 8.8255 8.8255 9.7170 9.7170 11.4154 11.4154 11.5343 11.5343 11.9828 11.9828 12.1679 12.1679 k =-0.0938 0.0579 0.1102 ( 10494 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0974 -23.0974 -22.5485 -22.5485 -22.5155 -22.5155 -22.4724 -22.4724 -22.3014 -22.3014 -1.9808 -1.9808 1.7788 1.7788 2.6184 2.6184 2.7876 2.7876 5.8651 5.8651 6.0670 6.0670 6.5239 6.5239 7.0345 7.0345 7.6435 7.6435 7.8820 7.8820 8.0184 8.0184 8.2105 8.2105 8.8793 8.8793 9.7213 9.7213 11.3505 11.3505 11.5184 11.5184 11.9985 11.9985 12.1606 12.1606 k =-0.0833 0.0515 0.0980 ( 10502 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0974 -23.0974 -22.5485 -22.5485 -22.5154 -22.5154 -22.4725 -22.4725 -22.3014 -22.3014 -2.0044 -2.0044 1.8031 1.8031 2.6646 2.6646 2.8040 2.8040 5.9318 5.9318 6.0213 6.0213 6.5858 6.5858 6.9686 6.9686 7.5951 7.5951 7.8123 7.8123 7.9638 7.9638 8.2004 8.2004 8.9244 8.9244 9.7281 9.7281 11.2877 11.2877 11.5040 11.5040 12.0138 12.0138 12.1522 12.1522 k =-0.0729 0.0450 0.0857 ( 10486 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0974 -23.0974 -22.5485 -22.5485 -22.5153 -22.5153 -22.4725 -22.4725 -22.3014 -22.3014 -2.0253 -2.0253 1.8253 1.8253 2.7073 2.7073 2.8180 2.8180 5.9593 5.9593 6.0241 6.0241 6.6319 6.6319 6.9238 6.9238 7.5247 7.5247 7.7613 7.7613 7.9126 7.9126 8.1944 8.1944 8.9612 8.9612 9.7367 9.7367 11.2284 11.2284 11.4909 11.4909 12.0282 12.0282 12.1433 12.1433 k =-0.0625 0.0386 0.0735 ( 10494 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0973 -23.0973 -22.5486 -22.5486 -22.5153 -22.5153 -22.4725 -22.4725 -22.3014 -22.3014 -2.0434 -2.0434 1.8451 1.8451 2.7457 2.7457 2.8298 2.8298 5.9265 5.9265 6.0956 6.0956 6.6515 6.6515 6.9104 6.9104 7.4359 7.4359 7.7291 7.7291 7.8634 7.8634 8.1910 8.1910 8.9906 8.9906 9.7464 9.7464 11.1741 11.1741 11.4795 11.4795 12.0411 12.0411 12.1348 12.1348 k =-0.0521 0.0322 0.0612 ( 10500 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0973 -23.0973 -22.5486 -22.5486 -22.5152 -22.5152 -22.4726 -22.4726 -22.3014 -22.3014 -2.0588 -2.0588 1.8623 1.8623 2.7794 2.7794 2.8395 2.8395 5.8936 5.8936 6.1746 6.1746 6.6450 6.6450 6.9276 6.9276 7.3388 7.3388 7.7087 7.7087 7.8166 7.8166 8.1892 8.1892 9.0134 9.0134 9.7563 9.7563 11.1259 11.1259 11.4697 11.4697 12.0520 12.0520 12.1273 12.1273 k =-0.0417 0.0257 0.0490 ( 10511 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0972 -23.0972 -22.5486 -22.5486 -22.5152 -22.5152 -22.4726 -22.4726 -22.3014 -22.3014 -2.0714 -2.0714 1.8767 1.8767 2.8079 2.8079 2.8473 2.8473 5.8657 5.8657 6.2535 6.2535 6.6284 6.6284 6.9579 6.9579 7.2422 7.2422 7.6950 7.6950 7.7730 7.7730 8.1884 8.1884 9.0306 9.0306 9.7656 9.7656 11.0851 11.0851 11.4616 11.4616 12.0603 12.0603 12.1218 12.1218 k =-0.0312 0.0193 0.0367 ( 10507 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5152 -22.5152 -22.4726 -22.4726 -22.3014 -22.3014 -2.0812 -2.0812 1.8881 1.8881 2.8306 2.8306 2.8532 2.8532 5.8436 5.8436 6.3262 6.3262 6.6180 6.6180 6.9783 6.9783 7.1594 7.1594 7.6857 7.6857 7.7345 7.7345 8.1881 8.1881 9.0430 9.0430 9.7736 9.7736 11.0523 11.0523 11.4552 11.4552 12.0657 12.0657 12.1185 12.1185 k =-0.0208 0.0129 0.0245 ( 10517 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5151 -22.5151 -22.4727 -22.4727 -22.3014 -22.3014 -2.0882 -2.0882 1.8964 1.8964 2.8470 2.8470 2.8574 2.8574 5.8276 5.8276 6.3830 6.3830 6.6264 6.6264 6.9574 6.9574 7.1181 7.1181 7.6793 7.6793 7.7036 7.7036 8.1881 8.1881 9.0514 9.0514 9.7797 9.7797 11.0284 11.0284 11.4506 11.4506 12.0684 12.0684 12.1172 12.1172 k =-0.0104 0.0064 0.0122 ( 10513 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5151 -22.5151 -22.4727 -22.4727 -22.3014 -22.3014 -2.0924 -2.0924 1.9014 1.9014 2.8568 2.8568 2.8602 2.8602 5.8179 5.8179 6.4147 6.4147 6.6562 6.6562 6.9011 6.9011 7.1163 7.1163 7.6748 7.6748 7.6841 7.6841 8.1881 8.1881 9.0562 9.0562 9.7835 9.7835 11.0139 11.0139 11.4479 11.4479 12.0694 12.0694 12.1170 12.1170 k = 0.0000 0.0000 0.0000 ( 10503 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5151 -22.5151 -22.4727 -22.4727 -22.3014 -22.3014 -2.0938 -2.0938 1.9030 1.9030 2.8595 2.8595 2.8617 2.8617 5.8147 5.8147 6.4238 6.4238 6.6780 6.6780 6.8687 6.8687 7.1193 7.1193 7.6718 7.6718 7.6787 7.6787 8.1881 8.1881 9.0577 9.0577 9.7848 9.7848 11.0090 11.0090 11.4470 11.4470 12.0696 12.0696 12.1171 12.1171 k = 0.0000 0.0000 0.0000 ( 10503 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1676 -23.1676 -23.0972 -23.0972 -22.5486 -22.5486 -22.5151 -22.5151 -22.4727 -22.4727 -22.3014 -22.3014 -2.0938 -2.0938 1.9030 1.9030 2.8595 2.8595 2.8617 2.8617 5.8147 5.8147 6.4238 6.4238 6.6780 6.6780 6.8687 6.8687 7.1193 7.1193 7.6718 7.6718 7.6787 7.6787 8.1881 8.1881 9.0577 9.0577 9.7848 9.7848 11.0090 11.0090 11.4470 11.4470 12.0696 12.0696 12.1171 12.1171 k = 0.0092 0.0149-0.0000 ( 10515 PWs) bands (ev): -46.4271 -46.4271 -46.3860 -46.3860 -23.1675 -23.1675 -23.0972 -23.0972 -22.5484 -22.5484 -22.5151 -22.5151 -22.4727 -22.4727 -22.3016 -22.3016 -2.0923 -2.0923 1.9016 1.9016 2.8573 2.8573 2.8595 2.8595 5.8060 5.8060 6.4226 6.4226 6.6739 6.6739 6.8713 6.8713 7.1318 7.1318 7.6787 7.6787 7.6859 7.6859 8.1832 8.1832 9.0588 9.0588 9.7857 9.7857 11.0124 11.0124 11.4462 11.4462 12.0671 12.0671 12.1149 12.1149 k = 0.0184 0.0297-0.0000 ( 10503 PWs) bands (ev): -46.4270 -46.4270 -46.3861 -46.3861 -23.1672 -23.1672 -23.0973 -23.0973 -22.5480 -22.5480 -22.5150 -22.5150 -22.4728 -22.4728 -22.3024 -22.3024 -2.0879 -2.0879 1.8975 1.8975 2.8507 2.8507 2.8528 2.8528 5.7813 5.7813 6.4189 6.4189 6.6624 6.6624 6.8788 6.8788 7.1683 7.1683 7.6990 7.6990 7.7071 7.7071 8.1688 8.1688 9.0621 9.0621 9.7884 9.7884 11.0224 11.0224 11.4438 11.4438 12.0599 12.0599 12.1083 12.1083 k = 0.0275 0.0446-0.0000 ( 10511 PWs) bands (ev): -46.4268 -46.4268 -46.3863 -46.3863 -23.1667 -23.1667 -23.0974 -23.0974 -22.5472 -22.5472 -22.5148 -22.5148 -22.4730 -22.4730 -22.3036 -22.3036 -2.0805 -2.0805 1.8905 1.8905 2.8398 2.8398 2.8418 2.8418 5.7437 5.7437 6.4122 6.4122 6.6453 6.6453 6.8903 6.8903 7.2268 7.2268 7.7308 7.7308 7.7416 7.7416 8.1460 8.1460 9.0675 9.0675 9.7927 9.7927 11.0384 11.0384 11.4399 11.4399 12.0482 12.0482 12.0976 12.0976 k = 0.0367 0.0595-0.0000 ( 10515 PWs) bands (ev): -46.4266 -46.4266 -46.3865 -46.3865 -23.1660 -23.1660 -23.0976 -23.0976 -22.5461 -22.5461 -22.5145 -22.5145 -22.4733 -22.4733 -22.3053 -22.3053 -2.0701 -2.0701 1.8807 1.8807 2.8246 2.8246 2.8264 2.8264 5.6971 5.6971 6.4026 6.4026 6.6246 6.6246 6.9048 6.9048 7.3042 7.3042 7.7709 7.7709 7.7882 7.7882 8.1175 8.1175 9.0750 9.0750 9.7986 9.7986 11.0596 11.0596 11.4344 11.4344 12.0323 12.0323 12.0828 12.0828 k = 0.0459 0.0743-0.0000 ( 10507 PWs) bands (ev): -46.4263 -46.4263 -46.3868 -46.3868 -23.1652 -23.1652 -23.0978 -23.0978 -22.5446 -22.5446 -22.5142 -22.5142 -22.4736 -22.4736 -22.3075 -22.3075 -2.0568 -2.0568 1.8681 1.8681 2.8053 2.8053 2.8069 2.8069 5.6453 5.6453 6.3908 6.3908 6.6022 6.6022 6.9219 6.9219 7.3974 7.3974 7.8129 7.8129 7.8455 7.8455 8.0889 8.0889 9.0848 9.0848 9.8058 9.8058 11.0851 11.0851 11.4274 11.4274 12.0126 12.0126 12.0643 12.0643 k = 0.0551 0.0892-0.0000 ( 10515 PWs) bands (ev): -46.4259 -46.4259 -46.3872 -46.3872 -23.1642 -23.1642 -23.0981 -23.0981 -22.5429 -22.5429 -22.5138 -22.5138 -22.4741 -22.4741 -22.3101 -22.3101 -2.0406 -2.0406 1.8526 1.8526 2.7821 2.7821 2.7833 2.7833 5.5912 5.5912 6.3776 6.3776 6.5797 6.5797 6.9414 6.9414 7.5034 7.5034 7.8426 7.8426 7.9123 7.9123 8.0739 8.0739 9.0966 9.0966 9.8140 9.8140 11.1136 11.1136 11.4190 11.4190 11.9895 11.9895 12.0424 12.0424 k = 0.0643 0.1041-0.0000 ( 10515 PWs) bands (ev): -46.4255 -46.4255 -46.3876 -46.3876 -23.1630 -23.1630 -23.0984 -23.0984 -22.5409 -22.5409 -22.5133 -22.5133 -22.4746 -22.4746 -22.3132 -22.3132 -2.0214 -2.0214 1.8342 1.8342 2.7550 2.7550 2.7559 2.7559 5.5373 5.5373 6.3641 6.3641 6.5579 6.5579 6.9630 6.9630 7.6198 7.6198 7.8391 7.8391 7.9873 7.9873 8.0930 8.0930 9.1107 9.1107 9.8230 9.8230 11.1438 11.1438 11.4092 11.4092 11.9634 11.9634 12.0174 12.0174 k = 0.0735 0.1189-0.0000 ( 10511 PWs) bands (ev): -46.4250 -46.4250 -46.3881 -46.3881 -23.1616 -23.1616 -23.0988 -23.0988 -22.5385 -22.5385 -22.5127 -22.5127 -22.4751 -22.4751 -22.3167 -22.3167 -1.9993 -1.9993 1.8130 1.8130 2.7244 2.7244 2.7249 2.7249 5.4853 5.4853 6.3512 6.3512 6.5380 6.5380 6.9866 6.9866 7.7445 7.7445 7.8010 7.8010 8.0692 8.0692 8.1477 8.1477 9.1269 9.1269 9.8322 9.8322 11.1744 11.1744 11.3980 11.3980 11.9347 11.9347 11.9898 11.9898 k = 0.0826 0.1338-0.0000 ( 10511 PWs) bands (ev): -46.4245 -46.4245 -46.3887 -46.3887 -23.1601 -23.1601 -23.0993 -23.0993 -22.5358 -22.5358 -22.5121 -22.5121 -22.4758 -22.4758 -22.3206 -22.3206 -1.9742 -1.9742 1.7888 1.7888 2.6904 2.6904 2.6904 2.6904 5.4364 5.4364 6.3397 6.3397 6.5204 6.5204 7.0119 7.0119 7.7435 7.7435 7.8759 7.8759 8.1571 8.1571 8.2230 8.2230 9.1453 9.1453 9.8409 9.8409 11.2043 11.2043 11.3856 11.3856 11.9039 11.9039 11.9599 11.9599 k = 0.0918 0.1487 0.0000 ( 10503 PWs) bands (ev): -46.4238 -46.4238 -46.3893 -46.3893 -23.1585 -23.1585 -23.0998 -23.0998 -22.5328 -22.5328 -22.5114 -22.5114 -22.4765 -22.4765 -22.3250 -22.3250 -1.9463 -1.9463 1.7617 1.7617 2.6528 2.6528 2.6532 2.6532 5.3917 5.3917 6.3301 6.3301 6.5056 6.5056 7.0383 7.0383 7.6767 7.6767 8.0125 8.0125 8.2501 8.2501 8.3093 8.3093 9.1658 9.1658 9.8485 9.8485 11.2324 11.2324 11.3720 11.3720 11.8713 11.8713 11.9281 11.9281 k = 0.1010 0.1635-0.0000 ( 10487 PWs) bands (ev): -46.4232 -46.4232 -46.3900 -46.3900 -23.1567 -23.1567 -23.1004 -23.1004 -22.5295 -22.5295 -22.5107 -22.5107 -22.4772 -22.4772 -22.3297 -22.3297 -1.9154 -1.9154 1.7318 1.7318 2.6122 2.6122 2.6132 2.6132 5.3519 5.3519 6.3230 6.3230 6.4938 6.4938 7.0647 7.0647 7.6059 7.6059 8.1530 8.1530 8.3476 8.3476 8.4025 8.4025 9.1886 9.1886 9.8539 9.8539 11.2575 11.2575 11.3572 11.3572 11.8373 11.8373 11.8949 11.8949 k = 0.1102 0.1784 0.0000 ( 10491 PWs) bands (ev): -46.4225 -46.4225 -46.3907 -46.3907 -23.1549 -23.1549 -23.1010 -23.1010 -22.5259 -22.5259 -22.5099 -22.5099 -22.4781 -22.4781 -22.3348 -22.3348 -1.8817 -1.8817 1.6991 1.6991 2.5691 2.5691 2.5706 2.5706 5.3175 5.3175 6.3186 6.3186 6.4854 6.4854 7.0889 7.0889 7.5355 7.5355 8.2959 8.2959 8.4494 8.4494 8.5004 8.5004 9.2137 9.2137 9.8558 9.8558 11.2788 11.2788 11.3415 11.3415 11.8022 11.8022 11.8605 11.8605 k = 0.1194 0.1933 0.0000 ( 10511 PWs) bands (ev): -46.4217 -46.4217 -46.3915 -46.3915 -23.1529 -23.1529 -23.1017 -23.1017 -22.5220 -22.5220 -22.5090 -22.5090 -22.4790 -22.4790 -22.3402 -22.3402 -1.8450 -1.8450 1.6637 1.6637 2.5235 2.5235 2.5256 2.5256 5.2889 5.2889 6.3172 6.3172 6.4803 6.4803 7.1062 7.1062 7.4715 7.4715 8.4389 8.4389 8.5560 8.5560 8.6017 8.6017 9.2411 9.2411 9.8529 9.8529 11.2957 11.2957 11.3249 11.3249 11.7665 11.7665 11.8254 11.8254 k = 0.1286 0.2081-0.0000 ( 10503 PWs) bands (ev): -46.4209 -46.4209 -46.3923 -46.3923 -23.1509 -23.1509 -23.1025 -23.1025 -22.5178 -22.5178 -22.5081 -22.5081 -22.4799 -22.4799 -22.3459 -22.3459 -1.8055 -1.8055 1.6258 1.6258 2.4759 2.4759 2.4786 2.4786 5.2664 5.2664 6.3189 6.3189 6.4785 6.4785 7.1079 7.1079 7.4236 7.4236 8.5781 8.5781 8.6698 8.6698 8.7054 8.7054 9.2711 9.2711 9.8431 9.8431 11.3074 11.3074 11.3076 11.3076 11.7304 11.7304 11.7900 11.7900 k = 0.1377 0.2230-0.0000 ( 10527 PWs) bands (ev): -46.4200 -46.4200 -46.3932 -46.3932 -23.1488 -23.1488 -23.1034 -23.1034 -22.5133 -22.5133 -22.5071 -22.5071 -22.4809 -22.4809 -22.3519 -22.3519 -1.7632 -1.7632 1.5854 1.5854 2.4265 2.4265 2.4298 2.4298 5.2500 5.2500 6.3238 6.3238 6.4801 6.4801 7.0835 7.0835 7.4031 7.4031 8.7071 8.7071 8.7954 8.7954 8.8108 8.8108 9.3039 9.3039 9.8244 9.8244 11.2893 11.2893 11.3142 11.3142 11.6944 11.6944 11.7546 11.7546 k = 0.1469 0.2379 0.0000 ( 10543 PWs) bands (ev): -46.4191 -46.4191 -46.3942 -46.3942 -23.1466 -23.1466 -23.1043 -23.1043 -22.5085 -22.5085 -22.5061 -22.5061 -22.4820 -22.4820 -22.3582 -22.3582 -1.7180 -1.7180 1.5428 1.5428 2.3756 2.3756 2.3795 2.3795 5.2400 5.2400 6.3318 6.3318 6.4848 6.4848 7.0318 7.0318 7.4117 7.4117 8.8238 8.8238 8.9172 8.9172 8.9332 8.9332 9.3399 9.3399 9.7944 9.7944 11.2706 11.2706 11.3152 11.3152 11.6589 11.6589 11.7195 11.7195 k = 0.1561 0.2527 0.0000 ( 10527 PWs) bands (ev): -46.4181 -46.4181 -46.3951 -46.3951 -23.1444 -23.1444 -23.1053 -23.1053 -22.5050 -22.5050 -22.5034 -22.5034 -22.4831 -22.4831 -22.3647 -22.3647 -1.6700 -1.6700 1.4982 1.4982 2.3235 2.3235 2.3280 2.3280 5.2362 5.2362 6.3428 6.3428 6.4923 6.4923 6.9624 6.9624 7.4405 7.4405 8.9321 8.9321 9.0241 9.0241 9.0770 9.0770 9.3800 9.3800 9.7505 9.7505 11.2514 11.2514 11.3107 11.3107 11.6242 11.6242 11.6852 11.6852 k = 0.1653 0.2676-0.0000 ( 10503 PWs) bands (ev): -46.4171 -46.4171 -46.3961 -46.3961 -23.1422 -23.1422 -23.1064 -23.1064 -22.5039 -22.5039 -22.4980 -22.4980 -22.4842 -22.4842 -22.3714 -22.3714 -1.6193 -1.6193 1.4517 1.4517 2.2704 2.2704 2.2754 2.2754 5.2387 5.2387 6.3569 6.3569 6.5023 6.5023 6.8840 6.8840 7.4813 7.4813 9.0347 9.0347 9.1308 9.1308 9.2208 9.2208 9.4260 9.4260 9.6907 9.6907 11.2319 11.2319 11.3007 11.3007 11.5911 11.5911 11.6520 11.6520 k = 0.1745 0.2825-0.0000 ( 10503 PWs) bands (ev): -46.4161 -46.4161 -46.3972 -46.3972 -23.1400 -23.1400 -23.1076 -23.1076 -22.5028 -22.5028 -22.4924 -22.4924 -22.4854 -22.4854 -22.3783 -22.3783 -1.5658 -1.5658 1.4036 1.4036 2.2165 2.2165 2.2222 2.2222 5.2474 5.2474 6.3739 6.3739 6.5139 6.5139 6.8023 6.8023 7.5297 7.5297 9.1316 9.1316 9.2370 9.2370 9.3581 9.3581 9.4829 9.4829 9.6131 9.6131 11.2122 11.2122 11.2855 11.2855 11.5601 11.5601 11.6202 11.6202 k = 0.1837 0.2973 0.0000 ( 10496 PWs) bands (ev): -46.4150 -46.4150 -46.3982 -46.3982 -23.1378 -23.1378 -23.1089 -23.1089 -22.5016 -22.5016 -22.4866 -22.4866 -22.4865 -22.4865 -22.3854 -22.3854 -1.5095 -1.5095 1.3542 1.3542 2.1622 2.1622 2.1684 2.1684 5.2621 5.2621 6.3936 6.3936 6.5243 6.5243 6.7221 6.7221 7.5833 7.5833 9.2217 9.2217 9.3420 9.3420 9.4728 9.4728 9.5171 9.5171 9.5664 9.5664 11.1924 11.1924 11.2652 11.2652 11.5319 11.5319 11.5902 11.5902 k = 0.1928 0.3122 0.0000 ( 10504 PWs) bands (ev): -46.4139 -46.4139 -46.3993 -46.3993 -23.1356 -23.1356 -23.1102 -23.1102 -22.5004 -22.5004 -22.4878 -22.4878 -22.4804 -22.4804 -22.3925 -22.3925 -1.4506 -1.4506 1.3037 1.3037 2.1076 2.1076 2.1144 2.1144 5.2827 5.2827 6.4160 6.4160 6.5242 6.5242 6.6543 6.6543 7.6410 7.6410 9.3033 9.3033 9.4027 9.4027 9.4458 9.4458 9.5566 9.5566 9.6847 9.6847 11.1727 11.1727 11.2404 11.2404 11.5071 11.5071 11.5623 11.5623 k = 0.2020 0.3271-0.0000 ( 10528 PWs) bands (ev): -46.4128 -46.4128 -46.4005 -46.4005 -23.1334 -23.1334 -23.1117 -23.1117 -22.4991 -22.4991 -22.4891 -22.4891 -22.4741 -22.4741 -22.3998 -22.3998 -1.3890 -1.3890 1.2523 1.2523 2.0529 2.0529 2.0603 2.0603 5.3092 5.3092 6.4409 6.4409 6.4877 6.4877 6.6252 6.6252 7.7021 7.7021 9.2722 9.2722 9.3757 9.3757 9.5471 9.5471 9.6330 9.6330 9.8135 9.8135 11.1533 11.1533 11.2113 11.2113 11.4859 11.4859 11.5370 11.5370 k = 0.2112 0.3419 0.0000 ( 10496 PWs) bands (ev): -46.4117 -46.4117 -46.4016 -46.4016 -23.1312 -23.1312 -23.1132 -23.1132 -22.4979 -22.4979 -22.4904 -22.4904 -22.4676 -22.4676 -22.4071 -22.4071 -1.3247 -1.3247 1.2004 1.2004 1.9984 1.9984 2.0063 2.0063 5.3412 5.3412 6.4171 6.4171 6.4680 6.4680 6.6329 6.6329 7.7661 7.7661 9.1267 9.1267 9.4396 9.4396 9.6461 9.6461 9.7121 9.7121 9.9400 9.9400 11.1342 11.1342 11.1784 11.1784 11.4683 11.4683 11.5145 11.5145 k = 0.2204 0.3568-0.0000 ( 10500 PWs) bands (ev): -46.4106 -46.4106 -46.4028 -46.4028 -23.1291 -23.1291 -23.1148 -23.1148 -22.4966 -22.4966 -22.4917 -22.4917 -22.4609 -22.4609 -22.4144 -22.4144 -1.2579 -1.2579 1.1480 1.1480 1.9442 1.9442 1.9526 1.9526 5.3786 5.3786 6.3364 6.3364 6.4973 6.4973 6.6538 6.6538 7.8326 7.8326 8.9689 8.9689 9.4967 9.4967 9.7422 9.7422 9.7941 9.7941 10.0605 10.0605 11.1156 11.1156 11.1422 11.1422 11.4543 11.4543 11.4954 11.4954 k = 0.2296 0.3717-0.0000 ( 10508 PWs) bands (ev): -46.4094 -46.4094 -46.4039 -46.4039 -23.1271 -23.1271 -23.1165 -23.1165 -22.4954 -22.4954 -22.4930 -22.4930 -22.4540 -22.4540 -22.4217 -22.4217 -1.1886 -1.1886 1.0955 1.0955 1.8905 1.8905 1.8994 1.8994 5.4213 5.4213 6.2534 6.2534 6.5285 6.5285 6.6800 6.6800 7.9013 7.9013 8.8012 8.8012 9.5489 9.5489 9.8350 9.8350 9.8775 9.8775 10.1728 10.1728 11.0977 11.0977 11.1031 11.1031 11.4439 11.4439 11.4799 11.4799 k = 0.2388 0.3865 0.0000 ( 10532 PWs) bands (ev): -46.4082 -46.4082 -46.4051 -46.4051 -23.1251 -23.1251 -23.1183 -23.1183 -22.4947 -22.4947 -22.4936 -22.4936 -22.4470 -22.4470 -22.4290 -22.4290 -1.1167 -1.1167 1.0430 1.0430 1.8375 1.8375 1.8469 1.8469 5.4691 5.4691 6.1705 6.1705 6.5614 6.5614 6.7092 6.7092 7.9718 7.9718 8.6261 8.6261 9.5979 9.5979 9.9240 9.9240 9.9602 9.9602 10.2757 10.2757 11.0615 11.0615 11.0806 11.0806 11.4375 11.4375 11.4686 11.4686 k = 0.2479 0.4014-0.0000 ( 10532 PWs) bands (ev): -46.4070 -46.4070 -46.4063 -46.4063 -23.1232 -23.1232 -23.1201 -23.1201 -22.4958 -22.4958 -22.4925 -22.4925 -22.4399 -22.4399 -22.4362 -22.4362 -1.0425 -1.0425 0.9909 0.9909 1.7853 1.7853 1.7952 1.7952 5.5218 5.5218 6.0886 6.0886 6.5959 6.5959 6.7405 6.7405 8.0428 8.0428 8.4466 8.4466 9.6445 9.6445 10.0089 10.0089 10.0409 10.0409 10.3679 10.3679 11.0181 11.0181 11.0646 11.0646 11.4353 11.4353 11.4618 11.4618 k = 0.2571 0.4163-0.0000 ( 10524 PWs) bands (ev): -46.4075 -46.4075 -46.4059 -46.4059 -23.1222 -23.1222 -23.1212 -23.1212 -22.4971 -22.4971 -22.4913 -22.4913 -22.4434 -22.4434 -22.4326 -22.4326 -0.9659 -0.9659 0.9393 0.9393 1.7341 1.7341 1.7444 1.7444 5.5792 5.5792 6.0082 6.0082 6.6318 6.6318 6.7733 6.7733 8.1072 8.1072 8.2712 8.2712 9.6894 9.6894 10.0893 10.0893 10.1185 10.1185 10.4487 10.4487 10.9731 10.9731 11.0499 11.0499 11.4379 11.4379 11.4599 11.4599 k = 0.2663 0.4311 0.0000 ( 10524 PWs) bands (ev): -46.4087 -46.4087 -46.4047 -46.4047 -23.1241 -23.1241 -23.1195 -23.1195 -22.4985 -22.4985 -22.4900 -22.4900 -22.4504 -22.4504 -22.4254 -22.4254 -0.8870 -0.8870 0.8883 0.8883 1.6839 1.6839 1.6946 1.6946 5.6412 5.6412 5.9296 5.9296 6.6687 6.6687 6.8071 6.8071 8.0484 8.0484 8.2179 8.2179 9.7326 9.7326 10.1649 10.1649 10.1921 10.1921 10.5176 10.5176 10.9269 10.9269 11.0365 11.0365 11.4455 11.4455 11.4633 11.4633 k = 0.2755 0.4460-0.0000 ( 10524 PWs) bands (ev): -46.4098 -46.4098 -46.4035 -46.4035 -23.1262 -23.1262 -23.1178 -23.1178 -22.4998 -22.4998 -22.4887 -22.4887 -22.4574 -22.4574 -22.4180 -22.4180 -0.8059 -0.8059 0.8382 0.8382 1.6349 1.6349 1.6461 1.6461 5.7076 5.7076 5.8529 5.8529 6.7067 6.7067 6.8414 6.8414 7.8684 7.8684 8.2858 8.2858 9.7744 9.7744 10.2357 10.2357 10.2609 10.2609 10.5742 10.5742 10.8801 10.8801 11.0248 11.0248 11.4585 11.4585 11.4722 11.4722 k = 0.2847 0.4609-0.0000 ( 10524 PWs) bands (ev): -46.4110 -46.4110 -46.4024 -46.4024 -23.1283 -23.1283 -23.1162 -23.1162 -22.5011 -22.5011 -22.4874 -22.4874 -22.4641 -22.4641 -22.4107 -22.4107 -0.7228 -0.7228 0.7891 0.7891 1.5873 1.5873 1.5988 1.5988 5.7782 5.7782 5.7784 5.7784 6.7453 6.7453 6.8756 6.8756 7.6805 7.6805 8.3629 8.3629 9.8145 9.8145 10.3015 10.3015 10.3246 10.3246 10.6184 10.6184 10.8329 10.8329 11.0150 11.0150 11.4770 11.4770 11.4867 11.4867 k = 0.2939 0.4757 0.0000 ( 10524 PWs) bands (ev): -46.4121 -46.4121 -46.4012 -46.4012 -23.1305 -23.1305 -23.1147 -23.1147 -22.5024 -22.5024 -22.4861 -22.4861 -22.4707 -22.4707 -22.4033 -22.4033 -0.6377 -0.6377 0.7411 0.7411 1.5411 1.5411 1.5529 1.5529 5.7062 5.7062 5.8530 5.8530 6.7844 6.7844 6.9082 6.9082 7.4931 7.4931 8.4425 8.4425 9.8529 9.8529 10.3625 10.3625 10.3824 10.3824 10.6505 10.6505 10.7859 10.7859 11.0072 11.0072 11.5010 11.5010 11.5070 11.5070 k = 0.3030 0.4906-0.0000 ( 10520 PWs) bands (ev): -46.4133 -46.4133 -46.4001 -46.4001 -23.1327 -23.1327 -23.1133 -23.1133 -22.5037 -22.5037 -22.4848 -22.4848 -22.4771 -22.4771 -22.3961 -22.3961 -0.5507 -0.5507 0.6945 0.6945 1.4963 1.4963 1.5085 1.5085 5.6365 5.6365 5.9318 5.9318 6.8238 6.8238 6.9356 6.9356 7.3114 7.3114 8.5233 8.5233 9.8894 9.8894 10.4187 10.4187 10.4339 10.4339 10.6710 10.6710 10.7394 10.7394 11.0017 11.0017 11.5303 11.5303 11.5327 11.5327 k = 0.3122 0.5054 0.0000 ( 10528 PWs) bands (ev): -46.4144 -46.4144 -46.3990 -46.3990 -23.1350 -23.1350 -23.1119 -23.1119 -22.5050 -22.5050 -22.4836 -22.4836 -22.4833 -22.4833 -22.3888 -22.3888 -0.4620 -0.4620 0.6493 0.6493 1.4532 1.4532 1.4657 1.4657 5.5693 5.5693 6.0143 6.0143 6.8632 6.8632 6.9400 6.9400 7.1538 7.1538 8.6048 8.6048 9.9236 9.9236 10.4703 10.4703 10.4774 10.4774 10.6813 10.6813 10.6940 10.6940 10.9988 10.9988 11.5636 11.5636 11.5645 11.5645 k = 0.3214 0.5203 0.0000 ( 10540 PWs) bands (ev): -46.4155 -46.4155 -46.3979 -46.3979 -23.1372 -23.1372 -23.1106 -23.1106 -22.5062 -22.5062 -22.4892 -22.4892 -22.4824 -22.4824 -22.3817 -22.3817 -0.3718 -0.3718 0.6056 0.6056 1.4116 1.4116 1.4244 1.4244 5.5047 5.5047 6.1006 6.1006 6.8549 6.8549 6.9025 6.9025 7.0871 7.0871 8.6868 8.6868 9.9551 9.9551 10.5098 10.5098 10.5164 10.5164 10.6515 10.6515 10.6848 10.6848 10.9986 10.9986 11.5990 11.5990 11.6031 11.6031 k = 0.3306 0.5352-0.0000 ( 10536 PWs) bands (ev): -46.4165 -46.4165 -46.3969 -46.3969 -23.1395 -23.1395 -23.1095 -23.1095 -22.5074 -22.5074 -22.4949 -22.4949 -22.4812 -22.4812 -22.3747 -22.3747 -0.2802 -0.2802 0.5635 0.5635 1.3719 1.3719 1.3849 1.3849 5.4429 5.4429 6.1904 6.1904 6.6945 6.6945 6.9414 6.9414 7.0977 7.0977 8.7689 8.7689 9.9838 9.9838 10.5239 10.5239 10.5497 10.5497 10.6202 10.6202 10.6891 10.6891 11.0013 11.0013 11.6376 11.6376 11.6455 11.6455 k = 0.3398 0.5500 0.0000 ( 10544 PWs) bands (ev): -46.4175 -46.4175 -46.3959 -46.3959 -23.1418 -23.1418 -23.1084 -23.1084 -22.5085 -22.5085 -22.5004 -22.5004 -22.4801 -22.4801 -22.3679 -22.3679 -0.1875 -0.1875 0.5233 0.5233 1.3339 1.3339 1.3472 1.3472 5.3840 5.3840 6.2836 6.2836 6.5192 6.5192 6.9797 6.9797 7.1252 7.1252 8.8507 8.8507 10.0089 10.0089 10.5119 10.5119 10.5404 10.5404 10.6307 10.6307 10.7027 10.7027 11.0069 11.0069 11.6733 11.6733 11.6912 11.6912 k = 0.3490 0.5649 0.0000 ( 10544 PWs) bands (ev): -46.4185 -46.4185 -46.3949 -46.3949 -23.1440 -23.1440 -23.1074 -23.1074 -22.5096 -22.5096 -22.5056 -22.5056 -22.4790 -22.4790 -22.3613 -22.3613 -0.0940 -0.0940 0.4848 0.4848 1.2977 1.2977 1.3113 1.3113 5.3279 5.3279 6.3426 6.3426 6.3800 6.3800 7.0173 7.0173 7.1563 7.1563 8.9320 8.9320 10.0299 10.0299 10.4744 10.4744 10.5052 10.5052 10.6671 10.6671 10.7267 10.7267 11.0155 11.0155 11.6578 11.6578 11.7394 11.7394 k = 0.3581 0.5798-0.0000 ( 10560 PWs) bands (ev): -46.4194 -46.4194 -46.3939 -46.3939 -23.1462 -23.1462 -23.1064 -23.1064 -22.5107 -22.5107 -22.5105 -22.5105 -22.4779 -22.4779 -22.3549 -22.3549 0.0001 0.0001 0.4483 0.4483 1.2634 1.2634 1.2772 1.2772 5.2747 5.2747 6.1682 6.1682 6.4795 6.4795 7.0539 7.0539 7.1881 7.1881 9.0123 9.0123 10.0454 10.0454 10.4180 10.4180 10.4670 10.4670 10.7074 10.7074 10.7568 10.7568 11.0269 11.0269 11.6143 11.6143 11.7845 11.7845 k = 0.3673 0.5946 0.0000 ( 10544 PWs) bands (ev): -46.4203 -46.4203 -46.3930 -46.3930 -23.1484 -23.1484 -23.1056 -23.1056 -22.5151 -22.5151 -22.5117 -22.5117 -22.4769 -22.4769 -22.3488 -22.3488 0.0944 0.0944 0.4137 0.4137 1.2311 1.2311 1.2451 1.2451 5.2247 5.2247 5.9973 5.9973 6.5818 6.5818 7.0895 7.0895 7.2194 7.2194 9.0912 9.0912 10.0527 10.0527 10.3506 10.3506 10.4294 10.4294 10.7485 10.7485 10.7900 10.7900 11.0410 11.0410 11.5748 11.5748 11.8338 11.8338 k = 0.3765 0.6095-0.0000 ( 10536 PWs) bands (ev): -46.4212 -46.4212 -46.3922 -46.3922 -23.1505 -23.1505 -23.1048 -23.1048 -22.5194 -22.5194 -22.5127 -22.5127 -22.4760 -22.4760 -22.3429 -22.3429 0.1885 0.1885 0.3812 0.3812 1.2008 1.2008 1.2150 1.2150 5.1776 5.1776 5.8309 5.8309 6.6867 6.6867 7.1240 7.1240 7.2497 7.2497 9.1684 9.1684 10.0448 10.0448 10.2823 10.2823 10.3933 10.3933 10.7901 10.7901 10.8248 10.8248 11.0573 11.0573 11.5412 11.5412 11.8848 11.8848 k = 0.3857 0.6244 0.0000 ( 10544 PWs) bands (ev): -46.4220 -46.4220 -46.3914 -46.3914 -23.1525 -23.1525 -23.1041 -23.1041 -22.5235 -22.5235 -22.5136 -22.5136 -22.4751 -22.4751 -22.3373 -22.3373 0.2818 0.2818 0.3508 0.3508 1.1725 1.1725 1.1869 1.1869 5.1338 5.1338 5.6697 5.6697 6.7937 6.7937 7.1576 7.1576 7.2787 7.2787 9.2434 9.2434 10.0085 10.0085 10.2293 10.2293 10.3592 10.3592 10.8321 10.8321 10.8607 10.8607 11.0756 11.0756 11.5130 11.5130 11.9367 11.9367 k = 0.3949 0.6392 0.0000 ( 10544 PWs) bands (ev): -46.4227 -46.4227 -46.3906 -46.3906 -23.1544 -23.1544 -23.1034 -23.1034 -22.5272 -22.5272 -22.5145 -22.5145 -22.4743 -22.4743 -22.3321 -22.3321 0.3226 0.3226 0.3739 0.3739 1.1463 1.1463 1.1608 1.1608 5.0931 5.0931 5.5146 5.5146 6.9021 6.9021 7.1906 7.1906 7.3060 7.3060 9.3156 9.3156 9.9354 9.9354 10.2021 10.2021 10.3272 10.3272 10.8745 10.8745 10.8975 10.8975 11.0953 11.0953 11.4895 11.4895 11.9891 11.9891 k = 0.4041 0.6541-0.0000 ( 10540 PWs) bands (ev): -46.4234 -46.4234 -46.3899 -46.3899 -23.1563 -23.1563 -23.1028 -23.1028 -22.5306 -22.5306 -22.5153 -22.5153 -22.4735 -22.4735 -22.3272 -22.3272 0.2965 0.2965 0.4641 0.4641 1.1221 1.1221 1.1368 1.1368 5.0557 5.0557 5.3664 5.3664 7.0099 7.0099 7.2247 7.2247 7.3315 7.3315 9.3846 9.3846 9.8359 9.8359 10.1926 10.1926 10.2975 10.2975 10.9170 10.9170 10.9347 10.9347 11.1159 11.1159 11.4700 11.4700 12.0416 12.0417 k = 0.4132 0.6690 0.0000 ( 10524 PWs) bands (ev): -46.4241 -46.4241 -46.3893 -46.3893 -23.1580 -23.1580 -23.1023 -23.1023 -22.5337 -22.5337 -22.5160 -22.5160 -22.4728 -22.4728 -22.3226 -22.3226 0.2728 0.2728 0.5516 0.5516 1.1001 1.1001 1.1149 1.1149 5.0215 5.0215 5.2259 5.2259 7.1118 7.1118 7.2647 7.2647 7.3550 7.3550 9.4498 9.4498 9.7219 9.7219 10.1906 10.1906 10.2704 10.2704 10.9594 10.9594 10.9722 10.9722 11.1368 11.1368 11.4539 11.4539 12.0944 12.0948 k = 0.4224 0.6838-0.0000 ( 10532 PWs) bands (ev): -46.4247 -46.4247 -46.3887 -46.3887 -23.1596 -23.1596 -23.1018 -23.1018 -22.5366 -22.5366 -22.5166 -22.5166 -22.4721 -22.4721 -22.3185 -22.3185 0.2513 0.2513 0.6354 0.6354 1.0802 1.0802 1.0951 1.0951 4.9905 4.9905 5.0943 5.0943 7.1933 7.1933 7.3249 7.3249 7.3764 7.3764 9.5106 9.5106 9.5999 9.5999 10.1913 10.1913 10.2458 10.2458 11.0012 11.0012 11.0095 11.0095 11.1575 11.1575 11.4405 11.4405 12.1472 12.1474 k = 0.4316 0.6987-0.0000 ( 10504 PWs) bands (ev): -46.4252 -46.4252 -46.3882 -46.3882 -23.1610 -23.1610 -23.1014 -23.1014 -22.5390 -22.5390 -22.5172 -22.5172 -22.4715 -22.4715 -22.3148 -22.3148 0.2321 0.2321 0.7147 0.7147 1.0625 1.0625 1.0775 1.0775 4.9600 4.9600 4.9753 4.9753 7.2424 7.2424 7.3956 7.3956 7.4168 7.4168 9.4733 9.4733 9.5664 9.5664 10.1928 10.1928 10.2239 10.2239 11.0417 11.0417 11.0459 11.0459 11.1775 11.1775 11.4295 11.4295 12.2004 12.2004 k = 0.4408 0.7136-0.0000 ( 10488 PWs) bands (ev): -46.4256 -46.4256 -46.3877 -46.3877 -23.1623 -23.1623 -23.1011 -23.1011 -22.5412 -22.5412 -22.5178 -22.5178 -22.4710 -22.4710 -22.3115 -22.3115 0.2153 0.2153 0.7882 0.7882 1.0470 1.0470 1.0621 1.0621 4.8604 4.8604 4.9399 4.9399 7.2721 7.2721 7.4126 7.4126 7.5269 7.5269 9.3442 9.3442 9.6167 9.6167 10.1944 10.1944 10.2048 10.2048 11.0803 11.0803 11.0808 11.0808 11.1961 11.1961 11.4205 11.4205 12.2540 12.2542 k = 0.4408 0.7136-0.0000 ( 10488 PWs) bands (ev): -46.4256 -46.4256 -46.3877 -46.3877 -23.1623 -23.1623 -23.1011 -23.1011 -22.5412 -22.5412 -22.5178 -22.5178 -22.4710 -22.4710 -22.3115 -22.3115 0.2153 0.2153 0.7882 0.7882 1.0470 1.0470 1.0621 1.0621 4.8604 4.8604 4.9399 4.9399 7.2721 7.2721 7.4126 7.4126 7.5269 7.5269 9.3442 9.3442 9.6167 9.6167 10.1944 10.1944 10.2048 10.2048 11.0803 11.0803 11.0808 11.0808 11.1961 11.1961 11.4205 11.4205 12.2540 12.2540 k = 0.4360 0.7059 0.0147 ( 10500 PWs) bands (ev): -46.4254 -46.4254 -46.3880 -46.3880 -23.1616 -23.1616 -23.1013 -23.1013 -22.5401 -22.5401 -22.5175 -22.5175 -22.4713 -22.4713 -22.3132 -22.3132 0.2182 0.2182 0.7513 0.7513 1.0566 1.0566 1.0737 1.0737 4.9170 4.9170 4.9555 4.9555 7.2378 7.2378 7.3798 7.3798 7.5127 7.5127 9.4109 9.4109 9.5892 9.5892 10.1919 10.1919 10.2140 10.2140 11.0375 11.0375 11.0651 11.0651 11.2079 11.2079 11.4234 11.4234 12.2263 12.2263 k = 0.4312 0.6981 0.0294 ( 10514 PWs) bands (ev): -46.4252 -46.4252 -46.3882 -46.3882 -23.1609 -23.1609 -23.1015 -23.1015 -22.5390 -22.5390 -22.5172 -22.5172 -22.4715 -22.4715 -22.3149 -22.3149 0.2114 0.2114 0.7141 0.7141 1.0639 1.0639 1.0992 1.0992 4.9715 4.9715 4.9853 4.9853 7.1550 7.1550 7.3481 7.3481 7.5443 7.5443 9.4739 9.4739 9.5578 9.5578 10.1860 10.1860 10.2232 10.2232 10.9770 10.9770 11.0467 11.0467 11.2404 11.2404 11.4242 11.4242 12.1993 12.1993 k = 0.4265 0.6904 0.0441 ( 10514 PWs) bands (ev): -46.4249 -46.4249 -46.3885 -46.3885 -23.1602 -23.1602 -23.1016 -23.1016 -22.5377 -22.5377 -22.5169 -22.5169 -22.4719 -22.4719 -22.3168 -22.3168 0.1961 0.1961 0.6767 0.6767 1.0674 1.0674 1.1387 1.1387 5.0038 5.0038 5.0488 5.0488 7.0453 7.0453 7.3334 7.3334 7.5845 7.5845 9.4990 9.4990 9.5567 9.5567 10.1766 10.1766 10.2320 10.2320 10.9118 10.9118 11.0294 11.0294 11.2785 11.2785 11.4229 11.4229 12.1729 12.1729 k = 0.4217 0.6827 0.0588 ( 10523 PWs) bands (ev): -46.4246 -46.4246 -46.3887 -46.3887 -23.1595 -23.1595 -23.1018 -23.1018 -22.5364 -22.5364 -22.5165 -22.5165 -22.4722 -22.4722 -22.3188 -22.3188 0.1743 0.1743 0.6395 0.6395 1.0686 1.0686 1.1888 1.1888 5.0392 5.0392 5.1203 5.1203 6.9269 6.9269 7.3252 7.3252 7.6258 7.6258 9.4603 9.4603 9.6118 9.6118 10.1637 10.1637 10.2404 10.2404 10.8459 10.8459 11.0140 11.0140 11.3183 11.3183 11.4202 11.4202 12.1470 12.1470 k = 0.4169 0.6750 0.0735 ( 10517 PWs) bands (ev): -46.4243 -46.4243 -46.3890 -46.3890 -23.1587 -23.1587 -23.1021 -23.1021 -22.5349 -22.5349 -22.5162 -22.5162 -22.4725 -22.4725 -22.3209 -22.3209 0.1477 0.1477 0.6027 0.6027 1.0680 1.0680 1.2471 1.2471 5.0807 5.0807 5.1964 5.1964 6.8056 6.8056 7.3198 7.3198 7.6661 7.6661 9.4113 9.4113 9.6696 9.6696 10.1471 10.1471 10.2479 10.2479 10.7812 10.7812 11.0008 11.0008 11.3586 11.3586 11.4166 11.4166 12.1217 12.1217 k = 0.4122 0.6672 0.0882 ( 10521 PWs) bands (ev): -46.4240 -46.4240 -46.3894 -46.3894 -23.1578 -23.1578 -23.1023 -23.1023 -22.5334 -22.5334 -22.5158 -22.5158 -22.4729 -22.4729 -22.3231 -22.3231 0.1179 0.1179 0.5664 0.5664 1.0659 1.0659 1.3117 1.3117 5.1280 5.1280 5.2765 5.2765 6.6838 6.6838 7.3161 7.3161 7.7043 7.7043 9.3584 9.3584 9.7236 9.7236 10.1270 10.1270 10.2541 10.2541 10.7190 10.7190 10.9894 10.9894 11.3981 11.3981 11.4135 11.4135 12.0974 12.0974 k = 0.4074 0.6595 0.1028 ( 10526 PWs) bands (ev): -46.4237 -46.4237 -46.3897 -46.3897 -23.1570 -23.1570 -23.1025 -23.1025 -22.5318 -22.5318 -22.5154 -22.5154 -22.4733 -22.4733 -22.3255 -22.3255 0.0862 0.0862 0.5309 0.5309 1.0625 1.0625 1.3812 1.3812 5.1811 5.1811 5.3603 5.3603 6.5626 6.5626 7.3139 7.3139 7.7399 7.7399 9.3037 9.3037 9.7715 9.7715 10.1040 10.1040 10.2584 10.2584 10.6603 10.6603 10.9790 10.9790 11.4080 11.4080 11.4403 11.4403 12.0744 12.0744 k = 0.4026 0.6518 0.1175 ( 10535 PWs) bands (ev): -46.4233 -46.4233 -46.3900 -46.3900 -23.1561 -23.1561 -23.1028 -23.1028 -22.5302 -22.5302 -22.5149 -22.5149 -22.4738 -22.4738 -22.3279 -22.3279 0.0535 0.0535 0.4963 0.4963 1.0581 1.0581 1.4541 1.4541 5.2395 5.2395 5.4473 5.4473 6.4432 6.4432 7.3130 7.3130 7.7722 7.7722 9.2487 9.2487 9.8104 9.8104 10.0795 10.0795 10.2596 10.2596 10.6069 10.6069 10.9687 10.9687 11.4062 11.4062 11.4798 11.4798 12.0529 12.0530 k = 0.3979 0.6441 0.1322 ( 10541 PWs) bands (ev): -46.4230 -46.4230 -46.3904 -46.3904 -23.1551 -23.1551 -23.1030 -23.1030 -22.5284 -22.5284 -22.5145 -22.5145 -22.4742 -22.4742 -22.3304 -22.3304 0.0208 0.0208 0.4626 0.4626 1.0529 1.0529 1.5294 1.5294 5.3029 5.3029 5.5367 5.5367 6.3266 6.3266 7.3133 7.3133 7.8008 7.8008 9.1948 9.1948 9.8357 9.8357 10.0568 10.0568 10.2565 10.2565 10.5602 10.5602 10.9571 10.9571 11.4069 11.4069 11.5189 11.5189 12.0327 12.0327 k = 0.3931 0.6364 0.1469 ( 10533 PWs) bands (ev): -46.4226 -46.4226 -46.3907 -46.3907 -23.1542 -23.1542 -23.1033 -23.1033 -22.5266 -22.5266 -22.5140 -22.5140 -22.4747 -22.4747 -22.3330 -22.3330 -0.0116 -0.0116 0.4301 0.4301 1.0470 1.0470 1.6061 1.6061 5.3710 5.3710 5.6271 5.6271 6.2147 6.2147 7.3150 7.3150 7.8252 7.8252 9.1434 9.1434 9.8412 9.8412 10.0412 10.0412 10.2473 10.2473 10.5222 10.5222 10.9431 10.9431 11.4111 11.4111 11.5571 11.5571 12.0128 12.0128 k = 0.3883 0.6286 0.1616 ( 10535 PWs) bands (ev): -46.4222 -46.4222 -46.3911 -46.3911 -23.1532 -23.1532 -23.1036 -23.1036 -22.5246 -22.5246 -22.5135 -22.5135 -22.4751 -22.4751 -22.3358 -22.3358 -0.0431 -0.0431 0.3988 0.3988 1.0408 1.0408 1.6833 1.6833 5.4432 5.4432 5.7149 5.7149 6.1117 6.1117 7.3180 7.3180 7.8450 7.8450 9.0958 9.0958 9.8231 9.8231 10.0353 10.0353 10.2308 10.2308 10.4941 10.4941 10.9258 10.9258 11.4196 11.4196 11.5943 11.5943 11.9918 11.9918 k = 0.3835 0.6209 0.1763 ( 10533 PWs) bands (ev): -46.4218 -46.4218 -46.3915 -46.3915 -23.1522 -23.1522 -23.1039 -23.1039 -22.5226 -22.5226 -22.5130 -22.5130 -22.4757 -22.4757 -22.3386 -22.3386 -0.0735 -0.0735 0.3688 0.3688 1.0344 1.0344 1.7600 1.7600 5.5190 5.5190 5.7859 5.7859 6.0325 6.0325 7.3225 7.3225 7.8597 7.8597 9.0530 9.0530 9.7850 9.7850 10.0351 10.0351 10.2067 10.2067 10.4758 10.4758 10.9046 10.9046 11.4323 11.4323 11.6304 11.6304 11.9699 11.9699 k = 0.3788 0.6132 0.1910 ( 10537 PWs) bands (ev): -46.4214 -46.4214 -46.3919 -46.3919 -23.1512 -23.1512 -23.1043 -23.1043 -22.5205 -22.5205 -22.5124 -22.5124 -22.4762 -22.4762 -22.3415 -22.3415 -0.1024 -0.1024 0.3403 0.3403 1.0281 1.0281 1.8353 1.8353 5.5971 5.5971 5.7939 5.7939 6.0246 6.0246 7.3284 7.3284 7.8691 7.8691 9.0160 9.0160 9.7335 9.7335 10.0335 10.0335 10.1762 10.1762 10.4656 10.4656 10.8798 10.8798 11.4484 11.4484 11.6652 11.6652 11.9488 11.9488 k = 0.3740 0.6055 0.2057 ( 10539 PWs) bands (ev): -46.4210 -46.4210 -46.3924 -46.3924 -23.1501 -23.1501 -23.1046 -23.1046 -22.5184 -22.5184 -22.5119 -22.5119 -22.4767 -22.4767 -22.3444 -22.3444 -0.1297 -0.1297 0.3132 0.3132 1.0220 1.0220 1.9082 1.9082 5.6681 5.6681 5.7424 5.7424 6.0943 6.0943 7.3358 7.3358 7.8730 7.8730 8.9853 8.9853 9.6732 9.6732 10.0256 10.0256 10.1409 10.1409 10.4615 10.4615 10.8521 10.8521 11.4660 11.4660 11.6985 11.6985 11.9302 11.9302 k = 0.3692 0.5978 0.2204 ( 10542 PWs) bands (ev): -46.4205 -46.4205 -46.3928 -46.3928 -23.1491 -23.1491 -23.1050 -23.1050 -22.5161 -22.5161 -22.5113 -22.5113 -22.4773 -22.4773 -22.3475 -22.3475 -0.1551 -0.1551 0.2876 0.2876 1.0164 1.0164 1.9776 1.9776 5.6373 5.6373 5.7777 5.7777 6.1904 6.1904 7.3449 7.3449 7.8714 7.8714 8.9613 8.9613 9.6069 9.6069 10.0087 10.0087 10.1024 10.1024 10.4614 10.4614 10.8223 10.8223 11.4824 11.4824 11.7303 11.7303 11.9166 11.9166 k = 0.3645 0.5900 0.2351 ( 10542 PWs) bands (ev): -46.4201 -46.4201 -46.3933 -46.3933 -23.1480 -23.1480 -23.1054 -23.1054 -22.5138 -22.5138 -22.5107 -22.5107 -22.4778 -22.4778 -22.3506 -22.3506 -0.1787 -0.1787 0.2637 0.2637 1.0114 1.0114 2.0424 2.0424 5.5612 5.5612 5.8614 5.8614 6.2950 6.2950 7.3557 7.3557 7.8646 7.8646 8.9439 8.9439 9.5365 9.5365 9.9813 9.9813 10.0616 10.0616 10.4640 10.4640 10.7914 10.7914 11.4937 11.4937 11.7609 11.7609 11.9107 11.9107 k = 0.3597 0.5823 0.2498 ( 10543 PWs) bands (ev): -46.4196 -46.4196 -46.3937 -46.3937 -23.1469 -23.1469 -23.1058 -23.1058 -22.5114 -22.5114 -22.5101 -22.5101 -22.4784 -22.4784 -22.3538 -22.3538 -0.2002 -0.2002 0.2413 0.2413 1.0072 1.0072 2.1011 2.1011 5.4889 5.4889 5.9495 5.9495 6.4037 6.4037 7.3683 7.3683 7.8532 7.8532 8.9329 8.9329 9.4630 9.4630 9.9430 9.9430 10.0190 10.0190 10.4683 10.4683 10.7604 10.7604 11.4965 11.4965 11.7906 11.7906 11.9151 11.9151 k = 0.3549 0.5746 0.2645 ( 10538 PWs) bands (ev): -46.4191 -46.4191 -46.3942 -46.3942 -23.1458 -23.1458 -23.1062 -23.1062 -22.5095 -22.5095 -22.5089 -22.5089 -22.4790 -22.4790 -22.3571 -22.3571 -0.2196 -0.2196 0.2206 0.2206 1.0040 1.0040 2.1527 2.1527 5.4252 5.4252 6.0391 6.0391 6.5147 6.5147 7.3829 7.3829 7.8379 7.8379 8.9277 8.9277 9.3875 9.3875 9.8944 9.8944 9.9747 9.9747 10.4739 10.4739 10.7295 10.7295 11.4885 11.4885 11.8201 11.8201 11.9306 11.9306 k = 0.3502 0.5669 0.2792 ( 10541 PWs) bands (ev): -46.4187 -46.4187 -46.3947 -46.3947 -23.1447 -23.1447 -23.1066 -23.1066 -22.5089 -22.5089 -22.5064 -22.5064 -22.4797 -22.4797 -22.3604 -22.3604 -0.2368 -0.2368 0.2016 0.2016 1.0019 1.0019 2.1956 2.1956 5.3727 5.3727 6.1294 6.1294 6.6271 6.6271 7.3996 7.3996 7.8196 7.8196 8.9274 8.9274 9.3106 9.3106 9.8363 9.8363 9.9290 9.9290 10.4803 10.4803 10.6989 10.6989 11.4697 11.4697 11.8500 11.8500 11.9563 11.9563 k = 0.3454 0.5591 0.2939 ( 10545 PWs) bands (ev): -46.4182 -46.4182 -46.3952 -46.3952 -23.1436 -23.1436 -23.1071 -23.1071 -22.5082 -22.5082 -22.5038 -22.5038 -22.4803 -22.4803 -22.3638 -22.3638 -0.2518 -0.2518 0.1842 0.1842 1.0010 1.0010 2.2287 2.2287 5.3330 5.3330 6.2194 6.2194 6.7401 6.7401 7.4184 7.4184 7.7991 7.7991 8.9311 8.9311 9.2328 9.2328 9.7700 9.7700 9.8820 9.8820 10.4872 10.4872 10.6684 10.6684 11.4417 11.4417 11.8805 11.8805 11.9901 11.9901 k = 0.3406 0.5514 0.3085 ( 10540 PWs) bands (ev): -46.4177 -46.4177 -46.3957 -46.3957 -23.1424 -23.1424 -23.1076 -23.1076 -22.5076 -22.5076 -22.5011 -22.5011 -22.4809 -22.4809 -22.3673 -22.3673 -0.2645 -0.2645 0.1684 0.1684 1.0015 1.0015 2.2509 2.2509 5.3075 5.3075 6.3083 6.3083 6.8529 6.8529 7.4394 7.4394 7.7775 7.7775 8.9377 8.9377 9.1548 9.1548 9.6971 9.6971 9.8342 9.8342 10.4942 10.4942 10.6378 10.6378 11.4065 11.4065 11.9117 11.9117 12.0292 12.0292 k = 0.3359 0.5437 0.3232 ( 10538 PWs) bands (ev): -46.4171 -46.4171 -46.3962 -46.3962 -23.1413 -23.1413 -23.1081 -23.1081 -22.5069 -22.5069 -22.4983 -22.4983 -22.4816 -22.4816 -22.3708 -22.3708 -0.2749 -0.2749 0.1542 0.1542 1.0034 1.0034 2.2614 2.2614 5.2973 5.2973 6.3955 6.3955 6.9647 6.9647 7.4626 7.4626 7.7561 7.7561 8.9462 8.9462 9.0770 9.0770 9.6197 9.6197 9.7856 9.7856 10.5004 10.5004 10.6070 10.6070 11.3661 11.3661 11.9436 11.9436 12.0715 12.0715 k = 0.3311 0.5360 0.3379 ( 10540 PWs) bands (ev): -46.4166 -46.4166 -46.3967 -46.3967 -23.1402 -23.1402 -23.1086 -23.1086 -22.5062 -22.5062 -22.4955 -22.4955 -22.4822 -22.4822 -22.3743 -22.3743 -0.2830 -0.2830 0.1416 0.1416 1.0069 1.0069 2.2599 2.2599 5.3029 5.3029 6.4798 6.4798 7.0746 7.0746 7.4874 7.4874 7.7361 7.7361 8.9541 8.9541 9.0011 9.0011 9.5399 9.5399 9.7365 9.7365 10.5034 10.5034 10.5779 10.5779 11.3220 11.3220 11.9761 11.9761 12.1149 12.1149 k = 0.3263 0.5283 0.3526 ( 10536 PWs) bands (ev): -46.4161 -46.4161 -46.3973 -46.3973 -23.1390 -23.1390 -23.1092 -23.1092 -22.5056 -22.5056 -22.4926 -22.4926 -22.4829 -22.4829 -22.3779 -22.3779 -0.2887 -0.2887 0.1304 0.1304 1.0121 1.0121 2.2463 2.2463 5.3244 5.3244 6.5605 6.5605 7.1812 7.1812 7.5128 7.5128 7.7197 7.7197 8.9194 8.9194 8.9683 8.9683 9.4603 9.4603 9.6871 9.6871 10.4951 10.4951 10.5577 10.5577 11.2756 11.2756 12.0092 12.0092 12.1579 12.1579 k = 0.3215 0.5205 0.3673 ( 10540 PWs) bands (ev): -46.4155 -46.4155 -46.3978 -46.3978 -23.1379 -23.1379 -23.1098 -23.1098 -22.5049 -22.5049 -22.4896 -22.4896 -22.4835 -22.4835 -22.3815 -22.3815 -0.2921 -0.2921 0.1206 0.1206 1.0190 1.0190 2.2211 2.2211 5.3615 5.3615 6.6367 6.6367 7.2828 7.2828 7.5359 7.5359 7.7108 7.7108 8.8458 8.8458 8.9736 8.9736 9.3841 9.3841 9.6377 9.6377 10.4674 10.4674 10.5540 10.5540 11.2277 11.2277 12.0425 12.0425 12.1998 12.1998 k = 0.3168 0.5128 0.3820 ( 10528 PWs) bands (ev): -46.4150 -46.4150 -46.3984 -46.3984 -23.1367 -23.1367 -23.1104 -23.1104 -22.5042 -22.5042 -22.4868 -22.4868 -22.4840 -22.4840 -22.3852 -22.3852 -0.2930 -0.2930 0.1121 0.1121 1.0276 1.0276 2.1854 2.1854 5.4136 5.4136 6.7073 6.7073 7.3764 7.3764 7.5527 7.5527 7.7148 7.7148 8.7728 8.7728 8.9756 8.9756 9.3155 9.3155 9.5885 9.5885 10.4269 10.4269 10.5596 10.5596 11.1792 11.1792 12.0756 12.0756 12.2405 12.2405 k = 0.3120 0.5051 0.3967 ( 10522 PWs) bands (ev): -46.4144 -46.4144 -46.3989 -46.3989 -23.1356 -23.1356 -23.1110 -23.1110 -22.5035 -22.5035 -22.4855 -22.4855 -22.4829 -22.4829 -22.3889 -22.3889 -0.2916 -0.2916 0.1046 0.1046 1.0381 1.0381 2.1401 2.1401 5.4796 5.4796 6.7718 6.7718 7.4563 7.4563 7.5625 7.5625 7.7359 7.7359 8.7020 8.7020 8.9707 8.9707 9.2591 9.2591 9.5397 9.5397 10.3795 10.3795 10.5685 10.5685 11.1308 11.1308 12.1078 12.1078 12.2772 12.2772 k = 0.3072 0.4974 0.4114 ( 10526 PWs) bands (ev): -46.4138 -46.4138 -46.3995 -46.3995 -23.1345 -23.1345 -23.1117 -23.1117 -22.5028 -22.5028 -22.4859 -22.4859 -22.4800 -22.4800 -22.3926 -22.3926 -0.2877 -0.2877 0.0981 0.0981 1.0505 1.0505 2.0869 2.0869 5.5584 5.5584 6.8294 6.8294 7.5040 7.5040 7.5826 7.5826 7.7720 7.7720 8.6342 8.6342 8.9576 8.9576 9.2191 9.2191 9.4919 9.4919 10.3269 10.3269 10.5788 10.5788 11.0832 11.0832 12.1386 12.1386 12.2890 12.2890 k = 0.3025 0.4897 0.4261 ( 10522 PWs) bands (ev): -46.4133 -46.4133 -46.4001 -46.4001 -23.1334 -23.1334 -23.1124 -23.1124 -22.5020 -22.5020 -22.4865 -22.4865 -22.4768 -22.4768 -22.3964 -22.3964 -0.2814 -0.2814 0.0922 0.0922 1.0647 1.0647 2.0270 2.0270 5.6486 5.6486 6.8797 6.8797 7.5083 7.5083 7.6255 7.6255 7.8174 7.8174 8.5702 8.5702 8.9394 8.9394 9.1957 9.1957 9.4452 9.4452 10.2697 10.2697 10.5898 10.5898 11.0368 11.0368 12.1673 12.1673 12.2754 12.2754 k = 0.2977 0.4819 0.4408 ( 10533 PWs) bands (ev): -46.4127 -46.4127 -46.4006 -46.4006 -23.1322 -23.1322 -23.1131 -23.1131 -22.5013 -22.5013 -22.4872 -22.4872 -22.4735 -22.4735 -22.4002 -22.4002 -0.2727 -0.2727 0.0867 0.0867 1.0809 1.0809 1.9622 1.9622 5.7490 5.7490 6.9225 6.9225 7.4961 7.4961 7.6639 7.6639 7.8674 7.8674 8.5106 8.5106 8.9239 8.9239 9.1848 9.1848 9.4003 9.4003 10.2085 10.2085 10.6012 10.6012 10.9920 10.9920 12.1935 12.1935 12.2594 12.2594 k = 0.2929 0.4742 0.4555 ( 10534 PWs) bands (ev): -46.4121 -46.4121 -46.4012 -46.4012 -23.1311 -23.1311 -23.1138 -23.1138 -22.5006 -22.5006 -22.4879 -22.4879 -22.4702 -22.4702 -22.4039 -22.4039 -0.2616 -0.2616 0.0813 0.0813 1.0991 1.0991 1.8938 1.8938 5.8583 5.8583 6.9577 6.9577 7.4791 7.4791 7.6844 7.6844 7.9190 7.9190 8.4558 8.4558 8.9194 8.9194 9.1813 9.1813 9.3578 9.3578 10.1439 10.1439 10.6128 10.6128 10.9493 10.9493 12.2164 12.2164 12.2471 12.2471 k = 0.2882 0.4665 0.4702 ( 10539 PWs) bands (ev): -46.4115 -46.4115 -46.4018 -46.4018 -23.1300 -23.1300 -23.1146 -23.1146 -22.4999 -22.4999 -22.4886 -22.4886 -22.4668 -22.4668 -22.4077 -22.4077 -0.2481 -0.2481 0.0755 0.0755 1.1191 1.1191 1.8234 1.8234 5.9753 5.9753 6.9854 6.9854 7.4600 7.4600 7.6826 7.6826 7.9707 7.9707 8.4061 8.4061 8.9310 8.9310 9.1813 9.1813 9.3185 9.3185 10.0764 10.0764 10.6244 10.6244 10.9088 10.9088 12.2308 12.2308 12.2442 12.2442 k = 0.2834 0.4588 0.4849 ( 10538 PWs) bands (ev): -46.4109 -46.4109 -46.4024 -46.4024 -23.1289 -23.1289 -23.1154 -23.1154 -22.4992 -22.4992 -22.4893 -22.4893 -22.4634 -22.4634 -22.4115 -22.4115 -0.2322 -0.2322 0.0688 0.0688 1.1412 1.1412 1.7523 1.7523 6.0988 6.0988 7.0057 7.0057 7.4398 7.4398 7.6587 7.6587 8.0213 8.0213 8.3617 8.3617 8.9593 8.9593 9.1825 9.1825 9.2839 9.2839 10.0067 10.0067 10.6358 10.6358 10.8710 10.8710 12.2302 12.2302 12.2574 12.2574 k = 0.2786 0.4510 0.4995 ( 10536 PWs) bands (ev): -46.4103 -46.4103 -46.4030 -46.4030 -23.1279 -23.1279 -23.1162 -23.1162 -22.4985 -22.4985 -22.4900 -22.4900 -22.4599 -22.4599 -22.4154 -22.4154 -0.2139 -0.2139 0.0608 0.0608 1.1651 1.1651 1.6820 1.6820 6.2279 6.2279 7.0185 7.0185 7.4185 7.4185 7.6156 7.6156 8.0691 8.0691 8.3228 8.3228 9.0009 9.0009 9.1826 9.1826 9.2569 9.2569 9.9352 9.9352 10.6469 10.6469 10.8363 10.8363 12.2303 12.2303 12.2704 12.2704 k = 0.2738 0.4433 0.5142 ( 10543 PWs) bands (ev): -46.4097 -46.4097 -46.4036 -46.4036 -23.1268 -23.1268 -23.1171 -23.1171 -22.4978 -22.4978 -22.4907 -22.4907 -22.4563 -22.4563 -22.4192 -22.4192 -0.1932 -0.1932 0.0507 0.0507 1.1910 1.1910 1.6138 1.6138 6.3611 6.3611 7.0241 7.0241 7.3961 7.3961 7.5579 7.5579 8.1126 8.1126 8.2898 8.2898 9.0488 9.0488 9.1785 9.1785 9.2442 9.2442 9.8625 9.8625 10.6577 10.6577 10.8048 10.8048 12.2336 12.2336 12.2800 12.2800 k = 0.2691 0.4356 0.5289 ( 10545 PWs) bands (ev): -46.4091 -46.4091 -46.4042 -46.4042 -23.1257 -23.1257 -23.1179 -23.1179 -22.4971 -22.4971 -22.4915 -22.4915 -22.4527 -22.4527 -22.4230 -22.4230 -0.1701 -0.1701 0.0379 0.0379 1.2187 1.2187 1.5491 1.5491 6.4971 6.4971 7.0227 7.0227 7.3722 7.3722 7.4907 7.4907 8.1498 8.1498 8.2629 8.2629 9.0918 9.0918 9.1681 9.1681 9.2556 9.2556 9.7891 9.7891 10.6680 10.6680 10.7769 10.7769 12.2396 12.2396 12.2858 12.2858 k = 0.2643 0.4279 0.5436 ( 10544 PWs) bands (ev): -46.4085 -46.4085 -46.4048 -46.4048 -23.1247 -23.1247 -23.1188 -23.1188 -22.4963 -22.4963 -22.4922 -22.4922 -22.4491 -22.4491 -22.4268 -22.4268 -0.1447 -0.1447 0.0217 0.0217 1.2483 1.2483 1.4890 1.4890 6.6338 6.6338 7.0145 7.0145 7.3461 7.3461 7.4194 7.4194 8.1793 8.1793 8.2426 8.2426 9.1188 9.1188 9.1560 9.1560 9.2945 9.2945 9.7154 9.7154 10.6779 10.6779 10.7529 10.7529 12.2476 12.2476 12.2878 12.2878 k = 0.2595 0.4202 0.5583 ( 10542 PWs) bands (ev): -46.4079 -46.4079 -46.4054 -46.4054 -23.1237 -23.1237 -23.1198 -23.1198 -22.4956 -22.4956 -22.4929 -22.4929 -22.4455 -22.4455 -22.4305 -22.4305 -0.1170 -0.1170 0.0013 0.0013 1.2797 1.2797 1.4347 1.4347 6.7667 6.7667 6.9999 6.9999 7.3149 7.3149 7.3528 7.3528 8.1999 8.1999 8.2290 8.2290 9.1304 9.1304 9.1468 9.1468 9.3539 9.3539 9.6416 9.6416 10.6874 10.6874 10.7330 10.7330 12.2567 12.2567 12.2863 12.2863 k = 0.2548 0.4124 0.5730 ( 10545 PWs) bands (ev): -46.4073 -46.4073 -46.4061 -46.4061 -23.1227 -23.1227 -23.1207 -23.1207 -22.4949 -22.4949 -22.4936 -22.4936 -22.4418 -22.4418 -22.4343 -22.4343 -0.0869 -0.0869 -0.0240 -0.0240 1.3128 1.3128 1.3873 1.3873 6.8845 6.8845 6.9795 6.9795 7.2761 7.2761 7.3058 7.3058 8.2116 8.2116 8.2216 8.2216 9.1344 9.1344 9.1410 9.1410 9.4230 9.4230 9.5682 9.5682 10.6966 10.6966 10.7173 10.7173 12.2660 12.2660 12.2817 12.2817 k = 0.2500 0.4047 0.5877 ( 10552 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4943 -22.4943 -22.4943 -22.4943 -22.4380 -22.4380 -22.4380 -22.4380 -0.0546 -0.0546 -0.0546 -0.0546 1.3476 1.3476 1.3476 1.3476 6.9537 6.9537 6.9537 6.9537 7.2711 7.2711 7.2711 7.2711 8.2173 8.2173 8.2173 8.2173 9.1372 9.1372 9.1372 9.1372 9.4953 9.4953 9.4953 9.4953 10.7059 10.7059 10.7059 10.7059 12.2747 12.2747 12.2747 12.2747 k = 0.2500 0.4047 0.5877 ( 10552 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4943 -22.4943 -22.4943 -22.4943 -22.4380 -22.4380 -22.4380 -22.4380 -0.0546 -0.0546 -0.0546 -0.0546 1.3476 1.3476 1.3476 1.3476 6.9537 6.9537 6.9537 6.9537 7.2711 7.2711 7.2711 7.2711 8.2173 8.2173 8.2173 8.2173 9.1372 9.1372 9.1372 9.1372 9.4953 9.4953 9.4953 9.4953 10.7059 10.7059 10.7059 10.7059 12.2747 12.2747 12.2747 12.2747 k = 0.2396 0.4112 0.5755 ( 10538 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4943 -22.4943 -22.4943 -22.4943 -22.4380 -22.4380 -22.4380 -22.4380 -0.0562 -0.0562 -0.0560 -0.0560 1.3505 1.3505 1.3509 1.3509 6.9127 6.9127 6.9328 6.9328 7.2884 7.2884 7.3102 7.3102 8.2159 8.2159 8.2170 8.2170 9.1379 9.1379 9.1410 9.1410 9.4924 9.4924 9.4984 9.4984 10.7046 10.7046 10.7118 10.7118 12.2729 12.2729 12.2743 12.2743 k = 0.2292 0.4176 0.5632 ( 10538 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4943 -22.4943 -22.4942 -22.4942 -22.4380 -22.4380 -22.4380 -22.4380 -0.0608 -0.0608 -0.0604 -0.0604 1.3595 1.3595 1.3605 1.3605 6.8356 6.8356 6.8642 6.8642 7.3481 7.3481 7.3798 7.3798 8.2130 8.2130 8.2154 8.2154 9.1428 9.1428 9.1491 9.1491 9.4899 9.4899 9.5019 9.5019 10.7079 10.7079 10.7222 10.7222 12.2691 12.2691 12.2720 12.2720 k = 0.2188 0.4240 0.5510 ( 10538 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4380 -22.4380 -22.4380 -22.4380 -0.0682 -0.0682 -0.0677 -0.0677 1.3746 1.3746 1.3760 1.3760 6.7434 6.7434 6.7745 6.7745 7.4232 7.4232 7.4584 7.4584 8.2091 8.2091 8.2134 8.2134 9.1516 9.1516 9.1612 9.1612 9.4881 9.4881 9.5059 9.5059 10.7156 10.7156 10.7367 10.7367 12.2631 12.2631 12.2675 12.2675 k = 0.2083 0.4305 0.5387 ( 10542 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4380 -22.4380 -22.4380 -22.4380 -0.0782 -0.0782 -0.0775 -0.0775 1.3953 1.3953 1.3971 1.3971 6.6446 6.6446 6.6759 6.6759 7.5009 7.5009 7.5365 7.5365 8.2052 8.2052 8.2122 8.2122 9.1636 9.1636 9.1766 9.1766 9.4876 9.4876 9.5110 9.5110 10.7274 10.7274 10.7549 10.7549 12.2547 12.2547 12.2609 12.2609 k = 0.1979 0.4369 0.5265 ( 10544 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4380 -22.4380 -22.4380 -22.4380 -0.0903 -0.0903 -0.0895 -0.0895 1.4212 1.4212 1.4234 1.4234 6.5426 6.5426 6.5733 6.5733 7.5755 7.5755 7.6094 7.6094 8.2027 8.2027 8.2136 8.2136 9.1781 9.1781 9.1945 9.1945 9.4892 9.4892 9.5177 9.5177 10.7426 10.7426 10.7763 10.7763 12.2436 12.2436 12.2520 12.2520 k = 0.1875 0.4433 0.5142 ( 10540 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4380 -22.4380 -22.4380 -22.4380 -0.1043 -0.1043 -0.1033 -0.1033 1.4518 1.4518 1.4544 1.4544 6.4392 6.4392 6.4688 6.4688 7.6434 7.6434 7.6736 7.6736 8.2037 8.2037 8.2198 8.2198 9.1942 9.1942 9.2138 9.2138 9.4938 9.4938 9.5269 9.5269 10.7607 10.7607 10.8003 10.8003 12.2295 12.2295 12.2406 12.2406 k = 0.1771 0.4498 0.5020 ( 10540 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4380 -22.4380 -22.4380 -22.4380 -0.1197 -0.1197 -0.1187 -0.1187 1.4866 1.4866 1.4895 1.4895 6.3354 6.3354 6.3637 6.3637 7.7016 7.7016 7.7263 7.7263 8.2103 8.2103 8.2332 8.2332 9.2109 9.2109 9.2333 9.2333 9.5024 9.5024 9.5393 9.5393 10.7811 10.7811 10.8261 10.8261 12.2120 12.2120 12.2263 12.2263 k = 0.1667 0.4562 0.4898 ( 10528 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4380 -22.4380 -22.4380 -22.4380 -0.1361 -0.1361 -0.1350 -0.1350 1.5250 1.5250 1.5282 1.5282 6.2320 6.2320 6.2590 6.2590 7.7475 7.7475 7.7656 7.7656 8.2247 8.2247 8.2553 8.2553 9.2276 9.2276 9.2519 9.2519 9.5161 9.5161 9.5557 9.5557 10.8031 10.8031 10.8532 10.8532 12.1907 12.1907 12.2089 12.2089 k = 0.1562 0.4626 0.4775 ( 10524 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4380 -22.4380 -0.1532 -0.1532 -0.1521 -0.1521 1.5664 1.5664 1.5698 1.5698 6.1299 6.1299 6.1554 6.1554 7.7799 7.7799 7.7911 7.7911 8.2482 8.2482 8.2861 8.2861 9.2437 9.2437 9.2687 9.2687 9.5356 9.5356 9.5766 9.5766 10.8260 10.8260 10.8809 10.8809 12.1650 12.1650 12.1878 12.1878 k = 0.1458 0.4691 0.4653 ( 10518 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4380 -22.4380 -0.1706 -0.1706 -0.1695 -0.1695 1.6100 1.6100 1.6136 1.6136 6.0295 6.0295 6.0535 6.0535 7.7993 7.7993 7.8045 7.8045 8.2800 8.2800 8.3239 8.3239 9.2587 9.2587 9.2834 9.2834 9.5612 9.5612 9.6024 9.6024 10.8493 10.8493 10.9088 10.9088 12.1345 12.1345 12.1624 12.1624 k = 0.1354 0.4755 0.4530 ( 10516 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.1879 -0.1879 -0.1868 -0.1868 1.6554 1.6554 1.6591 1.6591 5.9315 5.9315 5.9541 5.9541 7.8078 7.8078 7.8086 7.8086 8.3179 8.3179 8.3658 8.3658 9.2728 9.2728 9.2959 9.2959 9.5924 9.5924 9.6328 9.6328 10.8725 10.8725 10.9363 10.9363 12.0992 12.0992 12.1324 12.1324 k = 0.1250 0.4819 0.4408 ( 10518 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.2049 -0.2049 -0.2039 -0.2039 1.7018 1.7018 1.7056 1.7056 5.8366 5.8366 5.8576 5.8576 7.8062 7.8062 7.8083 7.8083 8.3591 8.3591 8.4088 8.4088 9.2860 9.2860 9.3070 9.3070 9.6285 9.6285 9.6674 9.6674 10.8953 10.8953 10.9632 10.9632 12.0590 12.0590 12.0976 12.0976 k = 0.1146 0.4884 0.4285 ( 10506 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.2214 -0.2214 -0.2204 -0.2204 1.7485 1.7485 1.7524 1.7524 5.7454 5.7454 5.7648 5.7648 7.7996 7.7996 7.8034 7.8034 8.4009 8.4009 8.4506 8.4506 9.2986 9.2986 9.3170 9.3170 9.6683 9.6683 9.7057 9.7057 10.9174 10.9174 10.9892 10.9892 12.0144 12.0144 12.0579 12.0579 k = 0.1042 0.4948 0.4163 ( 10512 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.2371 -0.2371 -0.2361 -0.2361 1.7950 1.7950 1.7988 1.7988 5.6585 5.6585 5.6763 5.6763 7.7905 7.7905 7.7952 7.7952 8.4413 8.4413 8.4896 8.4896 9.3109 9.3109 9.3266 9.3266 9.7108 9.7108 9.7466 9.7466 10.9388 10.9388 11.0142 11.0142 11.9661 11.9661 12.0140 12.0140 k = 0.0938 0.5012 0.4040 ( 10510 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.2517 -0.2517 -0.2508 -0.2508 1.8403 1.8403 1.8440 1.8440 5.5767 5.5767 5.5929 5.5929 7.7801 7.7801 7.7852 7.7852 8.4791 8.4791 8.5248 8.5248 9.3231 9.3231 9.3361 9.3361 9.7549 9.7549 9.7891 9.7891 10.9596 10.9596 11.0381 11.0381 11.9150 11.9150 11.9665 11.9665 k = 0.0833 0.5077 0.3918 ( 10504 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.2652 -0.2652 -0.2644 -0.2644 1.8839 1.8839 1.8874 1.8874 5.5006 5.5006 5.5152 5.5152 7.7694 7.7694 7.7745 7.7745 8.5134 8.5134 8.5554 8.5554 9.3350 9.3350 9.3455 9.3455 9.7994 9.7994 9.8320 9.8320 10.9801 10.9801 11.0610 11.0610 11.8620 11.8620 11.9165 11.9165 k = 0.0729 0.5141 0.3796 ( 10504 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.2774 -0.2774 -0.2767 -0.2767 1.9249 1.9249 1.9282 1.9282 5.4311 5.4311 5.4440 5.4440 7.7590 7.7590 7.7639 7.7639 8.5437 8.5437 8.5815 8.5815 9.3465 9.3465 9.3548 9.3548 9.8433 9.8433 9.8741 9.8741 11.0006 11.0006 11.0828 11.0828 11.8086 11.8086 11.8651 11.8651 k = 0.0625 0.5205 0.3673 ( 10512 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.2882 -0.2882 -0.2876 -0.2876 1.9626 1.9626 1.9656 1.9656 5.3689 5.3689 5.3801 5.3801 7.7493 7.7493 7.7537 7.7537 8.5699 8.5699 8.6029 8.6029 9.3575 9.3575 9.3639 9.3639 9.8853 9.8853 9.9140 9.9140 11.0214 11.0214 11.1033 11.1033 11.7561 11.7561 11.8134 11.8134 k = 0.0521 0.5270 0.3551 ( 10514 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.2975 -0.2975 -0.2970 -0.2970 1.9962 1.9962 1.9988 1.9988 5.3148 5.3148 5.3242 5.3242 7.7407 7.7407 7.7446 7.7446 8.5921 8.5921 8.6200 8.6200 9.3675 9.3675 9.3723 9.3723 9.9243 9.9243 9.9502 9.9502 11.0430 11.0430 11.1222 11.1222 11.7064 11.7064 11.7629 11.7629 k = 0.0417 0.5334 0.3428 ( 10522 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.3052 -0.3052 -0.3048 -0.3048 2.0250 2.0250 2.0272 2.0272 5.2695 5.2695 5.2771 5.2771 7.7335 7.7335 7.7367 7.7367 8.6104 8.6104 8.6328 8.6328 9.3764 9.3764 9.3797 9.3797 9.9591 9.9591 9.9815 9.9815 11.0654 11.0654 11.1385 11.1385 11.6616 11.6616 11.7149 11.7149 k = 0.0312 0.5398 0.3306 ( 10524 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.3112 -0.3112 -0.3109 -0.3109 2.0482 2.0482 2.0499 2.0499 5.2337 5.2337 5.2394 5.2394 7.7278 7.7278 7.7302 7.7302 8.6249 8.6249 8.6419 8.6419 9.3837 9.3837 9.3859 9.3859 9.9885 9.9885 10.0064 10.0064 11.0882 11.0882 11.1509 11.1509 11.6247 11.6247 11.6712 11.6712 k = 0.0208 0.5463 0.3183 ( 10522 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.3156 -0.3156 -0.3153 -0.3153 2.0654 2.0654 2.0665 2.0665 5.2079 5.2079 5.2118 5.2118 7.7238 7.7238 7.7254 7.7254 8.6360 8.6360 8.6473 8.6473 9.3892 9.3892 9.3905 9.3905 10.0114 10.0114 10.0239 10.0239 11.1108 11.1108 11.1575 11.1575 11.5986 11.5986 11.6339 11.6339 k = 0.0104 0.5527 0.3061 ( 10520 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.3182 -0.3182 -0.3180 -0.3180 2.0760 2.0760 2.0766 2.0766 5.1927 5.1927 5.1946 5.1946 7.7215 7.7215 7.7223 7.7223 8.6436 8.6436 8.6493 8.6493 9.3926 9.3926 9.3933 9.3933 10.0269 10.0269 10.0334 10.0334 11.1312 11.1312 11.1564 11.1564 11.5862 11.5862 11.6055 11.6055 k = 0.0000 0.5591 0.2939 ( 10532 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.3190 -0.3190 -0.3190 -0.3190 2.0797 2.0797 2.0797 2.0797 5.1882 5.1882 5.1882 5.1882 7.7210 7.7210 7.7210 7.7210 8.6481 8.6481 8.6481 8.6481 9.3940 9.3940 9.3940 9.3940 10.0344 10.0344 10.0344 10.0344 11.1472 11.1472 11.1472 11.1472 11.5888 11.5888 11.5888 11.5888 k = 0.0000 0.5591 0.2939 ( 10532 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4942 -22.4942 -22.4942 -22.4942 -22.4381 -22.4381 -22.4381 -22.4381 -0.3190 -0.3190 -0.3190 -0.3190 2.0797 2.0797 2.0797 2.0797 5.1882 5.1882 5.1882 5.1882 7.7210 7.7210 7.7210 7.7210 8.6481 8.6481 8.6481 8.6481 9.3940 9.3940 9.3940 9.3940 10.0344 10.0344 10.0344 10.0344 11.1472 11.1472 11.1472 11.1472 11.5888 11.5888 11.5888 11.5888 k =-0.0138 0.5543 0.3030 ( 10525 PWs) bands (ev): -46.4074 -46.4074 -46.4059 -46.4059 -23.1229 -23.1229 -23.1205 -23.1205 -22.4952 -22.4952 -22.4933 -22.4933 -22.4427 -22.4427 -22.4334 -22.4334 -0.3218 -0.3218 -0.3139 -0.3139 2.0535 2.0535 2.1015 2.1015 5.1390 5.1390 5.2453 5.2453 7.6292 7.6292 7.8043 7.8043 8.6040 8.6040 8.6749 8.6749 9.3771 9.3771 9.4275 9.4275 10.0135 10.0135 10.0581 10.0581 11.1303 11.1303 11.1646 11.1646 11.5716 11.5716 11.6068 11.6068 k =-0.0275 0.5495 0.3122 ( 10519 PWs) bands (ev): -46.4082 -46.4082 -46.4051 -46.4051 -23.1241 -23.1241 -23.1194 -23.1194 -22.4961 -22.4961 -22.4923 -22.4923 -22.4473 -22.4473 -22.4287 -22.4287 -0.3224 -0.3224 -0.3065 -0.3065 2.0234 2.0234 2.1183 2.1183 5.0984 5.0984 5.3097 5.3097 7.5314 7.5314 7.8750 7.8750 8.5487 8.5487 8.6825 8.6825 9.3767 9.3767 9.4748 9.4748 9.9961 9.9961 10.0839 10.0839 11.1137 11.1137 11.1825 11.1825 11.5556 11.5556 11.6257 11.6257 k =-0.0413 0.5447 0.3214 ( 10523 PWs) bands (ev): -46.4089 -46.4089 -46.4044 -46.4044 -23.1253 -23.1253 -23.1183 -23.1183 -22.4971 -22.4971 -22.4914 -22.4914 -22.4518 -22.4518 -22.4239 -22.4239 -0.3208 -0.3208 -0.2968 -0.2968 1.9900 1.9900 2.1297 2.1297 5.0669 5.0669 5.3805 5.3805 7.4292 7.4292 7.9260 7.9260 8.4923 8.4923 8.6729 8.6729 9.3900 9.3900 9.5319 9.5319 9.9828 9.9828 10.1115 10.1115 11.0972 11.0972 11.2010 11.2010 11.5412 11.5412 11.6453 11.6453 k =-0.0551 0.5398 0.3306 ( 10526 PWs) bands (ev): -46.4097 -46.4097 -46.4036 -46.4036 -23.1266 -23.1266 -23.1172 -23.1172 -22.4980 -22.4980 -22.4904 -22.4904 -22.4563 -22.4563 -22.4192 -22.4192 -0.3169 -0.3169 -0.2849 -0.2849 1.9538 1.9538 2.1353 2.1353 5.0449 5.0449 5.4570 5.4570 7.3237 7.3237 7.9462 7.9462 8.4491 8.4491 8.6502 8.6502 9.4131 9.4131 9.5948 9.5948 9.9743 9.9743 10.1404 10.1404 11.0805 11.0805 11.2199 11.2199 11.5287 11.5287 11.6658 11.6658 k =-0.0689 0.5350 0.3398 ( 10526 PWs) bands (ev): -46.4105 -46.4105 -46.4029 -46.4029 -23.1279 -23.1279 -23.1162 -23.1162 -22.4990 -22.4990 -22.4895 -22.4895 -22.4607 -22.4607 -22.4144 -22.4144 -0.3109 -0.3109 -0.2706 -0.2706 1.9154 1.9154 2.1347 2.1347 5.0328 5.0328 5.5385 5.5385 7.2161 7.2161 7.9248 7.9248 8.4314 8.4314 8.6192 8.6192 9.4417 9.4417 9.6598 9.6598 9.9714 9.9714 10.1701 10.1701 11.0635 11.0635 11.2391 11.2391 11.5189 11.5189 11.6872 11.6872 k =-0.0826 0.5302 0.3489 ( 10526 PWs) bands (ev): -46.4112 -46.4112 -46.4021 -46.4021 -23.1293 -23.1293 -23.1152 -23.1152 -22.4999 -22.4999 -22.4885 -22.4885 -22.4651 -22.4651 -22.4097 -22.4097 -0.3028 -0.3028 -0.2541 -0.2541 1.8753 1.8753 2.1280 2.1280 5.0306 5.0306 5.6241 5.6241 7.1071 7.1071 7.8628 7.8628 8.4380 8.4380 8.5857 8.5857 9.4729 9.4729 9.7244 9.7244 9.9747 9.9747 10.2003 10.2003 11.0461 11.0461 11.2584 11.2584 11.5120 11.5120 11.7096 11.7096 k =-0.0964 0.5254 0.3581 ( 10536 PWs) bands (ev): -46.4119 -46.4119 -46.4014 -46.4014 -23.1306 -23.1306 -23.1143 -23.1143 -22.5008 -22.5008 -22.4876 -22.4876 -22.4694 -22.4694 -22.4049 -22.4049 -0.2927 -0.2927 -0.2352 -0.2352 1.8338 1.8338 2.1150 2.1150 5.0382 5.0382 5.7129 5.7129 6.9975 6.9975 7.7722 7.7722 8.4499 8.4499 8.5607 8.5607 9.5045 9.5045 9.7866 9.7866 9.9843 9.9843 10.2305 10.2305 11.0282 11.0282 11.2775 11.2775 11.5085 11.5085 11.7331 11.7331 k =-0.1102 0.5205 0.3673 ( 10533 PWs) bands (ev): -46.4127 -46.4127 -46.4007 -46.4007 -23.1320 -23.1320 -23.1134 -23.1134 -22.5018 -22.5018 -22.4867 -22.4867 -22.4736 -22.4736 -22.4002 -22.4002 -0.2805 -0.2805 -0.2142 -0.2142 1.7915 1.7915 2.0960 2.0960 5.0555 5.0555 5.8039 5.8039 6.8883 6.8883 7.6645 7.6645 8.4386 8.4386 8.5642 8.5642 9.5354 9.5354 9.8454 9.8454 10.0002 10.0002 10.2600 10.2600 11.0100 11.0100 11.2963 11.2963 11.5085 11.5085 11.7575 11.7575 k =-0.1240 0.5157 0.3765 ( 10534 PWs) bands (ev): -46.4134 -46.4134 -46.3999 -46.3999 -23.1334 -23.1334 -23.1125 -23.1125 -22.5027 -22.5027 -22.4858 -22.4858 -22.4777 -22.4777 -22.3955 -22.3955 -0.2663 -0.2663 -0.1908 -0.1908 1.7487 1.7487 2.0712 2.0712 5.0820 5.0820 5.8962 5.8962 6.7803 6.7803 7.5469 7.5469 8.4029 8.4029 8.5927 8.5927 9.5652 9.5652 9.9002 9.9002 10.0217 10.0217 10.2885 10.2885 10.9918 10.9918 11.3143 11.3143 11.5122 11.5122 11.7827 11.7827 k =-0.1377 0.5109 0.3857 ( 10528 PWs) bands (ev): -46.4141 -46.4141 -46.3992 -46.3992 -23.1348 -23.1348 -23.1117 -23.1117 -22.5036 -22.5036 -22.4849 -22.4849 -22.4817 -22.4817 -22.3908 -22.3908 -0.2503 -0.2503 -0.1652 -0.1652 1.7057 1.7057 2.0411 2.0411 5.1170 5.1170 5.9880 5.9880 6.6746 6.6746 7.4239 7.4239 8.3579 8.3579 8.6290 8.6290 9.5939 9.5939 9.9508 9.9508 10.0477 10.0477 10.3150 10.3150 10.9742 10.9742 11.3315 11.3315 11.5193 11.5193 11.8082 11.8082 k =-0.1515 0.5061 0.3949 ( 10526 PWs) bands (ev): -46.4148 -46.4148 -46.3985 -46.3985 -23.1362 -23.1362 -23.1109 -23.1109 -22.5045 -22.5045 -22.4856 -22.4856 -22.4840 -22.4840 -22.3862 -22.3862 -0.2324 -0.2324 -0.1375 -0.1375 1.6628 1.6628 2.0061 2.0061 5.1598 5.1598 6.0772 6.0772 6.5734 6.5734 7.2983 7.2983 8.3097 8.3097 8.6663 8.6663 9.6222 9.6222 9.9970 9.9970 10.0773 10.0773 10.3388 10.3388 10.9578 10.9578 11.3476 11.3476 11.5295 11.5295 11.8336 11.8336 k =-0.1653 0.5012 0.4040 ( 10522 PWs) bands (ev): -46.4155 -46.4155 -46.3978 -46.3978 -23.1377 -23.1377 -23.1101 -23.1101 -22.5053 -22.5053 -22.4894 -22.4894 -22.4832 -22.4832 -22.3816 -22.3816 -0.2128 -0.2128 -0.1076 -0.1076 1.6202 1.6202 1.9667 1.9667 5.2092 5.2092 6.1583 6.1583 6.4810 6.4810 7.1728 7.1728 8.2603 8.2603 8.7027 8.7027 9.6505 9.6505 10.0382 10.0382 10.1099 10.1099 10.3592 10.3592 10.9431 10.9431 11.3625 11.3625 11.5421 11.5421 11.8582 11.8582 k =-0.1791 0.4964 0.4132 ( 10535 PWs) bands (ev): -46.4162 -46.4162 -46.3972 -46.3972 -23.1391 -23.1391 -23.1094 -23.1094 -22.5062 -22.5062 -22.4932 -22.4932 -22.4823 -22.4823 -22.3770 -22.3770 -0.1916 -0.1916 -0.0756 -0.0756 1.5782 1.5782 1.9235 1.9235 5.2639 5.2639 6.2146 6.2146 6.4130 6.4130 7.0502 7.0502 8.2106 8.2106 8.7381 8.7381 9.6791 9.6791 10.0738 10.0738 10.1452 10.1452 10.3753 10.3753 10.9309 10.9309 11.3761 11.3761 11.5562 11.5562 11.8814 11.8814 k =-0.1928 0.4916 0.4224 ( 10536 PWs) bands (ev): -46.4169 -46.4169 -46.3965 -46.3965 -23.1405 -23.1405 -23.1087 -23.1087 -22.5070 -22.5070 -22.4968 -22.4968 -22.4815 -22.4815 -22.3726 -22.3726 -0.1688 -0.1688 -0.0415 -0.0415 1.5370 1.5370 1.8770 1.8770 5.3219 5.3219 6.2057 6.2057 6.4059 6.4059 6.9358 6.9358 8.1612 8.1612 8.7727 8.7727 9.7084 9.7084 10.1033 10.1033 10.1828 10.1828 10.3869 10.3869 10.9216 10.9216 11.3881 11.3881 11.5704 11.5704 11.9024 11.9024 k =-0.2066 0.4868 0.4316 ( 10543 PWs) bands (ev): -46.4175 -46.4175 -46.3958 -46.3958 -23.1420 -23.1420 -23.1080 -23.1080 -22.5078 -22.5078 -22.5003 -22.5003 -22.4807 -22.4807 -22.3682 -22.3682 -0.1446 -0.1446 -0.0055 -0.0055 1.4968 1.4968 1.8278 1.8278 5.3802 5.3802 6.1480 6.1480 6.4343 6.4343 6.8418 6.8418 8.1123 8.1123 8.8073 8.8073 9.7383 9.7383 10.1269 10.1269 10.2214 10.2214 10.3939 10.3939 10.9156 10.9156 11.3984 11.3984 11.5825 11.5825 11.9102 11.9102 k =-0.2204 0.4819 0.4408 ( 10538 PWs) bands (ev): -46.4181 -46.4181 -46.3952 -46.3952 -23.1434 -23.1434 -23.1074 -23.1074 -22.5086 -22.5086 -22.5037 -22.5037 -22.4799 -22.4799 -22.3638 -22.3638 -0.1191 -0.1191 0.0324 0.0324 1.4576 1.4576 1.7764 1.7764 5.4340 5.4340 6.0869 6.0869 6.4321 6.4321 6.7927 6.7927 8.0640 8.0640 8.8428 8.8428 9.7688 9.7688 10.1448 10.1448 10.2597 10.2597 10.3971 10.3971 10.9127 10.9127 11.4067 11.4067 11.5894 11.5894 11.8759 11.8759 k =-0.2342 0.4771 0.4500 ( 10543 PWs) bands (ev): -46.4188 -46.4188 -46.3946 -46.3946 -23.1448 -23.1448 -23.1068 -23.1068 -22.5094 -22.5094 -22.5070 -22.5070 -22.4792 -22.4792 -22.3596 -22.3596 -0.0924 -0.0924 0.0722 0.0722 1.4197 1.4197 1.7232 1.7232 5.4753 5.4753 6.0418 6.0418 6.3733 6.3733 6.8027 6.8027 8.0167 8.0167 8.8799 8.8799 9.7993 9.7993 10.1570 10.1570 10.2951 10.2951 10.3989 10.3989 10.9126 10.9126 11.4128 11.4128 11.5875 11.5875 11.8521 11.8521 k =-0.2479 0.4723 0.4591 ( 10534 PWs) bands (ev): -46.4194 -46.4194 -46.3940 -46.3940 -23.1462 -23.1462 -23.1062 -23.1062 -22.5102 -22.5102 -22.5101 -22.5101 -22.4784 -22.4784 -22.3555 -22.3555 -0.0648 -0.0648 0.1137 0.1137 1.3831 1.3831 1.6687 1.6687 5.4944 5.4944 6.0247 6.0247 6.2786 6.2786 6.8483 6.8483 7.9703 7.9703 8.9194 8.9194 9.8293 9.8293 10.1633 10.1633 10.3228 10.3228 10.4051 10.4051 10.9149 10.9149 11.4163 11.4163 11.5751 11.5751 11.8444 11.8444 k =-0.2617 0.4675 0.4683 ( 10521 PWs) bands (ev): -46.4200 -46.4200 -46.3934 -46.3934 -23.1476 -23.1476 -23.1057 -23.1057 -22.5132 -22.5132 -22.5109 -22.5109 -22.4777 -22.4777 -22.3514 -22.3514 -0.0364 -0.0364 0.1569 0.1569 1.3480 1.3480 1.6134 1.6134 5.4853 5.4853 6.0395 6.0395 6.1733 6.1733 6.9062 6.9062 7.9250 7.9250 8.9619 8.9619 9.8580 9.8580 10.1633 10.1633 10.3355 10.3355 10.4240 10.4240 10.9187 10.9187 11.4167 11.4167 11.5545 11.5545 11.8512 11.8512 k =-0.2755 0.4626 0.4775 ( 10519 PWs) bands (ev): -46.4205 -46.4205 -46.3928 -46.3928 -23.1490 -23.1490 -23.1052 -23.1052 -22.5161 -22.5161 -22.5116 -22.5116 -22.4770 -22.4770 -22.3475 -22.3475 -0.0074 -0.0074 0.2016 0.2016 1.3144 1.3144 1.5577 1.5577 5.4518 5.4518 6.0289 6.0289 6.1204 6.1204 6.9658 6.9658 7.8808 7.8808 9.0078 9.0078 9.8839 9.8839 10.1572 10.1572 10.3352 10.3352 10.4554 10.4554 10.9236 10.9236 11.4139 11.4139 11.5303 11.5303 11.8685 11.8685 k =-0.2893 0.4578 0.4867 ( 10517 PWs) bands (ev): -46.4211 -46.4211 -46.3923 -46.3923 -23.1503 -23.1503 -23.1047 -23.1047 -22.5189 -22.5189 -22.5123 -22.5123 -22.4764 -22.4764 -22.3437 -22.3437 0.0219 0.0219 0.2476 0.2476 1.2824 1.2824 1.5019 1.5019 5.4035 5.4035 5.9249 5.9249 6.1828 6.1828 7.0231 7.0231 7.8377 7.8377 9.0570 9.0570 9.9045 9.9045 10.1463 10.1463 10.3291 10.3291 10.4932 10.4932 10.9294 10.9294 11.4075 11.4075 11.5064 11.5064 11.8923 11.8923 k =-0.3030 0.4530 0.4959 ( 10521 PWs) bands (ev): -46.4216 -46.4216 -46.3918 -46.3918 -23.1516 -23.1516 -23.1042 -23.1042 -22.5216 -22.5216 -22.5129 -22.5129 -22.4757 -22.4757 -22.3400 -22.3400 0.0512 0.0512 0.2949 0.2949 1.2522 1.2522 1.4466 1.4466 5.3482 5.3482 5.8115 5.8115 6.2705 6.2705 7.0762 7.0762 7.7957 7.7957 9.1094 9.1094 9.9159 9.9159 10.1341 10.1341 10.3208 10.3208 10.5345 10.5345 10.9358 10.9358 11.3975 11.3975 11.4853 11.4853 11.9203 11.9203 k =-0.3168 0.4482 0.5051 ( 10536 PWs) bands (ev): -46.4221 -46.4221 -46.3912 -46.3912 -23.1529 -23.1529 -23.1038 -23.1038 -22.5241 -22.5241 -22.5136 -22.5136 -22.4751 -22.4751 -22.3365 -22.3365 0.0800 0.0800 0.3433 0.3433 1.2237 1.2237 1.3922 1.3922 5.2910 5.2910 5.6987 5.6987 6.3693 6.3693 7.1241 7.1241 7.7550 7.7550 9.1645 9.1645 9.9127 9.9127 10.1258 10.1258 10.3116 10.3116 10.5787 10.5787 10.9430 10.9430 11.3838 11.3838 11.4681 11.4681 11.9508 11.9508 k =-0.3306 0.4433 0.5142 ( 10532 PWs) bands (ev): -46.4226 -46.4226 -46.3908 -46.3908 -23.1541 -23.1541 -23.1034 -23.1034 -22.5265 -22.5265 -22.5141 -22.5141 -22.4745 -22.4745 -22.3330 -22.3330 0.1081 0.1081 0.3926 0.3926 1.1969 1.1969 1.3391 1.3391 5.2346 5.2346 5.5883 5.5883 6.4753 6.4753 7.1667 7.1667 7.7154 7.7154 9.2214 9.2214 9.8911 9.8911 10.1258 10.1258 10.3015 10.3015 10.6259 10.6259 10.9515 10.9515 11.3668 11.3668 11.4550 11.4550 11.9830 11.9830 k =-0.3444 0.4385 0.5234 ( 10532 PWs) bands (ev): -46.4231 -46.4231 -46.3903 -46.3903 -23.1553 -23.1553 -23.1031 -23.1031 -22.5288 -22.5288 -22.5147 -22.5147 -22.4740 -22.4740 -22.3298 -22.3298 0.1348 0.1348 0.4425 0.4425 1.1720 1.1720 1.2881 1.2881 5.1808 5.1808 5.4811 5.4811 6.5864 6.5864 7.2040 7.2040 7.6770 7.6770 9.2792 9.2792 9.8520 9.8520 10.1333 10.1333 10.2906 10.2906 10.6764 10.6764 10.9615 10.9615 11.3467 11.3467 11.4457 11.4457 12.0162 12.0162 k =-0.3581 0.4337 0.5326 ( 10523 PWs) bands (ev): -46.4235 -46.4235 -46.3899 -46.3899 -23.1565 -23.1565 -23.1027 -23.1027 -22.5310 -22.5310 -22.5152 -22.5152 -22.4735 -22.4735 -22.3267 -22.3267 0.1594 0.1594 0.4929 0.4929 1.1490 1.1490 1.2398 1.2398 5.1308 5.1308 5.3777 5.3777 6.7010 6.7010 7.2364 7.2364 7.6399 7.6399 9.3367 9.3367 9.7992 9.7992 10.1450 10.1450 10.2790 10.2790 10.7306 10.7306 10.9733 10.9733 11.3241 11.3241 11.4395 11.4395 12.0500 12.0500 k =-0.3719 0.4289 0.5418 ( 10514 PWs) bands (ev): -46.4239 -46.4239 -46.3894 -46.3894 -23.1576 -23.1576 -23.1024 -23.1024 -22.5330 -22.5330 -22.5157 -22.5157 -22.4730 -22.4730 -22.3237 -22.3237 0.1813 0.1813 0.5435 0.5435 1.1279 1.1279 1.1951 1.1951 5.0853 5.0853 5.2785 5.2785 6.8178 6.8178 7.2645 7.2645 7.6041 7.6041 9.3928 9.3928 9.7366 9.7366 10.1577 10.1577 10.2668 10.2668 10.7884 10.7884 10.9871 10.9871 11.2996 11.2996 11.4355 11.4355 12.0840 12.0841 k =-0.3857 0.4240 0.5510 ( 10522 PWs) bands (ev): -46.4243 -46.4243 -46.3890 -46.3890 -23.1586 -23.1586 -23.1021 -23.1021 -22.5349 -22.5349 -22.5162 -22.5162 -22.4725 -22.4725 -22.3209 -22.3209 0.1994 0.1994 0.5940 0.5940 1.1085 1.1085 1.1548 1.1548 5.0447 5.0447 5.1841 5.1841 6.9354 6.9354 7.2891 7.2891 7.5699 7.5699 9.4461 9.4461 9.6668 9.6668 10.1695 10.1695 10.2542 10.2542 10.8495 10.8495 11.0030 11.0030 11.2739 11.2739 11.4328 11.4328 12.1180 12.1180 k =-0.3995 0.4192 0.5602 ( 10518 PWs) bands (ev): -46.4247 -46.4247 -46.3887 -46.3887 -23.1596 -23.1596 -23.1018 -23.1018 -22.5367 -22.5367 -22.5167 -22.5167 -22.4721 -22.4721 -22.3183 -22.3183 0.2129 0.2129 0.6441 0.6441 1.0908 1.0908 1.1203 1.1203 5.0094 5.0094 5.0948 5.0948 7.0511 7.0511 7.3121 7.3121 7.5379 7.5379 9.4951 9.4951 9.5922 9.5922 10.1795 10.1795 10.2415 10.2415 10.9129 10.9129 11.0208 11.0208 11.2477 11.2477 11.4306 11.4306 12.1517 12.1517 k =-0.4132 0.4144 0.5693 ( 10516 PWs) bands (ev): -46.4250 -46.4250 -46.3883 -46.3883 -23.1606 -23.1606 -23.1016 -23.1016 -22.5383 -22.5383 -22.5171 -22.5171 -22.4717 -22.4717 -22.3159 -22.3159 0.2206 0.2206 0.6934 0.6934 1.0742 1.0742 1.0931 1.0931 4.9791 4.9791 5.0117 5.0117 7.1582 7.1582 7.3383 7.3383 7.5099 7.5099 9.5066 9.5066 9.5464 9.5464 10.1871 10.1871 10.2289 10.2289 10.9767 10.9767 11.0403 11.0403 11.2222 11.2222 11.4282 11.4282 12.1853 12.1853 k =-0.4270 0.4095 0.5785 ( 10498 PWs) bands (ev): -46.4253 -46.4253 -46.3880 -46.3880 -23.1615 -23.1615 -23.1013 -23.1013 -22.5399 -22.5399 -22.5174 -22.5174 -22.4713 -22.4713 -22.3136 -22.3136 0.2216 0.2216 0.7416 0.7416 1.0589 1.0589 1.0742 1.0742 4.9308 4.9308 4.9585 4.9585 7.2376 7.2376 7.3786 7.3786 7.4937 7.4937 9.4277 9.4277 9.5831 9.5831 10.1920 10.1920 10.2166 10.2166 11.0364 11.0364 11.0611 11.0611 11.2009 11.2009 11.4250 11.4250 12.2193 12.2193 k =-0.4408 0.4047 0.5877 ( 10488 PWs) bands (ev): -46.4256 -46.4256 -46.3877 -46.3877 -23.1623 -23.1623 -23.1011 -23.1011 -22.5412 -22.5412 -22.5178 -22.5178 -22.4710 -22.4710 -22.3115 -22.3115 0.2153 0.2153 0.7882 0.7882 1.0470 1.0470 1.0621 1.0621 4.8604 4.8604 4.9399 4.9399 7.2721 7.2721 7.4126 7.4126 7.5269 7.5269 9.3442 9.3442 9.6167 9.6167 10.1944 10.1944 10.2048 10.2048 11.0803 11.0803 11.0808 11.0808 11.1961 11.1961 11.4205 11.4205 12.2540 12.2541 k =-0.4408 0.4047 0.5877 ( 10488 PWs) bands (ev): -46.4256 -46.4256 -46.3877 -46.3877 -23.1623 -23.1623 -23.1011 -23.1011 -22.5412 -22.5412 -22.5178 -22.5178 -22.4710 -22.4710 -22.3115 -22.3115 0.2153 0.2153 0.7882 0.7882 1.0470 1.0470 1.0621 1.0621 4.8604 4.8604 4.9399 4.9399 7.2721 7.2721 7.4126 7.4126 7.5269 7.5269 9.3442 9.3442 9.6167 9.6167 10.1944 10.1944 10.2048 10.2048 11.0803 11.0803 11.0808 11.0808 11.1961 11.1961 11.4205 11.4205 12.2540 12.2541 k =-0.4492 0.3910 0.5877 ( 10480 PWs) bands (ev): -46.4260 -46.4260 -46.3874 -46.3874 -23.1633 -23.1633 -23.1008 -23.1008 -22.5430 -22.5430 -22.5182 -22.5182 -22.4706 -22.4706 -22.3089 -22.3089 0.2019 0.2019 0.8497 0.8497 1.0347 1.0347 1.0498 1.0498 4.7692 4.7692 4.9205 4.9205 7.2917 7.2917 7.4261 7.4261 7.6341 7.6341 9.2246 9.2246 9.6576 9.6576 10.1896 10.1896 10.1957 10.1957 11.1108 11.1108 11.1133 11.1133 11.2116 11.2116 11.4138 11.4138 12.3040 12.3042 k =-0.4577 0.3773 0.5877 ( 10488 PWs) bands (ev): -46.4263 -46.4263 -46.3870 -46.3870 -23.1642 -23.1642 -23.1006 -23.1006 -22.5444 -22.5444 -22.5185 -22.5185 -22.4702 -22.4702 -22.3066 -22.3066 0.1906 0.1906 0.9042 0.9042 1.0242 1.0242 1.0394 1.0394 4.6895 4.6895 4.9042 4.9042 7.3070 7.3070 7.4376 7.4376 7.7430 7.7430 9.1059 9.1059 9.6930 9.6930 10.1769 10.1769 10.1967 10.1967 11.1381 11.1381 11.1431 11.1431 11.2253 11.2253 11.4084 11.4084 12.3547 12.3551 k =-0.4662 0.3636 0.5877 ( 10496 PWs) bands (ev): -46.4266 -46.4266 -46.3868 -46.3868 -23.1649 -23.1649 -23.1004 -23.1004 -22.5456 -22.5456 -22.5188 -22.5188 -22.4699 -22.4699 -22.3048 -22.3048 0.1813 0.1813 0.9507 0.9507 1.0156 1.0156 1.0309 1.0309 4.6223 4.6223 4.8909 4.8909 7.3190 7.3190 7.4471 7.4471 7.8511 7.8511 8.9900 8.9900 9.7224 9.7224 10.1666 10.1666 10.1975 10.1975 11.1619 11.1619 11.1689 11.1689 11.2367 11.2367 11.4043 11.4043 12.4060 12.4064 k =-0.4746 0.3499 0.5877 ( 10488 PWs) bands (ev): -46.4268 -46.4268 -46.3866 -46.3866 -23.1655 -23.1655 -23.1003 -23.1003 -22.5466 -22.5466 -22.5191 -22.5191 -22.4697 -22.4697 -22.3033 -22.3033 0.1740 0.1740 0.9882 0.9882 1.0090 1.0090 1.0243 1.0243 4.5687 4.5687 4.8805 4.8805 7.3281 7.3281 7.4544 7.4544 7.9549 7.9549 8.8799 8.8799 9.7455 9.7455 10.1587 10.1587 10.1981 10.1981 11.1814 11.1814 11.1899 11.1899 11.2458 11.2458 11.4012 11.4012 12.4570 12.4584 k =-0.4831 0.3362 0.5877 ( 10496 PWs) bands (ev): -46.4269 -46.4269 -46.3864 -46.3864 -23.1659 -23.1659 -23.1002 -23.1002 -22.5472 -22.5472 -22.5192 -22.5192 -22.4696 -22.4696 -22.3023 -22.3023 0.1688 0.1688 1.0042 1.0042 1.0156 1.0156 1.0196 1.0196 4.5297 4.5297 4.8731 4.8731 7.3345 7.3345 7.4597 7.4597 8.0486 8.0486 8.7818 8.7818 9.7621 9.7621 10.1531 10.1531 10.1985 10.1985 11.1959 11.1959 11.2054 11.2054 11.2523 11.2523 11.3992 11.3992 12.5052 12.5060 k =-0.4915 0.3226 0.5877 ( 10480 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1662 -23.1662 -23.1001 -23.1001 -22.5476 -22.5476 -22.5193 -22.5193 -22.4695 -22.4695 -22.3017 -22.3017 0.1657 0.1657 1.0013 1.0013 1.0166 1.0166 1.0325 1.0325 4.5060 4.5060 4.8686 4.8686 7.3384 7.3384 7.4629 7.4629 8.1199 8.1199 8.7078 8.7078 9.7722 9.7722 10.1498 10.1498 10.1988 10.1988 11.2049 11.2049 11.2150 11.2150 11.2561 11.2561 11.3980 11.3980 12.5399 12.5437 k =-0.5000 0.3089 0.5877 ( 10484 PWs) bands (ev): -46.4270 -46.4270 -46.3863 -46.3863 -23.1663 -23.1663 -23.1001 -23.1001 -22.5478 -22.5478 -22.5193 -22.5193 -22.4694 -22.4694 -22.3015 -22.3015 0.1647 0.1647 1.0004 1.0004 1.0157 1.0157 1.0381 1.0381 4.4980 4.4980 4.8671 4.8671 7.3396 7.3396 7.4640 7.4640 8.1481 8.1481 8.6787 8.6787 9.7756 9.7756 10.1487 10.1487 10.1988 10.1988 11.2080 11.2080 11.2182 11.2182 11.2574 11.2574 11.3976 11.3976 12.5489 12.5492 k = 0.0000 0.0000 0.5877 ( 10542 PWs) bands (ev): -46.4271 -46.4271 -46.3861 -46.3861 -23.1669 -23.1669 -23.0987 -23.0987 -22.5482 -22.5482 -22.5173 -22.5173 -22.4710 -22.4710 -22.3014 -22.3014 -0.9803 -0.9803 0.3491 0.3491 1.5144 1.5144 2.9589 2.9589 5.8741 5.8741 6.5989 6.5989 6.9459 6.9459 6.9817 6.9817 7.6611 7.6611 8.0554 8.0554 8.1822 8.1822 8.7081 8.7081 9.9565 9.9565 10.0029 10.0029 10.9062 10.9062 11.3279 11.3279 11.6281 11.6281 12.3910 12.3910 k = 0.0093 0.0150 0.5877 ( 10566 PWs) bands (ev): -46.4270 -46.4270 -46.3862 -46.3862 -23.1668 -23.1668 -23.0987 -23.0987 -22.5481 -22.5481 -22.5172 -22.5172 -22.4711 -22.4711 -22.3017 -22.3017 -0.9789 -0.9789 0.3506 0.3506 1.5103 1.5103 2.9549 2.9549 5.8787 5.8787 6.5923 6.5923 6.9307 6.9307 7.0135 7.0135 7.6612 7.6612 8.0558 8.0558 8.1819 8.1819 8.7060 8.7060 9.9379 9.9379 10.0119 10.0119 10.9180 10.9180 11.3252 11.3252 11.6240 11.6240 12.3914 12.3914 k = 0.0185 0.0300 0.5877 ( 10566 PWs) bands (ev): -46.4269 -46.4269 -46.3863 -46.3863 -23.1665 -23.1665 -23.0988 -23.0988 -22.5476 -22.5476 -22.5171 -22.5171 -22.4712 -22.4712 -22.3024 -22.3024 -0.9750 -0.9750 0.3549 0.3549 1.4980 1.4980 2.9431 2.9431 5.8922 5.8922 6.5745 6.5745 6.9202 6.9202 7.0720 7.0720 7.6615 7.6615 8.0571 8.0571 8.1810 8.1810 8.6994 8.6994 9.8969 9.8969 10.0259 10.0259 10.9516 10.9516 11.3174 11.3174 11.6118 11.6118 12.3928 12.3928 k = 0.0278 0.0450 0.5877 ( 10556 PWs) bands (ev): -46.4268 -46.4268 -46.3865 -46.3865 -23.1660 -23.1660 -23.0989 -23.0989 -22.5468 -22.5468 -22.5169 -22.5169 -22.4714 -22.4714 -22.3037 -22.3037 -0.9683 -0.9683 0.3622 0.3622 1.4777 1.4777 2.9234 2.9234 5.9143 5.9143 6.5499 6.5499 6.9230 6.9230 7.1439 7.1439 7.6619 7.6619 8.0593 8.0593 8.1796 8.1796 8.6887 8.6887 9.8431 9.8431 10.0392 10.0392 11.0025 11.0025 11.3047 11.3047 11.5924 11.5924 12.3950 12.3951 k = 0.0370 0.0600 0.5877 ( 10564 PWs) bands (ev): -46.4265 -46.4265 -46.3867 -46.3867 -23.1654 -23.1654 -23.0991 -23.0991 -22.5457 -22.5457 -22.5167 -22.5167 -22.4717 -22.4717 -22.3054 -22.3054 -0.9591 -0.9591 0.3723 0.3723 1.4498 1.4498 2.8964 2.8964 5.9445 5.9445 6.5231 6.5231 6.9377 6.9377 7.2259 7.2259 7.6623 7.6623 8.0624 8.0624 8.1774 8.1774 8.6738 8.6738 9.7804 9.7804 10.0527 10.0527 11.0653 11.0653 11.2879 11.2879 11.5667 11.5667 12.3983 12.3983 k = 0.0463 0.0749 0.5877 ( 10552 PWs) bands (ev): -46.4262 -46.4262 -46.3870 -46.3870 -23.1645 -23.1645 -23.0993 -23.0993 -22.5442 -22.5442 -22.5163 -22.5163 -22.4720 -22.4720 -22.3076 -22.3076 -0.9472 -0.9472 0.3852 0.3852 1.4148 1.4148 2.8622 2.8622 5.9817 5.9817 6.4972 6.4972 6.9627 6.9627 7.3158 7.3158 7.6625 7.6625 8.0664 8.0664 8.1745 8.1745 8.6551 8.6551 9.7121 9.7121 10.0672 10.0672 11.1323 11.1323 11.2699 11.2699 11.5364 11.5364 12.4025 12.4025 k = 0.0556 0.0899 0.5877 ( 10538 PWs) bands (ev): -46.4259 -46.4259 -46.3874 -46.3874 -23.1634 -23.1634 -23.0996 -23.0996 -22.5425 -22.5425 -22.5159 -22.5159 -22.4724 -22.4724 -22.3103 -22.3103 -0.9327 -0.9327 0.4011 0.4011 1.3732 1.3732 2.8215 2.8215 6.0251 6.0251 6.4743 6.4743 6.9972 6.9972 7.4119 7.4119 7.6623 7.6623 8.0715 8.0715 8.1708 8.1708 8.6328 8.6328 9.6411 9.6411 10.0833 10.0833 11.1839 11.1839 11.2651 11.2651 11.5047 11.5047 12.4076 12.4076 k = 0.0648 0.1049 0.5877 ( 10538 PWs) bands (ev): -46.4254 -46.4254 -46.3878 -46.3878 -23.1622 -23.1622 -23.0999 -23.0999 -22.5404 -22.5404 -22.5154 -22.5154 -22.4729 -22.4729 -22.3134 -22.3134 -0.9155 -0.9155 0.4198 0.4198 1.3257 1.3257 2.7747 2.7747 6.0736 6.0736 6.4557 6.4557 7.0408 7.0408 7.5117 7.5117 7.6623 7.6623 8.0777 8.0777 8.1661 8.1661 8.6074 8.6074 9.5696 9.5696 10.1015 10.1015 11.1820 11.1820 11.3013 11.3013 11.4807 11.4807 12.4136 12.4136 k = 0.0741 0.1199 0.5877 ( 10530 PWs) bands (ev): -46.4249 -46.4249 -46.3883 -46.3883 -23.1608 -23.1608 -23.1003 -23.1003 -22.5380 -22.5380 -22.5148 -22.5148 -22.4735 -22.4735 -22.3170 -22.3170 -0.8958 -0.8958 0.4413 0.4413 1.2729 1.2729 2.7224 2.7224 6.1259 6.1259 6.4419 6.4419 7.0933 7.0933 7.6072 7.6072 7.6685 7.6685 8.0854 8.0854 8.1604 8.1604 8.5794 8.5794 9.4994 9.4994 10.1217 10.1217 11.1536 11.1536 11.3248 11.3248 11.4902 11.4902 12.4199 12.4199 k = 0.0833 0.1349 0.5877 ( 10542 PWs) bands (ev): -46.4244 -46.4244 -46.3889 -46.3889 -23.1593 -23.1593 -23.1008 -23.1008 -22.5353 -22.5353 -22.5142 -22.5142 -22.4741 -22.4741 -22.3210 -22.3210 -0.8734 -0.8734 0.4657 0.4657 1.2154 1.2154 2.6652 2.6652 6.1810 6.1810 6.4332 6.4332 7.1546 7.1546 7.6408 7.6408 7.7358 7.7358 8.0955 8.0955 8.1536 8.1536 8.5493 8.5493 9.4321 9.4321 10.1441 10.1441 11.1179 11.1179 11.3030 11.3030 11.5458 11.5458 12.4245 12.4245 k = 0.0926 0.1499 0.5877 ( 10542 PWs) bands (ev): -46.4237 -46.4237 -46.3895 -46.3895 -23.1576 -23.1576 -23.1013 -23.1013 -22.5322 -22.5322 -22.5135 -22.5135 -22.4749 -22.4749 -22.3254 -22.3254 -0.8485 -0.8485 0.4929 0.4929 1.1539 1.1539 2.6036 2.6036 6.2378 6.2378 6.4298 6.4298 7.2247 7.2247 7.6369 7.6369 7.8355 7.8355 8.1100 8.1100 8.1460 8.1460 8.5181 8.5181 9.3689 9.3689 10.1686 10.1686 11.0786 11.0786 11.2588 11.2588 11.6208 11.6208 12.4201 12.4201 k = 0.1019 0.1649 0.5877 ( 10538 PWs) bands (ev): -46.4231 -46.4231 -46.3902 -46.3902 -23.1559 -23.1559 -23.1018 -23.1018 -22.5289 -22.5289 -22.5127 -22.5127 -22.4756 -22.4756 -22.3302 -22.3302 -0.8209 -0.8209 0.5228 0.5228 1.0891 1.0891 2.5384 2.5384 6.2951 6.2951 6.4320 6.4320 7.3030 7.3030 7.6270 7.6270 7.9271 7.9271 8.1341 8.1341 8.1398 8.1398 8.4866 8.4866 9.3108 9.3108 10.1952 10.1952 11.0368 11.0368 11.2054 11.2054 11.7004 11.7004 12.4067 12.4067 k = 0.1111 0.1799 0.5877 ( 10526 PWs) bands (ev): -46.4223 -46.4223 -46.3910 -46.3910 -23.1540 -23.1540 -23.1025 -23.1025 -22.5252 -22.5252 -22.5119 -22.5119 -22.4765 -22.4765 -22.3354 -22.3354 -0.7909 -0.7909 0.5555 0.5555 1.0214 1.0214 2.4699 2.4699 6.3517 6.3517 6.4402 6.4402 7.3886 7.3886 7.6129 7.6129 7.9905 7.9905 8.1325 8.1325 8.1867 8.1867 8.4558 8.4558 9.2588 9.2588 10.2238 10.2238 10.9930 10.9930 11.1470 11.1470 11.7797 11.7797 12.3927 12.3927 k = 0.1204 0.1949 0.5877 ( 10518 PWs) bands (ev): -46.4215 -46.4215 -46.3918 -46.3918 -23.1520 -23.1520 -23.1032 -23.1032 -22.5212 -22.5212 -22.5110 -22.5110 -22.4774 -22.4774 -22.3409 -22.3409 -0.7583 -0.7583 0.5909 0.5909 0.9515 0.9515 2.3988 2.3988 6.4042 6.4042 6.4573 6.4573 7.4795 7.4795 7.5954 7.5954 8.0147 8.0147 8.1321 8.1321 8.2691 8.2691 8.4271 8.4271 9.2135 9.2135 10.2542 10.2542 10.9469 10.9469 11.0855 11.0855 11.8565 11.8565 12.3809 12.3809 k = 0.1296 0.2099 0.5877 ( 10524 PWs) bands (ev): -46.4207 -46.4207 -46.3926 -46.3926 -23.1499 -23.1499 -23.1040 -23.1040 -22.5170 -22.5170 -22.5101 -22.5101 -22.4783 -22.4783 -22.3467 -22.3467 -0.7232 -0.7232 0.6290 0.6290 0.8798 0.8798 2.3255 2.3255 6.4434 6.4434 6.4921 6.4921 7.5541 7.5541 7.5931 7.5931 8.0130 8.0130 8.1384 8.1384 8.3664 8.3664 8.4034 8.4034 9.1755 9.1755 10.2863 10.2863 10.8973 10.8973 11.0231 11.0231 11.9297 11.9297 12.3723 12.3723 k = 0.1389 0.2248 0.5877 ( 10528 PWs) bands (ev): -46.4198 -46.4198 -46.3935 -46.3935 -23.1477 -23.1477 -23.1048 -23.1048 -22.5124 -22.5124 -22.5091 -22.5091 -22.4793 -22.4793 -22.3528 -22.3528 -0.6856 -0.6856 0.6697 0.6697 0.8068 0.8068 2.2506 2.2506 6.4703 6.4703 6.5432 6.5432 7.5376 7.5376 7.6750 7.6750 8.0016 8.0016 8.1507 8.1507 8.3760 8.3760 8.4755 8.4755 9.1449 9.1449 10.3199 10.3199 10.8412 10.8412 10.9635 10.9635 11.9983 11.9983 12.3666 12.3666 k = 0.1481 0.2398 0.5877 ( 10520 PWs) bands (ev): -46.4189 -46.4189 -46.3944 -46.3944 -23.1455 -23.1455 -23.1058 -23.1058 -22.5080 -22.5080 -22.5075 -22.5075 -22.4803 -22.4803 -22.3592 -22.3592 -0.6455 -0.6455 0.7127 0.7127 0.7333 0.7333 2.1744 2.1744 6.4962 6.4962 6.5992 6.5992 7.5058 7.5058 7.7516 7.7516 7.9967 7.9967 8.1698 8.1698 8.3579 8.3579 8.5784 8.5784 9.1218 9.1218 10.3547 10.3547 10.7748 10.7748 10.9110 10.9110 12.0616 12.0616 12.3595 12.3595 k = 0.1574 0.2548 0.5877 ( 10516 PWs) bands (ev): -46.4179 -46.4179 -46.3954 -46.3954 -23.1433 -23.1433 -23.1068 -23.1068 -22.5069 -22.5069 -22.5024 -22.5024 -22.4814 -22.4814 -22.3658 -22.3658 -0.6030 -0.6030 0.6584 0.6584 0.7592 0.7592 2.0975 2.0975 6.5244 6.5244 6.6566 6.6566 7.4688 7.4688 7.7875 7.7875 8.0194 8.0194 8.1998 8.1998 8.3448 8.3448 8.6775 8.6775 9.1060 9.1060 10.3903 10.3903 10.6965 10.6965 10.8680 10.8680 12.1190 12.1190 12.3397 12.3397 k = 0.1667 0.2698 0.5877 ( 10528 PWs) bands (ev): -46.4169 -46.4169 -46.3964 -46.3964 -23.1410 -23.1410 -23.1079 -23.1079 -22.5058 -22.5058 -22.4970 -22.4970 -22.4825 -22.4825 -22.3726 -22.3726 -0.5581 -0.5581 0.5838 0.5838 0.8077 0.8077 2.0200 2.0200 6.5556 6.5556 6.7147 6.7147 7.4275 7.4275 7.7764 7.7764 8.0640 8.0640 8.2445 8.2445 8.3448 8.3448 8.7701 8.7701 9.0969 9.0969 10.4261 10.4261 10.6078 10.6078 10.8337 10.8337 12.1698 12.1698 12.3145 12.3145 k = 0.1759 0.2848 0.5877 ( 10526 PWs) bands (ev): -46.4158 -46.4158 -46.3975 -46.3975 -23.1388 -23.1388 -23.1091 -23.1091 -22.5046 -22.5046 -22.4914 -22.4914 -22.4836 -22.4836 -22.3796 -22.3796 -0.5109 -0.5109 0.5094 0.5094 0.8586 0.8586 1.9425 1.9425 6.5899 6.5899 6.7733 6.7733 7.3825 7.3825 7.7397 7.7397 8.1019 8.1019 8.2763 8.2763 8.3924 8.3924 8.8542 8.8542 9.0941 9.0941 10.4573 10.4573 10.5147 10.5147 10.8067 10.8067 12.2134 12.2134 12.2901 12.2902 k = 0.1852 0.2998 0.5877 ( 10520 PWs) bands (ev): -46.4148 -46.4148 -46.3986 -46.3986 -23.1365 -23.1365 -23.1104 -23.1104 -22.5034 -22.5034 -22.4865 -22.4865 -22.4839 -22.4839 -22.3867 -22.3867 -0.4614 -0.4614 0.4354 0.4354 0.9120 0.9120 1.8650 1.8650 6.6273 6.6273 6.8322 6.8322 7.3347 7.3347 7.6916 7.6916 8.1275 8.1275 8.2778 8.2778 8.4957 8.4957 8.9282 8.9282 9.0966 9.0966 10.3965 10.3965 10.5056 10.5056 10.7859 10.7859 12.2490 12.2490 12.2692 12.2692 k = 0.1944 0.3148 0.5877 ( 10518 PWs) bands (ev): -46.4137 -46.4137 -46.3997 -46.3997 -23.1343 -23.1343 -23.1117 -23.1117 -22.5021 -22.5021 -22.4865 -22.4865 -22.4789 -22.4789 -22.3939 -22.3939 -0.4096 -0.4096 0.3619 0.3619 0.9677 0.9677 1.7881 1.7881 6.6674 6.6674 6.8915 6.8915 7.2847 7.2847 7.6373 7.6373 8.1460 8.1460 8.2713 8.2713 8.6214 8.6214 8.9909 8.9909 9.1037 9.1037 10.2849 10.2849 10.5396 10.5396 10.7704 10.7704 12.2515 12.2515 12.2776 12.2776 k = 0.2037 0.3298 0.5877 ( 10528 PWs) bands (ev): -46.4125 -46.4125 -46.4008 -46.4008 -23.1320 -23.1320 -23.1132 -23.1132 -22.5009 -22.5009 -22.4877 -22.4877 -22.4726 -22.4726 -22.4012 -22.4012 -0.3556 -0.3556 0.2894 0.2894 1.0258 1.0258 1.7118 1.7118 6.7101 6.7101 6.9507 6.9507 7.2335 7.2335 7.5795 7.5795 8.1609 8.1609 8.2631 8.2631 8.7561 8.7561 9.0418 9.0418 9.1147 9.1147 10.1653 10.1653 10.5738 10.5738 10.7589 10.7589 12.2406 12.2406 12.2963 12.2963 k = 0.2130 0.3448 0.5877 ( 10536 PWs) bands (ev): -46.4114 -46.4114 -46.4019 -46.4019 -23.1299 -23.1299 -23.1147 -23.1147 -22.4996 -22.4996 -22.4890 -22.4890 -22.4660 -22.4660 -22.4086 -22.4086 -0.2994 -0.2994 0.2178 0.2178 1.0861 1.0861 1.6364 1.6364 6.7553 6.7553 7.0088 7.0088 7.1829 7.1829 7.5194 7.5194 8.1739 8.1739 8.2544 8.2544 8.8933 8.8933 9.0815 9.0815 9.1293 9.1293 10.0397 10.0397 10.6064 10.6064 10.7500 10.7500 12.2360 12.2360 12.3062 12.3062 k = 0.2222 0.3598 0.5877 ( 10528 PWs) bands (ev): -46.4102 -46.4102 -46.4031 -46.4031 -23.1277 -23.1277 -23.1163 -23.1163 -22.4983 -22.4983 -22.4903 -22.4903 -22.4593 -22.4593 -22.4160 -22.4160 -0.2411 -0.2411 0.1475 0.1475 1.1485 1.1485 1.5621 1.5621 6.8025 6.8025 7.0576 7.0576 7.1414 7.1414 7.4580 7.4580 8.1858 8.1858 8.2454 8.2454 9.0225 9.0225 9.1122 9.1122 9.1527 9.1527 9.9089 9.9089 10.6365 10.6365 10.7418 10.7418 12.2381 12.2381 12.3076 12.3076 k = 0.2315 0.3747 0.5877 ( 10548 PWs) bands (ev): -46.4090 -46.4090 -46.4043 -46.4043 -23.1256 -23.1256 -23.1180 -23.1180 -22.4969 -22.4969 -22.4916 -22.4916 -22.4523 -22.4523 -22.4234 -22.4234 -0.1809 -0.1809 0.0786 0.0786 1.2129 1.2129 1.4891 1.4891 6.8516 6.8516 7.0512 7.0512 7.1555 7.1555 7.3957 7.3957 8.1968 8.1968 8.2363 8.2363 9.1014 9.1014 9.1325 9.1325 9.2266 9.2266 9.7739 9.7739 10.6635 10.6635 10.7326 10.7326 12.2464 12.2464 12.3015 12.3015 k = 0.2407 0.3897 0.5877 ( 10552 PWs) bands (ev): -46.4079 -46.4079 -46.4055 -46.4055 -23.1236 -23.1236 -23.1198 -23.1198 -22.4956 -22.4956 -22.4929 -22.4929 -22.4452 -22.4452 -22.4308 -22.4308 -0.1187 -0.1187 0.0112 0.0112 1.2793 1.2793 1.4175 1.4175 6.9022 6.9022 7.0049 7.0049 7.2104 7.2104 7.3332 7.3332 8.2073 8.2073 8.2269 8.2269 9.1268 9.1268 9.1394 9.1394 9.3556 9.3556 9.6356 9.6356 10.6867 10.6867 10.7210 10.7210 12.2593 12.2593 12.2897 12.2897 k = 0.2500 0.4047 0.5877 ( 10552 PWs) bands (ev): -46.4067 -46.4067 -46.4067 -46.4067 -23.1217 -23.1217 -23.1217 -23.1217 -22.4943 -22.4943 -22.4943 -22.4943 -22.4380 -22.4380 -22.4380 -22.4380 -0.0546 -0.0546 -0.0546 -0.0546 1.3476 1.3476 1.3476 1.3476 6.9537 6.9537 6.9537 6.9537 7.2711 7.2711 7.2711 7.2711 8.2173 8.2173 8.2173 8.2173 9.1372 9.1372 9.1372 9.1372 9.4953 9.4953 9.4953 9.4953 10.7059 10.7059 10.7059 10.7059 12.2747 12.2747 12.2747 12.2747 Writing output data file TiSb2.save init_run : 0.20s CPU 0.32s WALL ( 1 calls) electrons : 530.00s CPU 535.95s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 529.99s CPU 535.94s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.07s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.19s WALL ( 303 calls) cegterg : 507.24s CPU 511.51s WALL ( 932 calls) Called by sum_band: Called by *egterg: h_psi : 309.68s CPU 312.65s WALL ( 16905 calls) s_psi : 17.90s CPU 18.29s WALL ( 16905 calls) g_psi : 1.16s CPU 1.12s WALL ( 15670 calls) cdiaghg : 118.86s CPU 120.25s WALL ( 15973 calls) cegterg:over : 26.18s CPU 25.98s WALL ( 15670 calls) cegterg:upda : 27.74s CPU 27.78s WALL ( 15670 calls) cegterg:last : 11.54s CPU 11.55s WALL ( 2180 calls) cdiaghg:chol : 6.94s CPU 6.99s WALL ( 15973 calls) cdiaghg:inve : 4.56s CPU 4.62s WALL ( 15973 calls) cdiaghg:para : 6.96s CPU 7.16s WALL ( 31946 calls) Called by h_psi: h_psi:vloc : 261.81s CPU 264.34s WALL ( 16905 calls) h_psi:vnl : 46.92s CPU 47.20s WALL ( 16905 calls) add_vuspsi : 24.47s CPU 24.80s WALL ( 16905 calls) General routines calbec : 22.41s CPU 22.35s WALL ( 16905 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 248.48s CPU 250.84s WALL ( 1401220 calls) davcio : 0.27s CPU 0.45s WALL ( 606 calls) Parallel routines fft_scatter : 81.81s CPU 82.17s WALL ( 1401235 calls) PWSCF : 9m16.16s CPU 9m46.74s WALL This run was terminated on: 21:24: 1 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=