Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17: 8:20 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: ./C.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 14 7 2 216 73 14 Max 15 8 3 220 81 17 Sum 511 253 85 7799 2733 537 bravais-lattice index = 14 lattice parameter (alat) = 4.8015 a.u. unit-cell volume = 78.2739 (a.u.)^3 number of atoms/cell = 1 number of atomic types = 1 number of electrons = 4.00 number of Kohn-Sham states= 12 kinetic-energy cutoff = 41.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 4.801504 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential C 4.00 12.01070 C( 1.00) 12 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 1 -1 0 ) ( 1 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) ( 0 1 0 ) ( 0 1 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 8) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) ( 1 0 0 ) ( 1 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 1 0 ) ( 0 1 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 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 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 574 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017422 k( 2) = ( 0.0056818 -0.0032804 0.0046392), wk = 0.0017422 k( 3) = ( 0.0113636 -0.0065608 0.0092784), wk = 0.0017422 k( 4) = ( 0.0170455 -0.0098412 0.0139176), wk = 0.0017422 k( 5) = ( 0.0227273 -0.0131216 0.0185567), wk = 0.0017422 k( 6) = ( 0.0284091 -0.0164020 0.0231959), wk = 0.0017422 k( 7) = ( 0.0340909 -0.0196824 0.0278351), wk = 0.0017422 k( 8) = ( 0.0397727 -0.0229628 0.0324743), wk = 0.0017422 k( 9) = ( 0.0454546 -0.0262432 0.0371135), wk = 0.0017422 k( 10) = ( 0.0511364 -0.0295236 0.0417527), wk = 0.0017422 k( 11) = ( 0.0568182 -0.0328040 0.0463918), wk = 0.0017422 k( 12) = ( 0.0625000 -0.0360844 0.0510310), wk = 0.0017422 k( 13) = ( 0.0681818 -0.0393648 0.0556702), wk = 0.0017422 k( 14) = ( 0.0738636 -0.0426452 0.0603094), wk = 0.0017422 k( 15) = ( 0.0795455 -0.0459256 0.0649486), wk = 0.0017422 k( 16) = ( 0.0852273 -0.0492060 0.0695878), wk = 0.0017422 k( 17) = ( 0.0909091 -0.0524864 0.0742270), wk = 0.0017422 k( 18) = ( 0.0965909 -0.0557668 0.0788661), wk = 0.0017422 k( 19) = ( 0.1022727 -0.0590472 0.0835053), wk = 0.0017422 k( 20) = ( 0.1079545 -0.0623276 0.0881445), wk = 0.0017422 k( 21) = ( 0.1136364 -0.0656080 0.0927837), wk = 0.0017422 k( 22) = ( 0.1193182 -0.0688884 0.0974229), wk = 0.0017422 k( 23) = ( 0.1250000 -0.0721688 0.1020621), wk = 0.0017422 k( 24) = ( 0.1306818 -0.0754492 0.1067013), wk = 0.0017422 k( 25) = ( 0.1363636 -0.0787296 0.1113404), wk = 0.0017422 k( 26) = ( 0.1420454 -0.0820100 0.1159796), wk = 0.0017422 k( 27) = ( 0.1477273 -0.0852904 0.1206188), wk = 0.0017422 k( 28) = ( 0.1534091 -0.0885708 0.1252580), wk = 0.0017422 k( 29) = ( 0.1590909 -0.0918512 0.1298972), wk = 0.0017422 k( 30) = ( 0.1647727 -0.0951316 0.1345364), wk = 0.0017422 k( 31) = ( 0.1704546 -0.0984120 0.1391756), wk = 0.0017422 k( 32) = ( 0.1761364 -0.1016924 0.1438147), wk = 0.0017422 k( 33) = ( 0.1818182 -0.1049728 0.1484539), wk = 0.0017422 k( 34) = ( 0.1875000 -0.1082532 0.1530931), wk = 0.0017422 k( 35) = ( 0.1931818 -0.1115336 0.1577323), wk = 0.0017422 k( 36) = ( 0.1988636 -0.1148140 0.1623715), wk = 0.0017422 k( 37) = ( 0.2045454 -0.1180944 0.1670107), wk = 0.0017422 k( 38) = ( 0.2102273 -0.1213748 0.1716498), wk = 0.0017422 k( 39) = ( 0.2159091 -0.1246552 0.1762890), wk = 0.0017422 k( 40) = ( 0.2215909 -0.1279356 0.1809282), wk = 0.0017422 k( 41) = ( 0.2272727 -0.1312160 0.1855674), wk = 0.0017422 k( 42) = ( 0.2329546 -0.1344964 0.1902066), wk = 0.0017422 k( 43) = ( 0.2386364 -0.1377768 0.1948458), wk = 0.0017422 k( 44) = ( 0.2443182 -0.1410572 0.1994850), wk = 0.0017422 k( 45) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0017422 k( 46) = ( 0.2556818 -0.1476180 0.2087633), wk = 0.0017422 k( 47) = ( 0.2613636 -0.1508984 0.2134025), wk = 0.0017422 k( 48) = ( 0.2670455 -0.1541788 0.2180417), wk = 0.0017422 k( 49) = ( 0.2727273 -0.1574592 0.2226809), wk = 0.0017422 k( 50) = ( 0.2784091 -0.1607396 0.2273201), wk = 0.0017422 k( 51) = ( 0.2840909 -0.1640200 0.2319593), wk = 0.0017422 k( 52) = ( 0.2897727 -0.1673004 0.2365984), wk = 0.0017422 k( 53) = ( 0.2954545 -0.1705808 0.2412376), wk = 0.0017422 k( 54) = ( 0.3011364 -0.1738612 0.2458768), wk = 0.0017422 k( 55) = ( 0.3068182 -0.1771416 0.2505160), wk = 0.0017422 k( 56) = ( 0.3125000 -0.1804220 0.2551552), wk = 0.0017422 k( 57) = ( 0.3181818 -0.1837024 0.2597944), wk = 0.0017422 k( 58) = ( 0.3238636 -0.1869828 0.2644336), wk = 0.0017422 k( 59) = ( 0.3295455 -0.1902632 0.2690727), wk = 0.0017422 k( 60) = ( 0.3352273 -0.1935436 0.2737119), wk = 0.0017422 k( 61) = ( 0.3409091 -0.1968240 0.2783511), wk = 0.0017422 k( 62) = ( 0.3465909 -0.2001044 0.2829903), wk = 0.0017422 k( 63) = ( 0.3522727 -0.2033848 0.2876295), wk = 0.0017422 k( 64) = ( 0.3579545 -0.2066652 0.2922687), wk = 0.0017422 k( 65) = ( 0.3636364 -0.2099456 0.2969078), wk = 0.0017422 k( 66) = ( 0.3693182 -0.2132260 0.3015470), wk = 0.0017422 k( 67) = ( 0.3750000 -0.2165064 0.3061862), wk = 0.0017422 k( 68) = ( 0.3806818 -0.2197868 0.3108254), wk = 0.0017422 k( 69) = ( 0.3863636 -0.2230672 0.3154646), wk = 0.0017422 k( 70) = ( 0.3920455 -0.2263475 0.3201038), wk = 0.0017422 k( 71) = ( 0.3977273 -0.2296279 0.3247430), wk = 0.0017422 k( 72) = ( 0.4034091 -0.2329083 0.3293821), wk = 0.0017422 k( 73) = ( 0.4090909 -0.2361887 0.3340213), wk = 0.0017422 k( 74) = ( 0.4147727 -0.2394691 0.3386605), wk = 0.0017422 k( 75) = ( 0.4204545 -0.2427495 0.3432997), wk = 0.0017422 k( 76) = ( 0.4261364 -0.2460299 0.3479389), wk = 0.0017422 k( 77) = ( 0.4318182 -0.2493103 0.3525781), wk = 0.0017422 k( 78) = ( 0.4375000 -0.2525907 0.3572173), wk = 0.0017422 k( 79) = ( 0.4431818 -0.2558711 0.3618564), wk = 0.0017422 k( 80) = ( 0.4488636 -0.2591515 0.3664956), wk = 0.0017422 k( 81) = ( 0.4545455 -0.2624319 0.3711348), wk = 0.0017422 k( 82) = ( 0.4602273 -0.2657123 0.3757740), wk = 0.0017422 k( 83) = ( 0.4659091 -0.2689927 0.3804132), wk = 0.0017422 k( 84) = ( 0.4715909 -0.2722731 0.3850524), wk = 0.0017422 k( 85) = ( 0.4772727 -0.2755535 0.3896916), wk = 0.0017422 k( 86) = ( 0.4829545 -0.2788339 0.3943307), wk = 0.0017422 k( 87) = ( 0.4886364 -0.2821143 0.3989699), wk = 0.0017422 k( 88) = ( 0.4943182 -0.2853947 0.4036091), wk = 0.0017422 k( 89) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0017422 k( 90) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0017422 k( 91) = ( 0.5000000 -0.2821143 0.4128875), wk = 0.0017422 k( 92) = ( 0.5000000 -0.2755535 0.4175267), wk = 0.0017422 k( 93) = ( 0.5000000 -0.2689927 0.4221658), wk = 0.0017422 k( 94) = ( 0.5000000 -0.2624319 0.4268050), wk = 0.0017422 k( 95) = ( 0.5000000 -0.2558711 0.4314442), wk = 0.0017422 k( 96) = ( 0.5000000 -0.2493103 0.4360834), wk = 0.0017422 k( 97) = ( 0.5000000 -0.2427495 0.4407226), wk = 0.0017422 k( 98) = ( 0.5000000 -0.2361887 0.4453618), wk = 0.0017422 k( 99) = ( 0.5000000 -0.2296280 0.4500010), wk = 0.0017422 k( 100) = ( 0.5000000 -0.2230672 0.4546401), wk = 0.0017422 k( 101) = ( 0.5000000 -0.2165064 0.4592793), wk = 0.0017422 k( 102) = ( 0.5000000 -0.2099456 0.4639185), wk = 0.0017422 k( 103) = ( 0.5000000 -0.2033847 0.4685577), wk = 0.0017422 k( 104) = ( 0.5000000 -0.1968240 0.4731969), wk = 0.0017422 k( 105) = ( 0.5000000 -0.1902632 0.4778361), wk = 0.0017422 k( 106) = ( 0.5000000 -0.1837024 0.4824753), wk = 0.0017422 k( 107) = ( 0.5000000 -0.1771416 0.4871144), wk = 0.0017422 k( 108) = ( 0.5000000 -0.1705808 0.4917536), wk = 0.0017422 k( 109) = ( 0.5000000 -0.1640200 0.4963928), wk = 0.0017422 k( 110) = ( 0.5000000 -0.1574592 0.5010320), wk = 0.0017422 k( 111) = ( 0.5000000 -0.1508984 0.5056712), wk = 0.0017422 k( 112) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0017422 k( 113) = ( 0.5000000 -0.1377768 0.5149495), wk = 0.0017422 k( 114) = ( 0.5000000 -0.1312160 0.5195887), wk = 0.0017422 k( 115) = ( 0.5000000 -0.1246552 0.5242279), wk = 0.0017422 k( 116) = ( 0.5000000 -0.1180944 0.5288671), wk = 0.0017422 k( 117) = ( 0.5000000 -0.1115336 0.5335063), wk = 0.0017422 k( 118) = ( 0.5000000 -0.1049728 0.5381455), wk = 0.0017422 k( 119) = ( 0.5000000 -0.0984120 0.5427847), wk = 0.0017422 k( 120) = ( 0.5000000 -0.0918512 0.5474238), wk = 0.0017422 k( 121) = ( 0.5000000 -0.0852904 0.5520630), wk = 0.0017422 k( 122) = ( 0.5000000 -0.0787296 0.5567022), wk = 0.0017422 k( 123) = ( 0.5000000 -0.0721688 0.5613414), wk = 0.0017422 k( 124) = ( 0.5000000 -0.0656080 0.5659806), wk = 0.0017422 k( 125) = ( 0.5000000 -0.0590472 0.5706198), wk = 0.0017422 k( 126) = ( 0.5000000 -0.0524864 0.5752590), wk = 0.0017422 k( 127) = ( 0.5000000 -0.0459256 0.5798981), wk = 0.0017422 k( 128) = ( 0.5000000 -0.0393648 0.5845373), wk = 0.0017422 k( 129) = ( 0.5000000 -0.0328040 0.5891765), wk = 0.0017422 k( 130) = ( 0.5000000 -0.0262432 0.5938157), wk = 0.0017422 k( 131) = ( 0.5000000 -0.0196824 0.5984549), wk = 0.0017422 k( 132) = ( 0.5000000 -0.0131216 0.6030941), wk = 0.0017422 k( 133) = ( 0.5000000 -0.0065608 0.6077332), wk = 0.0017422 k( 134) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0017422 k( 135) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0017422 k( 136) = ( 0.4959677 0.0069841 0.6123724), wk = 0.0017422 k( 137) = ( 0.4919355 0.0139682 0.6123724), wk = 0.0017422 k( 138) = ( 0.4879032 0.0209522 0.6123724), wk = 0.0017422 k( 139) = ( 0.4838710 0.0279363 0.6123724), wk = 0.0017422 k( 140) = ( 0.4798387 0.0349204 0.6123724), wk = 0.0017422 k( 141) = ( 0.4758064 0.0419045 0.6123724), wk = 0.0017422 k( 142) = ( 0.4717742 0.0488885 0.6123724), wk = 0.0017422 k( 143) = ( 0.4677419 0.0558726 0.6123724), wk = 0.0017422 k( 144) = ( 0.4637097 0.0628567 0.6123724), wk = 0.0017422 k( 145) = ( 0.4596774 0.0698408 0.6123724), wk = 0.0017422 k( 146) = ( 0.4556452 0.0768248 0.6123724), wk = 0.0017422 k( 147) = ( 0.4516129 0.0838089 0.6123724), wk = 0.0017422 k( 148) = ( 0.4475807 0.0907930 0.6123724), wk = 0.0017422 k( 149) = ( 0.4435484 0.0977771 0.6123724), wk = 0.0017422 k( 150) = ( 0.4395161 0.1047611 0.6123724), wk = 0.0017422 k( 151) = ( 0.4354839 0.1117452 0.6123724), wk = 0.0017422 k( 152) = ( 0.4314516 0.1187293 0.6123724), wk = 0.0017422 k( 153) = ( 0.4274193 0.1257134 0.6123724), wk = 0.0017422 k( 154) = ( 0.4233871 0.1326974 0.6123724), wk = 0.0017422 k( 155) = ( 0.4193548 0.1396815 0.6123724), wk = 0.0017422 k( 156) = ( 0.4153226 0.1466656 0.6123724), wk = 0.0017422 k( 157) = ( 0.4112903 0.1536497 0.6123724), wk = 0.0017422 k( 158) = ( 0.4072581 0.1606338 0.6123724), wk = 0.0017422 k( 159) = ( 0.4032258 0.1676178 0.6123724), wk = 0.0017422 k( 160) = ( 0.3991936 0.1746019 0.6123724), wk = 0.0017422 k( 161) = ( 0.3951613 0.1815860 0.6123724), wk = 0.0017422 k( 162) = ( 0.3911290 0.1885701 0.6123724), wk = 0.0017422 k( 163) = ( 0.3870968 0.1955541 0.6123724), wk = 0.0017422 k( 164) = ( 0.3830645 0.2025382 0.6123724), wk = 0.0017422 k( 165) = ( 0.3790323 0.2095223 0.6123724), wk = 0.0017422 k( 166) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0017422 k( 167) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0017422 k( 168) = ( 0.3709677 0.2141783 0.6057878), wk = 0.0017422 k( 169) = ( 0.3669355 0.2118503 0.5992031), wk = 0.0017422 k( 170) = ( 0.3629032 0.2095223 0.5926185), wk = 0.0017422 k( 171) = ( 0.3588710 0.2071943 0.5860338), wk = 0.0017422 k( 172) = ( 0.3548387 0.2048662 0.5794492), wk = 0.0017422 k( 173) = ( 0.3508064 0.2025382 0.5728645), wk = 0.0017422 k( 174) = ( 0.3467742 0.2002102 0.5662799), wk = 0.0017422 k( 175) = ( 0.3427419 0.1978822 0.5596952), wk = 0.0017422 k( 176) = ( 0.3387097 0.1955541 0.5531106), wk = 0.0017422 k( 177) = ( 0.3346774 0.1932261 0.5465259), wk = 0.0017422 k( 178) = ( 0.3306452 0.1908981 0.5399413), wk = 0.0017422 k( 179) = ( 0.3266129 0.1885700 0.5333566), wk = 0.0017422 k( 180) = ( 0.3225807 0.1862420 0.5267720), wk = 0.0017422 k( 181) = ( 0.3185484 0.1839140 0.5201873), wk = 0.0017422 k( 182) = ( 0.3145161 0.1815860 0.5136027), wk = 0.0017422 k( 183) = ( 0.3104839 0.1792579 0.5070180), wk = 0.0017422 k( 184) = ( 0.3064516 0.1769299 0.5004334), wk = 0.0017422 k( 185) = ( 0.3024193 0.1746019 0.4938487), wk = 0.0017422 k( 186) = ( 0.2983871 0.1722739 0.4872641), wk = 0.0017422 k( 187) = ( 0.2943548 0.1699458 0.4806794), wk = 0.0017422 k( 188) = ( 0.2903226 0.1676178 0.4740948), wk = 0.0017422 k( 189) = ( 0.2862903 0.1652898 0.4675101), wk = 0.0017422 k( 190) = ( 0.2822581 0.1629618 0.4609255), wk = 0.0017422 k( 191) = ( 0.2782258 0.1606337 0.4543408), wk = 0.0017422 k( 192) = ( 0.2741936 0.1583057 0.4477562), wk = 0.0017422 k( 193) = ( 0.2701613 0.1559777 0.4411715), wk = 0.0017422 k( 194) = ( 0.2661290 0.1536497 0.4345869), wk = 0.0017422 k( 195) = ( 0.2620968 0.1513216 0.4280022), wk = 0.0017422 k( 196) = ( 0.2580645 0.1489936 0.4214176), wk = 0.0017422 k( 197) = ( 0.2540323 0.1466656 0.4148329), wk = 0.0017422 k( 198) = ( 0.2500000 0.1443376 0.4082483), wk = 0.0017422 k( 199) = ( 0.2459677 0.1420095 0.4016636), wk = 0.0017422 k( 200) = ( 0.2419355 0.1396815 0.3950790), wk = 0.0017422 k( 201) = ( 0.2379032 0.1373535 0.3884943), wk = 0.0017422 k( 202) = ( 0.2338710 0.1350255 0.3819097), wk = 0.0017422 k( 203) = ( 0.2298387 0.1326974 0.3753250), wk = 0.0017422 k( 204) = ( 0.2258064 0.1303694 0.3687404), wk = 0.0017422 k( 205) = ( 0.2217742 0.1280414 0.3621557), wk = 0.0017422 k( 206) = ( 0.2177419 0.1257134 0.3555711), wk = 0.0017422 k( 207) = ( 0.2137097 0.1233853 0.3489864), wk = 0.0017422 k( 208) = ( 0.2096774 0.1210573 0.3424018), wk = 0.0017422 k( 209) = ( 0.2056452 0.1187293 0.3358171), wk = 0.0017422 k( 210) = ( 0.2016129 0.1164013 0.3292325), wk = 0.0017422 k( 211) = ( 0.1975806 0.1140732 0.3226478), wk = 0.0017422 k( 212) = ( 0.1935484 0.1117452 0.3160632), wk = 0.0017422 k( 213) = ( 0.1895161 0.1094172 0.3094785), wk = 0.0017422 k( 214) = ( 0.1854839 0.1070892 0.3028939), wk = 0.0017422 k( 215) = ( 0.1814516 0.1047611 0.2963093), wk = 0.0017422 k( 216) = ( 0.1774194 0.1024331 0.2897246), wk = 0.0017422 k( 217) = ( 0.1733871 0.1001051 0.2831399), wk = 0.0017422 k( 218) = ( 0.1693548 0.0977771 0.2765553), wk = 0.0017422 k( 219) = ( 0.1653226 0.0954490 0.2699706), wk = 0.0017422 k( 220) = ( 0.1612903 0.0931210 0.2633860), wk = 0.0017422 k( 221) = ( 0.1572581 0.0907930 0.2568013), wk = 0.0017422 k( 222) = ( 0.1532258 0.0884650 0.2502167), wk = 0.0017422 k( 223) = ( 0.1491936 0.0861369 0.2436320), wk = 0.0017422 k( 224) = ( 0.1451613 0.0838089 0.2370474), wk = 0.0017422 k( 225) = ( 0.1411290 0.0814809 0.2304627), wk = 0.0017422 k( 226) = ( 0.1370968 0.0791529 0.2238781), wk = 0.0017422 k( 227) = ( 0.1330645 0.0768248 0.2172934), wk = 0.0017422 k( 228) = ( 0.1290323 0.0744968 0.2107088), wk = 0.0017422 k( 229) = ( 0.1250000 0.0721688 0.2041241), wk = 0.0017422 k( 230) = ( 0.1209677 0.0698408 0.1975395), wk = 0.0017422 k( 231) = ( 0.1169355 0.0675127 0.1909549), wk = 0.0017422 k( 232) = ( 0.1129032 0.0651847 0.1843702), wk = 0.0017422 k( 233) = ( 0.1088710 0.0628567 0.1777855), wk = 0.0017422 k( 234) = ( 0.1048387 0.0605287 0.1712009), wk = 0.0017422 k( 235) = ( 0.1008065 0.0582006 0.1646162), wk = 0.0017422 k( 236) = ( 0.0967742 0.0558726 0.1580316), wk = 0.0017422 k( 237) = ( 0.0927419 0.0535446 0.1514469), wk = 0.0017422 k( 238) = ( 0.0887097 0.0512166 0.1448623), wk = 0.0017422 k( 239) = ( 0.0846774 0.0488885 0.1382776), wk = 0.0017422 k( 240) = ( 0.0806452 0.0465605 0.1316930), wk = 0.0017422 k( 241) = ( 0.0766129 0.0442325 0.1251084), wk = 0.0017422 k( 242) = ( 0.0725806 0.0419045 0.1185237), wk = 0.0017422 k( 243) = ( 0.0685484 0.0395764 0.1119390), wk = 0.0017422 k( 244) = ( 0.0645161 0.0372484 0.1053544), wk = 0.0017422 k( 245) = ( 0.0604839 0.0349204 0.0987697), wk = 0.0017422 k( 246) = ( 0.0564516 0.0325924 0.0921851), wk = 0.0017422 k( 247) = ( 0.0524194 0.0302643 0.0856005), wk = 0.0017422 k( 248) = ( 0.0483871 0.0279363 0.0790158), wk = 0.0017422 k( 249) = ( 0.0443548 0.0256083 0.0724312), wk = 0.0017422 k( 250) = ( 0.0403226 0.0232803 0.0658465), wk = 0.0017422 k( 251) = ( 0.0362903 0.0209522 0.0592619), wk = 0.0017422 k( 252) = ( 0.0322581 0.0186242 0.0526772), wk = 0.0017422 k( 253) = ( 0.0282258 0.0162962 0.0460925), wk = 0.0017422 k( 254) = ( 0.0241936 0.0139682 0.0395079), wk = 0.0017422 k( 255) = ( 0.0201613 0.0116401 0.0329232), wk = 0.0017422 k( 256) = ( 0.0161290 0.0093121 0.0263386), wk = 0.0017422 k( 257) = ( 0.0120968 0.0069841 0.0197540), wk = 0.0017422 k( 258) = ( 0.0080645 0.0046561 0.0131693), wk = 0.0017422 k( 259) = ( 0.0040323 0.0023280 0.0065847), wk = 0.0017422 k( 260) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017422 k( 261) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017422 k( 262) = ( 0.0065790 0.0037984 0.0026858), wk = 0.0017422 k( 263) = ( 0.0131579 0.0075967 0.0053717), wk = 0.0017422 k( 264) = ( 0.0197368 0.0113951 0.0080575), wk = 0.0017422 k( 265) = ( 0.0263158 0.0151934 0.0107434), wk = 0.0017422 k( 266) = ( 0.0328947 0.0189918 0.0134292), wk = 0.0017422 k( 267) = ( 0.0394737 0.0227901 0.0161151), wk = 0.0017422 k( 268) = ( 0.0460526 0.0265885 0.0188009), wk = 0.0017422 k( 269) = ( 0.0526316 0.0303869 0.0214868), wk = 0.0017422 k( 270) = ( 0.0592105 0.0341852 0.0241726), wk = 0.0017422 k( 271) = ( 0.0657895 0.0379836 0.0268584), wk = 0.0017422 k( 272) = ( 0.0723684 0.0417819 0.0295443), wk = 0.0017422 k( 273) = ( 0.0789474 0.0455803 0.0322301), wk = 0.0017422 k( 274) = ( 0.0855263 0.0493786 0.0349160), wk = 0.0017422 k( 275) = ( 0.0921053 0.0531770 0.0376018), wk = 0.0017422 k( 276) = ( 0.0986842 0.0569754 0.0402877), wk = 0.0017422 k( 277) = ( 0.1052632 0.0607737 0.0429735), wk = 0.0017422 k( 278) = ( 0.1118421 0.0645721 0.0456594), wk = 0.0017422 k( 279) = ( 0.1184210 0.0683704 0.0483452), wk = 0.0017422 k( 280) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0017422 k( 281) = ( 0.1315790 0.0759671 0.0537169), wk = 0.0017422 k( 282) = ( 0.1381579 0.0797655 0.0564027), wk = 0.0017422 k( 283) = ( 0.1447368 0.0835639 0.0590886), wk = 0.0017422 k( 284) = ( 0.1513158 0.0873622 0.0617744), wk = 0.0017422 k( 285) = ( 0.1578947 0.0911606 0.0644603), wk = 0.0017422 k( 286) = ( 0.1644737 0.0949589 0.0671461), wk = 0.0017422 k( 287) = ( 0.1710526 0.0987573 0.0698319), wk = 0.0017422 k( 288) = ( 0.1776316 0.1025556 0.0725178), wk = 0.0017422 k( 289) = ( 0.1842105 0.1063540 0.0752036), wk = 0.0017422 k( 290) = ( 0.1907895 0.1101524 0.0778895), wk = 0.0017422 k( 291) = ( 0.1973684 0.1139507 0.0805753), wk = 0.0017422 k( 292) = ( 0.2039474 0.1177491 0.0832612), wk = 0.0017422 k( 293) = ( 0.2105263 0.1215474 0.0859470), wk = 0.0017422 k( 294) = ( 0.2171053 0.1253458 0.0886329), wk = 0.0017422 k( 295) = ( 0.2236842 0.1291441 0.0913187), wk = 0.0017422 k( 296) = ( 0.2302632 0.1329425 0.0940045), wk = 0.0017422 k( 297) = ( 0.2368421 0.1367409 0.0966904), wk = 0.0017422 k( 298) = ( 0.2434210 0.1405392 0.0993762), wk = 0.0017422 k( 299) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0017422 k( 300) = ( 0.2565789 0.1481359 0.1047479), wk = 0.0017422 k( 301) = ( 0.2631579 0.1519343 0.1074338), wk = 0.0017422 k( 302) = ( 0.2697368 0.1557326 0.1101196), wk = 0.0017422 k( 303) = ( 0.2763158 0.1595310 0.1128054), wk = 0.0017422 k( 304) = ( 0.2828947 0.1633294 0.1154913), wk = 0.0017422 k( 305) = ( 0.2894737 0.1671277 0.1181771), wk = 0.0017422 k( 306) = ( 0.2960526 0.1709261 0.1208630), wk = 0.0017422 k( 307) = ( 0.3026316 0.1747244 0.1235488), wk = 0.0017422 k( 308) = ( 0.3092105 0.1785228 0.1262347), wk = 0.0017422 k( 309) = ( 0.3157895 0.1823211 0.1289205), wk = 0.0017422 k( 310) = ( 0.3223684 0.1861195 0.1316064), wk = 0.0017422 k( 311) = ( 0.3289474 0.1899179 0.1342922), wk = 0.0017422 k( 312) = ( 0.3355263 0.1937162 0.1369780), wk = 0.0017422 k( 313) = ( 0.3421053 0.1975146 0.1396639), wk = 0.0017422 k( 314) = ( 0.3486842 0.2013129 0.1423497), wk = 0.0017422 k( 315) = ( 0.3552632 0.2051113 0.1450356), wk = 0.0017422 k( 316) = ( 0.3618421 0.2089096 0.1477214), wk = 0.0017422 k( 317) = ( 0.3684211 0.2127080 0.1504073), wk = 0.0017422 k( 318) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0017422 k( 319) = ( 0.3815789 0.2203047 0.1557790), wk = 0.0017422 k( 320) = ( 0.3881579 0.2241031 0.1584648), wk = 0.0017422 k( 321) = ( 0.3947368 0.2279014 0.1611506), wk = 0.0017422 k( 322) = ( 0.4013158 0.2316998 0.1638365), wk = 0.0017422 k( 323) = ( 0.4078947 0.2354981 0.1665223), wk = 0.0017422 k( 324) = ( 0.4144737 0.2392965 0.1692082), wk = 0.0017422 k( 325) = ( 0.4210526 0.2430948 0.1718940), wk = 0.0017422 k( 326) = ( 0.4276316 0.2468932 0.1745799), wk = 0.0017422 k( 327) = ( 0.4342105 0.2506916 0.1772657), wk = 0.0017422 k( 328) = ( 0.4407895 0.2544899 0.1799515), wk = 0.0017422 k( 329) = ( 0.4473684 0.2582883 0.1826374), wk = 0.0017422 k( 330) = ( 0.4539474 0.2620866 0.1853232), wk = 0.0017422 k( 331) = ( 0.4605263 0.2658850 0.1880091), wk = 0.0017422 k( 332) = ( 0.4671053 0.2696833 0.1906949), wk = 0.0017422 k( 333) = ( 0.4736842 0.2734817 0.1933808), wk = 0.0017422 k( 334) = ( 0.4802632 0.2772801 0.1960666), wk = 0.0017422 k( 335) = ( 0.4868421 0.2810784 0.1987525), wk = 0.0017422 k( 336) = ( 0.4934211 0.2848768 0.2014383), wk = 0.0017422 k( 337) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0017422 k( 338) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0017422 k( 339) = ( 0.5023148 0.2819928 0.2079042), wk = 0.0017422 k( 340) = ( 0.5046296 0.2753105 0.2116843), wk = 0.0017422 k( 341) = ( 0.5069444 0.2686283 0.2154644), wk = 0.0017422 k( 342) = ( 0.5092593 0.2619460 0.2192445), wk = 0.0017422 k( 343) = ( 0.5115741 0.2552637 0.2230245), wk = 0.0017422 k( 344) = ( 0.5138889 0.2485814 0.2268046), wk = 0.0017422 k( 345) = ( 0.5162037 0.2418991 0.2305847), wk = 0.0017422 k( 346) = ( 0.5185185 0.2352168 0.2343648), wk = 0.0017422 k( 347) = ( 0.5208333 0.2285345 0.2381448), wk = 0.0017422 k( 348) = ( 0.5231482 0.2218522 0.2419249), wk = 0.0017422 k( 349) = ( 0.5254630 0.2151699 0.2457050), wk = 0.0017422 k( 350) = ( 0.5277778 0.2084876 0.2494851), wk = 0.0017422 k( 351) = ( 0.5300926 0.2018053 0.2532651), wk = 0.0017422 k( 352) = ( 0.5324074 0.1951230 0.2570452), wk = 0.0017422 k( 353) = ( 0.5347222 0.1884407 0.2608253), wk = 0.0017422 k( 354) = ( 0.5370370 0.1817584 0.2646054), wk = 0.0017422 k( 355) = ( 0.5393518 0.1750761 0.2683854), wk = 0.0017422 k( 356) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0017422 k( 357) = ( 0.5439815 0.1617115 0.2759456), wk = 0.0017422 k( 358) = ( 0.5462963 0.1550292 0.2797257), wk = 0.0017422 k( 359) = ( 0.5486111 0.1483469 0.2835058), wk = 0.0017422 k( 360) = ( 0.5509259 0.1416646 0.2872858), wk = 0.0017422 k( 361) = ( 0.5532407 0.1349824 0.2910659), wk = 0.0017422 k( 362) = ( 0.5555556 0.1283001 0.2948460), wk = 0.0017422 k( 363) = ( 0.5578704 0.1216178 0.2986261), wk = 0.0017422 k( 364) = ( 0.5601852 0.1149355 0.3024061), wk = 0.0017422 k( 365) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0017422 k( 366) = ( 0.5648148 0.1015709 0.3099663), wk = 0.0017422 k( 367) = ( 0.5671296 0.0948886 0.3137464), wk = 0.0017422 k( 368) = ( 0.5694444 0.0882063 0.3175264), wk = 0.0017422 k( 369) = ( 0.5717593 0.0815240 0.3213065), wk = 0.0017422 k( 370) = ( 0.5740741 0.0748417 0.3250866), wk = 0.0017422 k( 371) = ( 0.5763889 0.0681594 0.3288667), wk = 0.0017422 k( 372) = ( 0.5787037 0.0614771 0.3326468), wk = 0.0017422 k( 373) = ( 0.5810185 0.0547948 0.3364268), wk = 0.0017422 k( 374) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0017422 k( 375) = ( 0.5856482 0.0414302 0.3439870), wk = 0.0017422 k( 376) = ( 0.5879630 0.0347479 0.3477671), wk = 0.0017422 k( 377) = ( 0.5902778 0.0280656 0.3515471), wk = 0.0017422 k( 378) = ( 0.5925926 0.0213833 0.3553272), wk = 0.0017422 k( 379) = ( 0.5949074 0.0147011 0.3591073), wk = 0.0017422 k( 380) = ( 0.5972222 0.0080188 0.3628874), wk = 0.0017422 k( 381) = ( 0.5995370 0.0013365 0.3666674), wk = 0.0017422 k( 382) = ( 0.6018518 -0.0053458 0.3704475), wk = 0.0017422 k( 383) = ( 0.6041667 -0.0120281 0.3742276), wk = 0.0017422 k( 384) = ( 0.6064815 -0.0187104 0.3780077), wk = 0.0017422 k( 385) = ( 0.6087963 -0.0253927 0.3817878), wk = 0.0017422 k( 386) = ( 0.6111111 -0.0320750 0.3855678), wk = 0.0017422 k( 387) = ( 0.6134259 -0.0387573 0.3893479), wk = 0.0017422 k( 388) = ( 0.6157407 -0.0454396 0.3931280), wk = 0.0017422 k( 389) = ( 0.6180556 -0.0521219 0.3969081), wk = 0.0017422 k( 390) = ( 0.6203704 -0.0588042 0.4006881), wk = 0.0017422 k( 391) = ( 0.6226852 -0.0654865 0.4044682), wk = 0.0017422 k( 392) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0017422 k( 393) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0017422 k( 394) = ( 0.6209677 -0.0698408 0.4148329), wk = 0.0017422 k( 395) = ( 0.6169355 -0.0675127 0.4214176), wk = 0.0017422 k( 396) = ( 0.6129032 -0.0651847 0.4280022), wk = 0.0017422 k( 397) = ( 0.6088710 -0.0628567 0.4345869), wk = 0.0017422 k( 398) = ( 0.6048387 -0.0605287 0.4411715), wk = 0.0017422 k( 399) = ( 0.6008064 -0.0582006 0.4477562), wk = 0.0017422 k( 400) = ( 0.5967742 -0.0558726 0.4543408), wk = 0.0017422 k( 401) = ( 0.5927419 -0.0535446 0.4609255), wk = 0.0017422 k( 402) = ( 0.5887097 -0.0512166 0.4675101), wk = 0.0017422 k( 403) = ( 0.5846774 -0.0488885 0.4740948), wk = 0.0017422 k( 404) = ( 0.5806452 -0.0465605 0.4806794), wk = 0.0017422 k( 405) = ( 0.5766129 -0.0442325 0.4872641), wk = 0.0017422 k( 406) = ( 0.5725807 -0.0419045 0.4938487), wk = 0.0017422 k( 407) = ( 0.5685484 -0.0395764 0.5004334), wk = 0.0017422 k( 408) = ( 0.5645161 -0.0372484 0.5070180), wk = 0.0017422 k( 409) = ( 0.5604839 -0.0349204 0.5136027), wk = 0.0017422 k( 410) = ( 0.5564516 -0.0325924 0.5201873), wk = 0.0017422 k( 411) = ( 0.5524193 -0.0302643 0.5267720), wk = 0.0017422 k( 412) = ( 0.5483871 -0.0279363 0.5333566), wk = 0.0017422 k( 413) = ( 0.5443548 -0.0256083 0.5399413), wk = 0.0017422 k( 414) = ( 0.5403226 -0.0232803 0.5465259), wk = 0.0017422 k( 415) = ( 0.5362903 -0.0209522 0.5531106), wk = 0.0017422 k( 416) = ( 0.5322581 -0.0186242 0.5596952), wk = 0.0017422 k( 417) = ( 0.5282258 -0.0162962 0.5662799), wk = 0.0017422 k( 418) = ( 0.5241936 -0.0139682 0.5728645), wk = 0.0017422 k( 419) = ( 0.5201613 -0.0116401 0.5794492), wk = 0.0017422 k( 420) = ( 0.5161290 -0.0093121 0.5860338), wk = 0.0017422 k( 421) = ( 0.5120968 -0.0069841 0.5926185), wk = 0.0017422 k( 422) = ( 0.5080645 -0.0046561 0.5992031), wk = 0.0017422 k( 423) = ( 0.5040323 -0.0023280 0.6057878), wk = 0.0017422 k( 424) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0017422 k( 425) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0017422 k( 426) = ( 0.5000000 0.0046561 0.6057878), wk = 0.0017422 k( 427) = ( 0.5000000 0.0093121 0.5992031), wk = 0.0017422 k( 428) = ( 0.5000000 0.0139681 0.5926185), wk = 0.0017422 k( 429) = ( 0.5000000 0.0186242 0.5860338), wk = 0.0017422 k( 430) = ( 0.5000000 0.0232803 0.5794492), wk = 0.0017422 k( 431) = ( 0.5000000 0.0279363 0.5728645), wk = 0.0017422 k( 432) = ( 0.5000000 0.0325924 0.5662799), wk = 0.0017422 k( 433) = ( 0.5000000 0.0372484 0.5596952), wk = 0.0017422 k( 434) = ( 0.5000000 0.0419045 0.5531106), wk = 0.0017422 k( 435) = ( 0.5000000 0.0465605 0.5465259), wk = 0.0017422 k( 436) = ( 0.5000000 0.0512166 0.5399413), wk = 0.0017422 k( 437) = ( 0.5000000 0.0558726 0.5333566), wk = 0.0017422 k( 438) = ( 0.5000000 0.0605287 0.5267720), wk = 0.0017422 k( 439) = ( 0.5000000 0.0651847 0.5201873), wk = 0.0017422 k( 440) = ( 0.5000000 0.0698408 0.5136027), wk = 0.0017422 k( 441) = ( 0.5000000 0.0744968 0.5070180), wk = 0.0017422 k( 442) = ( 0.5000000 0.0791529 0.5004334), wk = 0.0017422 k( 443) = ( 0.5000000 0.0838089 0.4938487), wk = 0.0017422 k( 444) = ( 0.5000000 0.0884650 0.4872641), wk = 0.0017422 k( 445) = ( 0.5000000 0.0931210 0.4806794), wk = 0.0017422 k( 446) = ( 0.5000000 0.0977771 0.4740948), wk = 0.0017422 k( 447) = ( 0.5000000 0.1024331 0.4675101), wk = 0.0017422 k( 448) = ( 0.5000000 0.1070892 0.4609255), wk = 0.0017422 k( 449) = ( 0.5000000 0.1117452 0.4543408), wk = 0.0017422 k( 450) = ( 0.5000000 0.1164013 0.4477562), wk = 0.0017422 k( 451) = ( 0.5000000 0.1210573 0.4411715), wk = 0.0017422 k( 452) = ( 0.5000000 0.1257134 0.4345869), wk = 0.0017422 k( 453) = ( 0.5000000 0.1303694 0.4280022), wk = 0.0017422 k( 454) = ( 0.5000000 0.1350255 0.4214176), wk = 0.0017422 k( 455) = ( 0.5000000 0.1396815 0.4148329), wk = 0.0017422 k( 456) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0017422 k( 457) = ( 0.5000000 0.1489936 0.4016636), wk = 0.0017422 k( 458) = ( 0.5000000 0.1536497 0.3950790), wk = 0.0017422 k( 459) = ( 0.5000000 0.1583057 0.3884943), wk = 0.0017422 k( 460) = ( 0.5000000 0.1629618 0.3819097), wk = 0.0017422 k( 461) = ( 0.5000000 0.1676178 0.3753250), wk = 0.0017422 k( 462) = ( 0.5000000 0.1722739 0.3687404), wk = 0.0017422 k( 463) = ( 0.5000000 0.1769299 0.3621557), wk = 0.0017422 k( 464) = ( 0.5000000 0.1815860 0.3555711), wk = 0.0017422 k( 465) = ( 0.5000000 0.1862420 0.3489864), wk = 0.0017422 k( 466) = ( 0.5000000 0.1908981 0.3424018), wk = 0.0017422 k( 467) = ( 0.5000000 0.1955541 0.3358171), wk = 0.0017422 k( 468) = ( 0.5000000 0.2002102 0.3292325), wk = 0.0017422 k( 469) = ( 0.5000000 0.2048662 0.3226479), wk = 0.0017422 k( 470) = ( 0.5000000 0.2095223 0.3160632), wk = 0.0017422 k( 471) = ( 0.5000000 0.2141783 0.3094785), wk = 0.0017422 k( 472) = ( 0.5000000 0.2188344 0.3028939), wk = 0.0017422 k( 473) = ( 0.5000000 0.2234904 0.2963092), wk = 0.0017422 k( 474) = ( 0.5000000 0.2281465 0.2897246), wk = 0.0017422 k( 475) = ( 0.5000000 0.2328025 0.2831399), wk = 0.0017422 k( 476) = ( 0.5000000 0.2374586 0.2765553), wk = 0.0017422 k( 477) = ( 0.5000000 0.2421146 0.2699706), wk = 0.0017422 k( 478) = ( 0.5000000 0.2467707 0.2633860), wk = 0.0017422 k( 479) = ( 0.5000000 0.2514267 0.2568013), wk = 0.0017422 k( 480) = ( 0.5000000 0.2560828 0.2502167), wk = 0.0017422 k( 481) = ( 0.5000000 0.2607388 0.2436320), wk = 0.0017422 k( 482) = ( 0.5000000 0.2653949 0.2370474), wk = 0.0017422 k( 483) = ( 0.5000000 0.2700509 0.2304627), wk = 0.0017422 k( 484) = ( 0.5000000 0.2747070 0.2238781), wk = 0.0017422 k( 485) = ( 0.5000000 0.2793630 0.2172935), wk = 0.0017422 k( 486) = ( 0.5000000 0.2840191 0.2107088), wk = 0.0017422 k( 487) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0017422 k( 488) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0017422 k( 489) = ( 0.4976852 0.2873387 0.2116843), wk = 0.0017422 k( 490) = ( 0.4953704 0.2860022 0.2192445), wk = 0.0017422 k( 491) = ( 0.4930556 0.2846658 0.2268046), wk = 0.0017422 k( 492) = ( 0.4907407 0.2833293 0.2343648), wk = 0.0017422 k( 493) = ( 0.4884259 0.2819928 0.2419249), wk = 0.0017422 k( 494) = ( 0.4861111 0.2806564 0.2494851), wk = 0.0017422 k( 495) = ( 0.4837963 0.2793199 0.2570452), wk = 0.0017422 k( 496) = ( 0.4814815 0.2779835 0.2646054), wk = 0.0017422 k( 497) = ( 0.4791667 0.2766470 0.2721655), wk = 0.0017422 k( 498) = ( 0.4768519 0.2753105 0.2797257), wk = 0.0017422 k( 499) = ( 0.4745370 0.2739741 0.2872858), wk = 0.0017422 k( 500) = ( 0.4722222 0.2726376 0.2948460), wk = 0.0017422 k( 501) = ( 0.4699074 0.2713012 0.3024061), wk = 0.0017422 k( 502) = ( 0.4675926 0.2699647 0.3099663), wk = 0.0017422 k( 503) = ( 0.4652778 0.2686283 0.3175264), wk = 0.0017422 k( 504) = ( 0.4629630 0.2672918 0.3250866), wk = 0.0017422 k( 505) = ( 0.4606481 0.2659553 0.3326467), wk = 0.0017422 k( 506) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0017422 k( 507) = ( 0.4560185 0.2632824 0.3477671), wk = 0.0017422 k( 508) = ( 0.4537037 0.2619460 0.3553272), wk = 0.0017422 k( 509) = ( 0.4513889 0.2606095 0.3628874), wk = 0.0017422 k( 510) = ( 0.4490741 0.2592730 0.3704475), wk = 0.0017422 k( 511) = ( 0.4467593 0.2579366 0.3780077), wk = 0.0017422 k( 512) = ( 0.4444444 0.2566001 0.3855678), wk = 0.0017422 k( 513) = ( 0.4421296 0.2552637 0.3931280), wk = 0.0017422 k( 514) = ( 0.4398148 0.2539272 0.4006881), wk = 0.0017422 k( 515) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0017422 k( 516) = ( 0.4351852 0.2512543 0.4158084), wk = 0.0017422 k( 517) = ( 0.4328704 0.2499178 0.4233686), wk = 0.0017422 k( 518) = ( 0.4305556 0.2485814 0.4309287), wk = 0.0017422 k( 519) = ( 0.4282407 0.2472449 0.4384889), wk = 0.0017422 k( 520) = ( 0.4259259 0.2459085 0.4460491), wk = 0.0017422 k( 521) = ( 0.4236111 0.2445720 0.4536092), wk = 0.0017422 k( 522) = ( 0.4212963 0.2432355 0.4611694), wk = 0.0017422 k( 523) = ( 0.4189815 0.2418991 0.4687295), wk = 0.0017422 k( 524) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0017422 k( 525) = ( 0.4143519 0.2392262 0.4838498), wk = 0.0017422 k( 526) = ( 0.4120370 0.2378897 0.4914100), wk = 0.0017422 k( 527) = ( 0.4097222 0.2365532 0.4989701), wk = 0.0017422 k( 528) = ( 0.4074074 0.2352168 0.5065303), wk = 0.0017422 k( 529) = ( 0.4050926 0.2338803 0.5140904), wk = 0.0017422 k( 530) = ( 0.4027778 0.2325439 0.5216506), wk = 0.0017422 k( 531) = ( 0.4004630 0.2312074 0.5292107), wk = 0.0017422 k( 532) = ( 0.3981481 0.2298709 0.5367709), wk = 0.0017422 k( 533) = ( 0.3958333 0.2285345 0.5443311), wk = 0.0017422 k( 534) = ( 0.3935185 0.2271980 0.5518912), wk = 0.0017422 k( 535) = ( 0.3912037 0.2258616 0.5594514), wk = 0.0017422 k( 536) = ( 0.3888889 0.2245251 0.5670115), wk = 0.0017422 k( 537) = ( 0.3865741 0.2231886 0.5745717), wk = 0.0017422 k( 538) = ( 0.3842593 0.2218522 0.5821318), wk = 0.0017422 k( 539) = ( 0.3819444 0.2205157 0.5896920), wk = 0.0017422 k( 540) = ( 0.3796296 0.2191793 0.5972521), wk = 0.0017422 k( 541) = ( 0.3773148 0.2178428 0.6048123), wk = 0.0017422 k( 542) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0017422 k( 543) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0017422 k( 544) = ( 0.6209677 -0.0791529 0.4082483), wk = 0.0017422 k( 545) = ( 0.6169355 -0.0861369 0.4082483), wk = 0.0017422 k( 546) = ( 0.6129032 -0.0931210 0.4082483), wk = 0.0017422 k( 547) = ( 0.6088710 -0.1001051 0.4082483), wk = 0.0017422 k( 548) = ( 0.6048387 -0.1070892 0.4082483), wk = 0.0017422 k( 549) = ( 0.6008064 -0.1140732 0.4082483), wk = 0.0017422 k( 550) = ( 0.5967742 -0.1210573 0.4082483), wk = 0.0017422 k( 551) = ( 0.5927419 -0.1280414 0.4082483), wk = 0.0017422 k( 552) = ( 0.5887097 -0.1350255 0.4082483), wk = 0.0017422 k( 553) = ( 0.5846774 -0.1420095 0.4082483), wk = 0.0017422 k( 554) = ( 0.5806452 -0.1489936 0.4082483), wk = 0.0017422 k( 555) = ( 0.5766129 -0.1559777 0.4082483), wk = 0.0017422 k( 556) = ( 0.5725807 -0.1629618 0.4082483), wk = 0.0017422 k( 557) = ( 0.5685484 -0.1699459 0.4082483), wk = 0.0017422 k( 558) = ( 0.5645161 -0.1769299 0.4082483), wk = 0.0017422 k( 559) = ( 0.5604839 -0.1839140 0.4082483), wk = 0.0017422 k( 560) = ( 0.5564516 -0.1908981 0.4082483), wk = 0.0017422 k( 561) = ( 0.5524193 -0.1978821 0.4082483), wk = 0.0017422 k( 562) = ( 0.5483871 -0.2048662 0.4082483), wk = 0.0017422 k( 563) = ( 0.5443548 -0.2118503 0.4082483), wk = 0.0017422 k( 564) = ( 0.5403226 -0.2188344 0.4082483), wk = 0.0017422 k( 565) = ( 0.5362903 -0.2258184 0.4082483), wk = 0.0017422 k( 566) = ( 0.5322581 -0.2328025 0.4082483), wk = 0.0017422 k( 567) = ( 0.5282258 -0.2397866 0.4082483), wk = 0.0017422 k( 568) = ( 0.5241936 -0.2467707 0.4082483), wk = 0.0017422 k( 569) = ( 0.5201613 -0.2537548 0.4082483), wk = 0.0017422 k( 570) = ( 0.5161290 -0.2607388 0.4082483), wk = 0.0017422 k( 571) = ( 0.5120968 -0.2677229 0.4082483), wk = 0.0017422 k( 572) = ( 0.5080645 -0.2747070 0.4082483), wk = 0.0017422 k( 573) = ( 0.5040323 -0.2816911 0.4082483), wk = 0.0017422 k( 574) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0017422 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017422 k( 2) = ( 0.0056818 -0.0000000 0.0056818), wk = 0.0017422 k( 3) = ( 0.0113636 -0.0000000 0.0113636), wk = 0.0017422 k( 4) = ( 0.0170455 -0.0000000 0.0170454), wk = 0.0017422 k( 5) = ( 0.0227273 -0.0000000 0.0227273), wk = 0.0017422 k( 6) = ( 0.0284091 0.0000000 0.0284091), wk = 0.0017422 k( 7) = ( 0.0340909 -0.0000000 0.0340909), wk = 0.0017422 k( 8) = ( 0.0397727 -0.0000000 0.0397727), wk = 0.0017422 k( 9) = ( 0.0454546 -0.0000000 0.0454546), wk = 0.0017422 k( 10) = ( 0.0511364 -0.0000000 0.0511364), wk = 0.0017422 k( 11) = ( 0.0568182 0.0000000 0.0568182), wk = 0.0017422 k( 12) = ( 0.0625000 0.0000000 0.0625000), wk = 0.0017422 k( 13) = ( 0.0681818 -0.0000000 0.0681818), wk = 0.0017422 k( 14) = ( 0.0738636 -0.0000000 0.0738636), wk = 0.0017422 k( 15) = ( 0.0795455 -0.0000000 0.0795454), wk = 0.0017422 k( 16) = ( 0.0852273 -0.0000000 0.0852273), wk = 0.0017422 k( 17) = ( 0.0909091 -0.0000000 0.0909091), wk = 0.0017422 k( 18) = ( 0.0965909 -0.0000000 0.0965909), wk = 0.0017422 k( 19) = ( 0.1022727 -0.0000000 0.1022727), wk = 0.0017422 k( 20) = ( 0.1079545 -0.0000000 0.1079545), wk = 0.0017422 k( 21) = ( 0.1136364 0.0000000 0.1136364), wk = 0.0017422 k( 22) = ( 0.1193182 0.0000000 0.1193182), wk = 0.0017422 k( 23) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0017422 k( 24) = ( 0.1306818 -0.0000000 0.1306818), wk = 0.0017422 k( 25) = ( 0.1363636 -0.0000000 0.1363636), wk = 0.0017422 k( 26) = ( 0.1420454 -0.0000000 0.1420454), wk = 0.0017422 k( 27) = ( 0.1477273 -0.0000000 0.1477273), wk = 0.0017422 k( 28) = ( 0.1534091 -0.0000000 0.1534091), wk = 0.0017422 k( 29) = ( 0.1590909 -0.0000000 0.1590909), wk = 0.0017422 k( 30) = ( 0.1647727 -0.0000000 0.1647727), wk = 0.0017422 k( 31) = ( 0.1704546 0.0000000 0.1704545), wk = 0.0017422 k( 32) = ( 0.1761364 -0.0000000 0.1761364), wk = 0.0017422 k( 33) = ( 0.1818182 -0.0000000 0.1818182), wk = 0.0017422 k( 34) = ( 0.1875000 0.0000000 0.1875000), wk = 0.0017422 k( 35) = ( 0.1931818 -0.0000000 0.1931818), wk = 0.0017422 k( 36) = ( 0.1988636 -0.0000000 0.1988636), wk = 0.0017422 k( 37) = ( 0.2045454 -0.0000000 0.2045454), wk = 0.0017422 k( 38) = ( 0.2102273 0.0000000 0.2102273), wk = 0.0017422 k( 39) = ( 0.2159091 -0.0000000 0.2159091), wk = 0.0017422 k( 40) = ( 0.2215909 0.0000000 0.2215909), wk = 0.0017422 k( 41) = ( 0.2272727 -0.0000000 0.2272727), wk = 0.0017422 k( 42) = ( 0.2329546 0.0000000 0.2329545), wk = 0.0017422 k( 43) = ( 0.2386364 0.0000000 0.2386364), wk = 0.0017422 k( 44) = ( 0.2443182 -0.0000000 0.2443182), wk = 0.0017422 k( 45) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0017422 k( 46) = ( 0.2556818 -0.0000000 0.2556818), wk = 0.0017422 k( 47) = ( 0.2613636 -0.0000000 0.2613636), wk = 0.0017422 k( 48) = ( 0.2670455 -0.0000000 0.2670454), wk = 0.0017422 k( 49) = ( 0.2727273 -0.0000000 0.2727273), wk = 0.0017422 k( 50) = ( 0.2784091 -0.0000000 0.2784091), wk = 0.0017422 k( 51) = ( 0.2840909 -0.0000000 0.2840909), wk = 0.0017422 k( 52) = ( 0.2897727 -0.0000000 0.2897727), wk = 0.0017422 k( 53) = ( 0.2954545 -0.0000000 0.2954545), wk = 0.0017422 k( 54) = ( 0.3011364 -0.0000000 0.3011364), wk = 0.0017422 k( 55) = ( 0.3068182 -0.0000000 0.3068182), wk = 0.0017422 k( 56) = ( 0.3125000 -0.0000000 0.3125000), wk = 0.0017422 k( 57) = ( 0.3181818 -0.0000000 0.3181818), wk = 0.0017422 k( 58) = ( 0.3238636 -0.0000000 0.3238636), wk = 0.0017422 k( 59) = ( 0.3295455 -0.0000000 0.3295455), wk = 0.0017422 k( 60) = ( 0.3352273 -0.0000000 0.3352273), wk = 0.0017422 k( 61) = ( 0.3409091 -0.0000000 0.3409091), wk = 0.0017422 k( 62) = ( 0.3465909 -0.0000000 0.3465909), wk = 0.0017422 k( 63) = ( 0.3522727 -0.0000000 0.3522727), wk = 0.0017422 k( 64) = ( 0.3579545 -0.0000000 0.3579545), wk = 0.0017422 k( 65) = ( 0.3636364 -0.0000000 0.3636364), wk = 0.0017422 k( 66) = ( 0.3693182 -0.0000000 0.3693182), wk = 0.0017422 k( 67) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0017422 k( 68) = ( 0.3806818 -0.0000000 0.3806818), wk = 0.0017422 k( 69) = ( 0.3863636 -0.0000000 0.3863636), wk = 0.0017422 k( 70) = ( 0.3920455 -0.0000000 0.3920454), wk = 0.0017422 k( 71) = ( 0.3977273 0.0000000 0.3977273), wk = 0.0017422 k( 72) = ( 0.4034091 -0.0000000 0.4034091), wk = 0.0017422 k( 73) = ( 0.4090909 -0.0000000 0.4090909), wk = 0.0017422 k( 74) = ( 0.4147727 0.0000000 0.4147727), wk = 0.0017422 k( 75) = ( 0.4204545 -0.0000000 0.4204545), wk = 0.0017422 k( 76) = ( 0.4261364 -0.0000000 0.4261364), wk = 0.0017422 k( 77) = ( 0.4318182 -0.0000000 0.4318182), wk = 0.0017422 k( 78) = ( 0.4375000 -0.0000000 0.4375000), wk = 0.0017422 k( 79) = ( 0.4431818 0.0000000 0.4431818), wk = 0.0017422 k( 80) = ( 0.4488636 -0.0000000 0.4488636), wk = 0.0017422 k( 81) = ( 0.4545455 0.0000000 0.4545454), wk = 0.0017422 k( 82) = ( 0.4602273 0.0000000 0.4602273), wk = 0.0017422 k( 83) = ( 0.4659091 -0.0000000 0.4659091), wk = 0.0017422 k( 84) = ( 0.4715909 -0.0000000 0.4715909), wk = 0.0017422 k( 85) = ( 0.4772727 -0.0000000 0.4772727), wk = 0.0017422 k( 86) = ( 0.4829545 0.0000000 0.4829545), wk = 0.0017422 k( 87) = ( 0.4886364 -0.0000000 0.4886364), wk = 0.0017422 k( 88) = ( 0.4943182 0.0000000 0.4943182), wk = 0.0017422 k( 89) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0017422 k( 90) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0017422 k( 91) = ( 0.5000000 0.0056818 0.5056818), wk = 0.0017422 k( 92) = ( 0.5000000 0.0113636 0.5113636), wk = 0.0017422 k( 93) = ( 0.5000000 0.0170454 0.5170454), wk = 0.0017422 k( 94) = ( 0.5000000 0.0227273 0.5227273), wk = 0.0017422 k( 95) = ( 0.5000000 0.0284091 0.5284091), wk = 0.0017422 k( 96) = ( 0.5000000 0.0340909 0.5340909), wk = 0.0017422 k( 97) = ( 0.5000000 0.0397727 0.5397727), wk = 0.0017422 k( 98) = ( 0.5000000 0.0454546 0.5454545), wk = 0.0017422 k( 99) = ( 0.5000000 0.0511364 0.5511364), wk = 0.0017422 k( 100) = ( 0.5000000 0.0568182 0.5568182), wk = 0.0017422 k( 101) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0017422 k( 102) = ( 0.5000000 0.0681818 0.5681818), wk = 0.0017422 k( 103) = ( 0.5000000 0.0738636 0.5738636), wk = 0.0017422 k( 104) = ( 0.5000000 0.0795454 0.5795454), wk = 0.0017422 k( 105) = ( 0.5000000 0.0852273 0.5852273), wk = 0.0017422 k( 106) = ( 0.5000000 0.0909091 0.5909091), wk = 0.0017422 k( 107) = ( 0.5000000 0.0965909 0.5965909), wk = 0.0017422 k( 108) = ( 0.5000000 0.1022727 0.6022727), wk = 0.0017422 k( 109) = ( 0.5000000 0.1079546 0.6079545), wk = 0.0017422 k( 110) = ( 0.5000000 0.1136364 0.6136364), wk = 0.0017422 k( 111) = ( 0.5000000 0.1193182 0.6193182), wk = 0.0017422 k( 112) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0017422 k( 113) = ( 0.5000000 0.1306818 0.6306818), wk = 0.0017422 k( 114) = ( 0.5000000 0.1363636 0.6363636), wk = 0.0017422 k( 115) = ( 0.5000000 0.1420454 0.6420454), wk = 0.0017422 k( 116) = ( 0.5000000 0.1477273 0.6477273), wk = 0.0017422 k( 117) = ( 0.5000000 0.1534091 0.6534091), wk = 0.0017422 k( 118) = ( 0.5000000 0.1590909 0.6590909), wk = 0.0017422 k( 119) = ( 0.5000000 0.1647727 0.6647727), wk = 0.0017422 k( 120) = ( 0.5000000 0.1704546 0.6704545), wk = 0.0017422 k( 121) = ( 0.5000000 0.1761364 0.6761364), wk = 0.0017422 k( 122) = ( 0.5000000 0.1818182 0.6818182), wk = 0.0017422 k( 123) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0017422 k( 124) = ( 0.5000000 0.1931818 0.6931818), wk = 0.0017422 k( 125) = ( 0.5000000 0.1988636 0.6988636), wk = 0.0017422 k( 126) = ( 0.5000000 0.2045454 0.7045454), wk = 0.0017422 k( 127) = ( 0.5000000 0.2102273 0.7102273), wk = 0.0017422 k( 128) = ( 0.5000000 0.2159091 0.7159091), wk = 0.0017422 k( 129) = ( 0.5000000 0.2215909 0.7215909), wk = 0.0017422 k( 130) = ( 0.5000000 0.2272727 0.7272727), wk = 0.0017422 k( 131) = ( 0.5000000 0.2329546 0.7329545), wk = 0.0017422 k( 132) = ( 0.5000000 0.2386364 0.7386364), wk = 0.0017422 k( 133) = ( 0.5000000 0.2443182 0.7443182), wk = 0.0017422 k( 134) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0017422 k( 135) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0017422 k( 136) = ( 0.4959677 0.2540323 0.7500000), wk = 0.0017422 k( 137) = ( 0.4919355 0.2580645 0.7500000), wk = 0.0017422 k( 138) = ( 0.4879032 0.2620968 0.7500000), wk = 0.0017422 k( 139) = ( 0.4838710 0.2661290 0.7500000), wk = 0.0017422 k( 140) = ( 0.4798387 0.2701613 0.7500000), wk = 0.0017422 k( 141) = ( 0.4758064 0.2741935 0.7500000), wk = 0.0017422 k( 142) = ( 0.4717742 0.2782258 0.7500000), wk = 0.0017422 k( 143) = ( 0.4677419 0.2822581 0.7500000), wk = 0.0017422 k( 144) = ( 0.4637097 0.2862903 0.7500000), wk = 0.0017422 k( 145) = ( 0.4596774 0.2903226 0.7500000), wk = 0.0017422 k( 146) = ( 0.4556452 0.2943548 0.7500000), wk = 0.0017422 k( 147) = ( 0.4516129 0.2983871 0.7500000), wk = 0.0017422 k( 148) = ( 0.4475807 0.3024193 0.7500000), wk = 0.0017422 k( 149) = ( 0.4435484 0.3064516 0.7500000), wk = 0.0017422 k( 150) = ( 0.4395161 0.3104839 0.7500000), wk = 0.0017422 k( 151) = ( 0.4354839 0.3145161 0.7500000), wk = 0.0017422 k( 152) = ( 0.4314516 0.3185484 0.7500000), wk = 0.0017422 k( 153) = ( 0.4274193 0.3225807 0.7500000), wk = 0.0017422 k( 154) = ( 0.4233871 0.3266129 0.7500000), wk = 0.0017422 k( 155) = ( 0.4193548 0.3306452 0.7500000), wk = 0.0017422 k( 156) = ( 0.4153226 0.3346774 0.7500000), wk = 0.0017422 k( 157) = ( 0.4112903 0.3387097 0.7500000), wk = 0.0017422 k( 158) = ( 0.4072581 0.3427419 0.7500000), wk = 0.0017422 k( 159) = ( 0.4032258 0.3467742 0.7500000), wk = 0.0017422 k( 160) = ( 0.3991936 0.3508064 0.7500000), wk = 0.0017422 k( 161) = ( 0.3951613 0.3548387 0.7500000), wk = 0.0017422 k( 162) = ( 0.3911290 0.3588710 0.7500000), wk = 0.0017422 k( 163) = ( 0.3870968 0.3629032 0.7500000), wk = 0.0017422 k( 164) = ( 0.3830645 0.3669355 0.7500000), wk = 0.0017422 k( 165) = ( 0.3790323 0.3709677 0.7500000), wk = 0.0017422 k( 166) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0017422 k( 167) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0017422 k( 168) = ( 0.3709677 0.3709677 0.7419355), wk = 0.0017422 k( 169) = ( 0.3669355 0.3669355 0.7338710), wk = 0.0017422 k( 170) = ( 0.3629032 0.3629032 0.7258064), wk = 0.0017422 k( 171) = ( 0.3588710 0.3588710 0.7177419), wk = 0.0017422 k( 172) = ( 0.3548387 0.3548387 0.7096774), wk = 0.0017422 k( 173) = ( 0.3508064 0.3508064 0.7016129), wk = 0.0017422 k( 174) = ( 0.3467742 0.3467742 0.6935484), wk = 0.0017422 k( 175) = ( 0.3427419 0.3427419 0.6854839), wk = 0.0017422 k( 176) = ( 0.3387097 0.3387097 0.6774193), wk = 0.0017422 k( 177) = ( 0.3346774 0.3346774 0.6693548), wk = 0.0017422 k( 178) = ( 0.3306452 0.3306452 0.6612903), wk = 0.0017422 k( 179) = ( 0.3266129 0.3266129 0.6532258), wk = 0.0017422 k( 180) = ( 0.3225807 0.3225807 0.6451613), wk = 0.0017422 k( 181) = ( 0.3185484 0.3185484 0.6370968), wk = 0.0017422 k( 182) = ( 0.3145161 0.3145161 0.6290323), wk = 0.0017422 k( 183) = ( 0.3104839 0.3104839 0.6209677), wk = 0.0017422 k( 184) = ( 0.3064516 0.3064516 0.6129032), wk = 0.0017422 k( 185) = ( 0.3024193 0.3024193 0.6048387), wk = 0.0017422 k( 186) = ( 0.2983871 0.2983871 0.5967742), wk = 0.0017422 k( 187) = ( 0.2943548 0.2943548 0.5887097), wk = 0.0017422 k( 188) = ( 0.2903226 0.2903226 0.5806452), wk = 0.0017422 k( 189) = ( 0.2862903 0.2862903 0.5725806), wk = 0.0017422 k( 190) = ( 0.2822581 0.2822581 0.5645161), wk = 0.0017422 k( 191) = ( 0.2782258 0.2782258 0.5564516), wk = 0.0017422 k( 192) = ( 0.2741936 0.2741936 0.5483871), wk = 0.0017422 k( 193) = ( 0.2701613 0.2701613 0.5403226), wk = 0.0017422 k( 194) = ( 0.2661290 0.2661290 0.5322581), wk = 0.0017422 k( 195) = ( 0.2620968 0.2620968 0.5241936), wk = 0.0017422 k( 196) = ( 0.2580645 0.2580645 0.5161290), wk = 0.0017422 k( 197) = ( 0.2540323 0.2540323 0.5080645), wk = 0.0017422 k( 198) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0017422 k( 199) = ( 0.2459677 0.2459677 0.4919355), wk = 0.0017422 k( 200) = ( 0.2419355 0.2419355 0.4838710), wk = 0.0017422 k( 201) = ( 0.2379032 0.2379032 0.4758064), wk = 0.0017422 k( 202) = ( 0.2338710 0.2338710 0.4677419), wk = 0.0017422 k( 203) = ( 0.2298387 0.2298387 0.4596774), wk = 0.0017422 k( 204) = ( 0.2258064 0.2258065 0.4516129), wk = 0.0017422 k( 205) = ( 0.2217742 0.2217742 0.4435484), wk = 0.0017422 k( 206) = ( 0.2177419 0.2177419 0.4354839), wk = 0.0017422 k( 207) = ( 0.2137097 0.2137097 0.4274193), wk = 0.0017422 k( 208) = ( 0.2096774 0.2096774 0.4193548), wk = 0.0017422 k( 209) = ( 0.2056452 0.2056452 0.4112903), wk = 0.0017422 k( 210) = ( 0.2016129 0.2016129 0.4032258), wk = 0.0017422 k( 211) = ( 0.1975806 0.1975806 0.3951613), wk = 0.0017422 k( 212) = ( 0.1935484 0.1935484 0.3870968), wk = 0.0017422 k( 213) = ( 0.1895161 0.1895161 0.3790323), wk = 0.0017422 k( 214) = ( 0.1854839 0.1854839 0.3709677), wk = 0.0017422 k( 215) = ( 0.1814516 0.1814516 0.3629032), wk = 0.0017422 k( 216) = ( 0.1774194 0.1774194 0.3548387), wk = 0.0017422 k( 217) = ( 0.1733871 0.1733871 0.3467742), wk = 0.0017422 k( 218) = ( 0.1693548 0.1693548 0.3387097), wk = 0.0017422 k( 219) = ( 0.1653226 0.1653226 0.3306452), wk = 0.0017422 k( 220) = ( 0.1612903 0.1612903 0.3225806), wk = 0.0017422 k( 221) = ( 0.1572581 0.1572581 0.3145161), wk = 0.0017422 k( 222) = ( 0.1532258 0.1532258 0.3064516), wk = 0.0017422 k( 223) = ( 0.1491936 0.1491936 0.2983871), wk = 0.0017422 k( 224) = ( 0.1451613 0.1451613 0.2903226), wk = 0.0017422 k( 225) = ( 0.1411290 0.1411290 0.2822581), wk = 0.0017422 k( 226) = ( 0.1370968 0.1370968 0.2741935), wk = 0.0017422 k( 227) = ( 0.1330645 0.1330645 0.2661290), wk = 0.0017422 k( 228) = ( 0.1290323 0.1290323 0.2580645), wk = 0.0017422 k( 229) = ( 0.1250000 0.1250000 0.2500000), wk = 0.0017422 k( 230) = ( 0.1209677 0.1209677 0.2419355), wk = 0.0017422 k( 231) = ( 0.1169355 0.1169355 0.2338710), wk = 0.0017422 k( 232) = ( 0.1129032 0.1129032 0.2258064), wk = 0.0017422 k( 233) = ( 0.1088710 0.1088710 0.2177419), wk = 0.0017422 k( 234) = ( 0.1048387 0.1048387 0.2096774), wk = 0.0017422 k( 235) = ( 0.1008065 0.1008065 0.2016129), wk = 0.0017422 k( 236) = ( 0.0967742 0.0967742 0.1935484), wk = 0.0017422 k( 237) = ( 0.0927419 0.0927419 0.1854839), wk = 0.0017422 k( 238) = ( 0.0887097 0.0887097 0.1774194), wk = 0.0017422 k( 239) = ( 0.0846774 0.0846774 0.1693548), wk = 0.0017422 k( 240) = ( 0.0806452 0.0806452 0.1612903), wk = 0.0017422 k( 241) = ( 0.0766129 0.0766129 0.1532258), wk = 0.0017422 k( 242) = ( 0.0725806 0.0725806 0.1451613), wk = 0.0017422 k( 243) = ( 0.0685484 0.0685484 0.1370968), wk = 0.0017422 k( 244) = ( 0.0645161 0.0645161 0.1290323), wk = 0.0017422 k( 245) = ( 0.0604839 0.0604839 0.1209677), wk = 0.0017422 k( 246) = ( 0.0564516 0.0564516 0.1129032), wk = 0.0017422 k( 247) = ( 0.0524194 0.0524194 0.1048387), wk = 0.0017422 k( 248) = ( 0.0483871 0.0483871 0.0967742), wk = 0.0017422 k( 249) = ( 0.0443548 0.0443548 0.0887097), wk = 0.0017422 k( 250) = ( 0.0403226 0.0403226 0.0806452), wk = 0.0017422 k( 251) = ( 0.0362903 0.0362903 0.0725806), wk = 0.0017422 k( 252) = ( 0.0322581 0.0322581 0.0645161), wk = 0.0017422 k( 253) = ( 0.0282258 0.0282258 0.0564516), wk = 0.0017422 k( 254) = ( 0.0241936 0.0241936 0.0483871), wk = 0.0017422 k( 255) = ( 0.0201613 0.0201613 0.0403226), wk = 0.0017422 k( 256) = ( 0.0161290 0.0161290 0.0322581), wk = 0.0017422 k( 257) = ( 0.0120968 0.0120968 0.0241935), wk = 0.0017422 k( 258) = ( 0.0080645 0.0080645 0.0161290), wk = 0.0017422 k( 259) = ( 0.0040323 0.0040323 0.0080645), wk = 0.0017422 k( 260) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017422 k( 261) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017422 k( 262) = ( 0.0065790 0.0065790 0.0065789), wk = 0.0017422 k( 263) = ( 0.0131579 0.0131579 0.0131579), wk = 0.0017422 k( 264) = ( 0.0197368 0.0197368 0.0197368), wk = 0.0017422 k( 265) = ( 0.0263158 0.0263158 0.0263158), wk = 0.0017422 k( 266) = ( 0.0328947 0.0328947 0.0328947), wk = 0.0017422 k( 267) = ( 0.0394737 0.0394737 0.0394737), wk = 0.0017422 k( 268) = ( 0.0460526 0.0460526 0.0460526), wk = 0.0017422 k( 269) = ( 0.0526316 0.0526316 0.0526316), wk = 0.0017422 k( 270) = ( 0.0592105 0.0592105 0.0592105), wk = 0.0017422 k( 271) = ( 0.0657895 0.0657895 0.0657895), wk = 0.0017422 k( 272) = ( 0.0723684 0.0723684 0.0723684), wk = 0.0017422 k( 273) = ( 0.0789474 0.0789474 0.0789474), wk = 0.0017422 k( 274) = ( 0.0855263 0.0855263 0.0855263), wk = 0.0017422 k( 275) = ( 0.0921053 0.0921053 0.0921053), wk = 0.0017422 k( 276) = ( 0.0986842 0.0986842 0.0986842), wk = 0.0017422 k( 277) = ( 0.1052632 0.1052632 0.1052632), wk = 0.0017422 k( 278) = ( 0.1118421 0.1118421 0.1118421), wk = 0.0017422 k( 279) = ( 0.1184210 0.1184210 0.1184210), wk = 0.0017422 k( 280) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0017422 k( 281) = ( 0.1315790 0.1315790 0.1315789), wk = 0.0017422 k( 282) = ( 0.1381579 0.1381579 0.1381579), wk = 0.0017422 k( 283) = ( 0.1447368 0.1447368 0.1447368), wk = 0.0017422 k( 284) = ( 0.1513158 0.1513158 0.1513158), wk = 0.0017422 k( 285) = ( 0.1578947 0.1578947 0.1578947), wk = 0.0017422 k( 286) = ( 0.1644737 0.1644737 0.1644737), wk = 0.0017422 k( 287) = ( 0.1710526 0.1710526 0.1710526), wk = 0.0017422 k( 288) = ( 0.1776316 0.1776316 0.1776316), wk = 0.0017422 k( 289) = ( 0.1842105 0.1842105 0.1842105), wk = 0.0017422 k( 290) = ( 0.1907895 0.1907895 0.1907895), wk = 0.0017422 k( 291) = ( 0.1973684 0.1973684 0.1973684), wk = 0.0017422 k( 292) = ( 0.2039474 0.2039474 0.2039474), wk = 0.0017422 k( 293) = ( 0.2105263 0.2105263 0.2105263), wk = 0.0017422 k( 294) = ( 0.2171053 0.2171053 0.2171053), wk = 0.0017422 k( 295) = ( 0.2236842 0.2236842 0.2236842), wk = 0.0017422 k( 296) = ( 0.2302632 0.2302632 0.2302632), wk = 0.0017422 k( 297) = ( 0.2368421 0.2368421 0.2368421), wk = 0.0017422 k( 298) = ( 0.2434210 0.2434210 0.2434210), wk = 0.0017422 k( 299) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0017422 k( 300) = ( 0.2565789 0.2565789 0.2565789), wk = 0.0017422 k( 301) = ( 0.2631579 0.2631579 0.2631579), wk = 0.0017422 k( 302) = ( 0.2697368 0.2697368 0.2697368), wk = 0.0017422 k( 303) = ( 0.2763158 0.2763158 0.2763158), wk = 0.0017422 k( 304) = ( 0.2828947 0.2828947 0.2828947), wk = 0.0017422 k( 305) = ( 0.2894737 0.2894737 0.2894737), wk = 0.0017422 k( 306) = ( 0.2960526 0.2960526 0.2960526), wk = 0.0017422 k( 307) = ( 0.3026316 0.3026316 0.3026316), wk = 0.0017422 k( 308) = ( 0.3092105 0.3092105 0.3092105), wk = 0.0017422 k( 309) = ( 0.3157895 0.3157895 0.3157895), wk = 0.0017422 k( 310) = ( 0.3223684 0.3223684 0.3223684), wk = 0.0017422 k( 311) = ( 0.3289474 0.3289474 0.3289474), wk = 0.0017422 k( 312) = ( 0.3355263 0.3355263 0.3355263), wk = 0.0017422 k( 313) = ( 0.3421053 0.3421053 0.3421053), wk = 0.0017422 k( 314) = ( 0.3486842 0.3486842 0.3486842), wk = 0.0017422 k( 315) = ( 0.3552632 0.3552632 0.3552632), wk = 0.0017422 k( 316) = ( 0.3618421 0.3618421 0.3618421), wk = 0.0017422 k( 317) = ( 0.3684211 0.3684211 0.3684210), wk = 0.0017422 k( 318) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0017422 k( 319) = ( 0.3815789 0.3815789 0.3815789), wk = 0.0017422 k( 320) = ( 0.3881579 0.3881579 0.3881579), wk = 0.0017422 k( 321) = ( 0.3947368 0.3947368 0.3947368), wk = 0.0017422 k( 322) = ( 0.4013158 0.4013158 0.4013158), wk = 0.0017422 k( 323) = ( 0.4078947 0.4078947 0.4078947), wk = 0.0017422 k( 324) = ( 0.4144737 0.4144737 0.4144737), wk = 0.0017422 k( 325) = ( 0.4210526 0.4210526 0.4210526), wk = 0.0017422 k( 326) = ( 0.4276316 0.4276316 0.4276316), wk = 0.0017422 k( 327) = ( 0.4342105 0.4342105 0.4342105), wk = 0.0017422 k( 328) = ( 0.4407895 0.4407895 0.4407895), wk = 0.0017422 k( 329) = ( 0.4473684 0.4473684 0.4473684), wk = 0.0017422 k( 330) = ( 0.4539474 0.4539474 0.4539474), wk = 0.0017422 k( 331) = ( 0.4605263 0.4605263 0.4605263), wk = 0.0017422 k( 332) = ( 0.4671053 0.4671053 0.4671053), wk = 0.0017422 k( 333) = ( 0.4736842 0.4736842 0.4736842), wk = 0.0017422 k( 334) = ( 0.4802632 0.4802632 0.4802632), wk = 0.0017422 k( 335) = ( 0.4868421 0.4868421 0.4868421), wk = 0.0017422 k( 336) = ( 0.4934211 0.4934211 0.4934210), wk = 0.0017422 k( 337) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0017422 k( 338) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0017422 k( 339) = ( 0.5023148 0.4953704 0.5023148), wk = 0.0017422 k( 340) = ( 0.5046296 0.4907407 0.5046296), wk = 0.0017422 k( 341) = ( 0.5069444 0.4861111 0.5069444), wk = 0.0017422 k( 342) = ( 0.5092593 0.4814815 0.5092593), wk = 0.0017422 k( 343) = ( 0.5115741 0.4768518 0.5115741), wk = 0.0017422 k( 344) = ( 0.5138889 0.4722222 0.5138889), wk = 0.0017422 k( 345) = ( 0.5162037 0.4675926 0.5162037), wk = 0.0017422 k( 346) = ( 0.5185185 0.4629630 0.5185185), wk = 0.0017422 k( 347) = ( 0.5208333 0.4583333 0.5208333), wk = 0.0017422 k( 348) = ( 0.5231482 0.4537037 0.5231482), wk = 0.0017422 k( 349) = ( 0.5254630 0.4490741 0.5254630), wk = 0.0017422 k( 350) = ( 0.5277778 0.4444444 0.5277778), wk = 0.0017422 k( 351) = ( 0.5300926 0.4398148 0.5300926), wk = 0.0017422 k( 352) = ( 0.5324074 0.4351852 0.5324074), wk = 0.0017422 k( 353) = ( 0.5347222 0.4305556 0.5347222), wk = 0.0017422 k( 354) = ( 0.5370370 0.4259259 0.5370370), wk = 0.0017422 k( 355) = ( 0.5393518 0.4212963 0.5393518), wk = 0.0017422 k( 356) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0017422 k( 357) = ( 0.5439815 0.4120370 0.5439815), wk = 0.0017422 k( 358) = ( 0.5462963 0.4074074 0.5462963), wk = 0.0017422 k( 359) = ( 0.5486111 0.4027778 0.5486111), wk = 0.0017422 k( 360) = ( 0.5509259 0.3981481 0.5509259), wk = 0.0017422 k( 361) = ( 0.5532407 0.3935185 0.5532407), wk = 0.0017422 k( 362) = ( 0.5555556 0.3888889 0.5555556), wk = 0.0017422 k( 363) = ( 0.5578704 0.3842593 0.5578704), wk = 0.0017422 k( 364) = ( 0.5601852 0.3796296 0.5601852), wk = 0.0017422 k( 365) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0017422 k( 366) = ( 0.5648148 0.3703704 0.5648148), wk = 0.0017422 k( 367) = ( 0.5671296 0.3657407 0.5671296), wk = 0.0017422 k( 368) = ( 0.5694444 0.3611111 0.5694444), wk = 0.0017422 k( 369) = ( 0.5717593 0.3564815 0.5717593), wk = 0.0017422 k( 370) = ( 0.5740741 0.3518519 0.5740741), wk = 0.0017422 k( 371) = ( 0.5763889 0.3472222 0.5763889), wk = 0.0017422 k( 372) = ( 0.5787037 0.3425926 0.5787037), wk = 0.0017422 k( 373) = ( 0.5810185 0.3379630 0.5810185), wk = 0.0017422 k( 374) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0017422 k( 375) = ( 0.5856482 0.3287037 0.5856481), wk = 0.0017422 k( 376) = ( 0.5879630 0.3240741 0.5879630), wk = 0.0017422 k( 377) = ( 0.5902778 0.3194444 0.5902778), wk = 0.0017422 k( 378) = ( 0.5925926 0.3148148 0.5925926), wk = 0.0017422 k( 379) = ( 0.5949074 0.3101852 0.5949074), wk = 0.0017422 k( 380) = ( 0.5972222 0.3055556 0.5972222), wk = 0.0017422 k( 381) = ( 0.5995370 0.3009259 0.5995370), wk = 0.0017422 k( 382) = ( 0.6018518 0.2962963 0.6018518), wk = 0.0017422 k( 383) = ( 0.6041667 0.2916667 0.6041667), wk = 0.0017422 k( 384) = ( 0.6064815 0.2870370 0.6064815), wk = 0.0017422 k( 385) = ( 0.6087963 0.2824074 0.6087963), wk = 0.0017422 k( 386) = ( 0.6111111 0.2777778 0.6111111), wk = 0.0017422 k( 387) = ( 0.6134259 0.2731481 0.6134259), wk = 0.0017422 k( 388) = ( 0.6157407 0.2685185 0.6157407), wk = 0.0017422 k( 389) = ( 0.6180556 0.2638889 0.6180556), wk = 0.0017422 k( 390) = ( 0.6203704 0.2592593 0.6203704), wk = 0.0017422 k( 391) = ( 0.6226852 0.2546296 0.6226852), wk = 0.0017422 k( 392) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0017422 k( 393) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0017422 k( 394) = ( 0.6209677 0.2500000 0.6290323), wk = 0.0017422 k( 395) = ( 0.6169355 0.2500000 0.6330645), wk = 0.0017422 k( 396) = ( 0.6129032 0.2500000 0.6370968), wk = 0.0017422 k( 397) = ( 0.6088710 0.2500000 0.6411290), wk = 0.0017422 k( 398) = ( 0.6048387 0.2500000 0.6451613), wk = 0.0017422 k( 399) = ( 0.6008064 0.2500000 0.6491935), wk = 0.0017422 k( 400) = ( 0.5967742 0.2500000 0.6532258), wk = 0.0017422 k( 401) = ( 0.5927419 0.2500000 0.6572581), wk = 0.0017422 k( 402) = ( 0.5887097 0.2500000 0.6612903), wk = 0.0017422 k( 403) = ( 0.5846774 0.2500000 0.6653226), wk = 0.0017422 k( 404) = ( 0.5806452 0.2500000 0.6693548), wk = 0.0017422 k( 405) = ( 0.5766129 0.2500000 0.6733871), wk = 0.0017422 k( 406) = ( 0.5725807 0.2500000 0.6774193), wk = 0.0017422 k( 407) = ( 0.5685484 0.2500000 0.6814516), wk = 0.0017422 k( 408) = ( 0.5645161 0.2500000 0.6854839), wk = 0.0017422 k( 409) = ( 0.5604839 0.2500000 0.6895161), wk = 0.0017422 k( 410) = ( 0.5564516 0.2500000 0.6935484), wk = 0.0017422 k( 411) = ( 0.5524193 0.2500000 0.6975806), wk = 0.0017422 k( 412) = ( 0.5483871 0.2500000 0.7016129), wk = 0.0017422 k( 413) = ( 0.5443548 0.2500000 0.7056452), wk = 0.0017422 k( 414) = ( 0.5403226 0.2500000 0.7096774), wk = 0.0017422 k( 415) = ( 0.5362903 0.2500000 0.7137097), wk = 0.0017422 k( 416) = ( 0.5322581 0.2500000 0.7177419), wk = 0.0017422 k( 417) = ( 0.5282258 0.2500000 0.7217742), wk = 0.0017422 k( 418) = ( 0.5241936 0.2500000 0.7258064), wk = 0.0017422 k( 419) = ( 0.5201613 0.2500000 0.7298387), wk = 0.0017422 k( 420) = ( 0.5161290 0.2500000 0.7338710), wk = 0.0017422 k( 421) = ( 0.5120968 0.2500000 0.7379032), wk = 0.0017422 k( 422) = ( 0.5080645 0.2500000 0.7419355), wk = 0.0017422 k( 423) = ( 0.5040323 0.2500000 0.7459677), wk = 0.0017422 k( 424) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0017422 k( 425) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0017422 k( 426) = ( 0.5000000 0.2540323 0.7459677), wk = 0.0017422 k( 427) = ( 0.5000000 0.2580645 0.7419355), wk = 0.0017422 k( 428) = ( 0.5000000 0.2620968 0.7379032), wk = 0.0017422 k( 429) = ( 0.5000000 0.2661290 0.7338710), wk = 0.0017422 k( 430) = ( 0.5000000 0.2701613 0.7298387), wk = 0.0017422 k( 431) = ( 0.5000000 0.2741936 0.7258064), wk = 0.0017422 k( 432) = ( 0.5000000 0.2782258 0.7217742), wk = 0.0017422 k( 433) = ( 0.5000000 0.2822581 0.7177419), wk = 0.0017422 k( 434) = ( 0.5000000 0.2862903 0.7137097), wk = 0.0017422 k( 435) = ( 0.5000000 0.2903226 0.7096774), wk = 0.0017422 k( 436) = ( 0.5000000 0.2943548 0.7056452), wk = 0.0017422 k( 437) = ( 0.5000000 0.2983871 0.7016129), wk = 0.0017422 k( 438) = ( 0.5000000 0.3024193 0.6975806), wk = 0.0017422 k( 439) = ( 0.5000000 0.3064516 0.6935484), wk = 0.0017422 k( 440) = ( 0.5000000 0.3104839 0.6895161), wk = 0.0017422 k( 441) = ( 0.5000000 0.3145161 0.6854839), wk = 0.0017422 k( 442) = ( 0.5000000 0.3185484 0.6814516), wk = 0.0017422 k( 443) = ( 0.5000000 0.3225807 0.6774193), wk = 0.0017422 k( 444) = ( 0.5000000 0.3266129 0.6733871), wk = 0.0017422 k( 445) = ( 0.5000000 0.3306452 0.6693548), wk = 0.0017422 k( 446) = ( 0.5000000 0.3346774 0.6653226), wk = 0.0017422 k( 447) = ( 0.5000000 0.3387097 0.6612903), wk = 0.0017422 k( 448) = ( 0.5000000 0.3427419 0.6572581), wk = 0.0017422 k( 449) = ( 0.5000000 0.3467742 0.6532258), wk = 0.0017422 k( 450) = ( 0.5000000 0.3508064 0.6491936), wk = 0.0017422 k( 451) = ( 0.5000000 0.3548387 0.6451613), wk = 0.0017422 k( 452) = ( 0.5000000 0.3588710 0.6411290), wk = 0.0017422 k( 453) = ( 0.5000000 0.3629032 0.6370968), wk = 0.0017422 k( 454) = ( 0.5000000 0.3669355 0.6330645), wk = 0.0017422 k( 455) = ( 0.5000000 0.3709677 0.6290323), wk = 0.0017422 k( 456) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0017422 k( 457) = ( 0.5000000 0.3790323 0.6209677), wk = 0.0017422 k( 458) = ( 0.5000000 0.3830645 0.6169355), wk = 0.0017422 k( 459) = ( 0.5000000 0.3870968 0.6129032), wk = 0.0017422 k( 460) = ( 0.5000000 0.3911290 0.6088710), wk = 0.0017422 k( 461) = ( 0.5000000 0.3951613 0.6048387), wk = 0.0017422 k( 462) = ( 0.5000000 0.3991936 0.6008064), wk = 0.0017422 k( 463) = ( 0.5000000 0.4032258 0.5967742), wk = 0.0017422 k( 464) = ( 0.5000000 0.4072581 0.5927419), wk = 0.0017422 k( 465) = ( 0.5000000 0.4112903 0.5887097), wk = 0.0017422 k( 466) = ( 0.5000000 0.4153226 0.5846774), wk = 0.0017422 k( 467) = ( 0.5000000 0.4193548 0.5806452), wk = 0.0017422 k( 468) = ( 0.5000000 0.4233871 0.5766129), wk = 0.0017422 k( 469) = ( 0.5000000 0.4274193 0.5725807), wk = 0.0017422 k( 470) = ( 0.5000000 0.4314516 0.5685484), wk = 0.0017422 k( 471) = ( 0.5000000 0.4354839 0.5645161), wk = 0.0017422 k( 472) = ( 0.5000000 0.4395161 0.5604839), wk = 0.0017422 k( 473) = ( 0.5000000 0.4435484 0.5564516), wk = 0.0017422 k( 474) = ( 0.5000000 0.4475807 0.5524193), wk = 0.0017422 k( 475) = ( 0.5000000 0.4516129 0.5483871), wk = 0.0017422 k( 476) = ( 0.5000000 0.4556452 0.5443548), wk = 0.0017422 k( 477) = ( 0.5000000 0.4596774 0.5403226), wk = 0.0017422 k( 478) = ( 0.5000000 0.4637097 0.5362903), wk = 0.0017422 k( 479) = ( 0.5000000 0.4677419 0.5322581), wk = 0.0017422 k( 480) = ( 0.5000000 0.4717742 0.5282258), wk = 0.0017422 k( 481) = ( 0.5000000 0.4758064 0.5241936), wk = 0.0017422 k( 482) = ( 0.5000000 0.4798387 0.5201613), wk = 0.0017422 k( 483) = ( 0.5000000 0.4838710 0.5161290), wk = 0.0017422 k( 484) = ( 0.5000000 0.4879032 0.5120968), wk = 0.0017422 k( 485) = ( 0.5000000 0.4919355 0.5080645), wk = 0.0017422 k( 486) = ( 0.5000000 0.4959677 0.5040323), wk = 0.0017422 k( 487) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0017422 k( 488) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0017422 k( 489) = ( 0.4976852 0.4976852 0.5046296), wk = 0.0017422 k( 490) = ( 0.4953704 0.4953704 0.5092593), wk = 0.0017422 k( 491) = ( 0.4930556 0.4930556 0.5138889), wk = 0.0017422 k( 492) = ( 0.4907407 0.4907407 0.5185185), wk = 0.0017422 k( 493) = ( 0.4884259 0.4884259 0.5231482), wk = 0.0017422 k( 494) = ( 0.4861111 0.4861111 0.5277778), wk = 0.0017422 k( 495) = ( 0.4837963 0.4837963 0.5324074), wk = 0.0017422 k( 496) = ( 0.4814815 0.4814815 0.5370370), wk = 0.0017422 k( 497) = ( 0.4791667 0.4791667 0.5416667), wk = 0.0017422 k( 498) = ( 0.4768519 0.4768519 0.5462963), wk = 0.0017422 k( 499) = ( 0.4745370 0.4745370 0.5509259), wk = 0.0017422 k( 500) = ( 0.4722222 0.4722222 0.5555556), wk = 0.0017422 k( 501) = ( 0.4699074 0.4699074 0.5601852), wk = 0.0017422 k( 502) = ( 0.4675926 0.4675926 0.5648148), wk = 0.0017422 k( 503) = ( 0.4652778 0.4652778 0.5694444), wk = 0.0017422 k( 504) = ( 0.4629630 0.4629630 0.5740741), wk = 0.0017422 k( 505) = ( 0.4606481 0.4606481 0.5787037), wk = 0.0017422 k( 506) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0017422 k( 507) = ( 0.4560185 0.4560185 0.5879630), wk = 0.0017422 k( 508) = ( 0.4537037 0.4537037 0.5925926), wk = 0.0017422 k( 509) = ( 0.4513889 0.4513889 0.5972222), wk = 0.0017422 k( 510) = ( 0.4490741 0.4490741 0.6018518), wk = 0.0017422 k( 511) = ( 0.4467593 0.4467593 0.6064815), wk = 0.0017422 k( 512) = ( 0.4444444 0.4444444 0.6111111), wk = 0.0017422 k( 513) = ( 0.4421296 0.4421296 0.6157407), wk = 0.0017422 k( 514) = ( 0.4398148 0.4398148 0.6203704), wk = 0.0017422 k( 515) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0017422 k( 516) = ( 0.4351852 0.4351852 0.6296296), wk = 0.0017422 k( 517) = ( 0.4328704 0.4328704 0.6342593), wk = 0.0017422 k( 518) = ( 0.4305556 0.4305556 0.6388889), wk = 0.0017422 k( 519) = ( 0.4282407 0.4282407 0.6435185), wk = 0.0017422 k( 520) = ( 0.4259259 0.4259259 0.6481481), wk = 0.0017422 k( 521) = ( 0.4236111 0.4236111 0.6527778), wk = 0.0017422 k( 522) = ( 0.4212963 0.4212963 0.6574074), wk = 0.0017422 k( 523) = ( 0.4189815 0.4189815 0.6620370), wk = 0.0017422 k( 524) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0017422 k( 525) = ( 0.4143519 0.4143519 0.6712963), wk = 0.0017422 k( 526) = ( 0.4120370 0.4120370 0.6759259), wk = 0.0017422 k( 527) = ( 0.4097222 0.4097222 0.6805556), wk = 0.0017422 k( 528) = ( 0.4074074 0.4074074 0.6851852), wk = 0.0017422 k( 529) = ( 0.4050926 0.4050926 0.6898148), wk = 0.0017422 k( 530) = ( 0.4027778 0.4027778 0.6944444), wk = 0.0017422 k( 531) = ( 0.4004630 0.4004630 0.6990741), wk = 0.0017422 k( 532) = ( 0.3981481 0.3981481 0.7037037), wk = 0.0017422 k( 533) = ( 0.3958333 0.3958333 0.7083333), wk = 0.0017422 k( 534) = ( 0.3935185 0.3935185 0.7129630), wk = 0.0017422 k( 535) = ( 0.3912037 0.3912037 0.7175926), wk = 0.0017422 k( 536) = ( 0.3888889 0.3888889 0.7222222), wk = 0.0017422 k( 537) = ( 0.3865741 0.3865741 0.7268518), wk = 0.0017422 k( 538) = ( 0.3842593 0.3842593 0.7314815), wk = 0.0017422 k( 539) = ( 0.3819444 0.3819444 0.7361111), wk = 0.0017422 k( 540) = ( 0.3796296 0.3796296 0.7407407), wk = 0.0017422 k( 541) = ( 0.3773148 0.3773148 0.7453704), wk = 0.0017422 k( 542) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0017422 k( 543) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0017422 k( 544) = ( 0.6209677 0.2419355 0.6209677), wk = 0.0017422 k( 545) = ( 0.6169355 0.2338710 0.6169355), wk = 0.0017422 k( 546) = ( 0.6129032 0.2258065 0.6129032), wk = 0.0017422 k( 547) = ( 0.6088710 0.2177419 0.6088710), wk = 0.0017422 k( 548) = ( 0.6048387 0.2096774 0.6048387), wk = 0.0017422 k( 549) = ( 0.6008064 0.2016129 0.6008064), wk = 0.0017422 k( 550) = ( 0.5967742 0.1935484 0.5967742), wk = 0.0017422 k( 551) = ( 0.5927419 0.1854839 0.5927419), wk = 0.0017422 k( 552) = ( 0.5887097 0.1774193 0.5887097), wk = 0.0017422 k( 553) = ( 0.5846774 0.1693548 0.5846774), wk = 0.0017422 k( 554) = ( 0.5806452 0.1612903 0.5806452), wk = 0.0017422 k( 555) = ( 0.5766129 0.1532258 0.5766129), wk = 0.0017422 k( 556) = ( 0.5725807 0.1451613 0.5725807), wk = 0.0017422 k( 557) = ( 0.5685484 0.1370968 0.5685484), wk = 0.0017422 k( 558) = ( 0.5645161 0.1290323 0.5645161), wk = 0.0017422 k( 559) = ( 0.5604839 0.1209677 0.5604839), wk = 0.0017422 k( 560) = ( 0.5564516 0.1129032 0.5564516), wk = 0.0017422 k( 561) = ( 0.5524193 0.1048387 0.5524193), wk = 0.0017422 k( 562) = ( 0.5483871 0.0967742 0.5483871), wk = 0.0017422 k( 563) = ( 0.5443548 0.0887097 0.5443548), wk = 0.0017422 k( 564) = ( 0.5403226 0.0806452 0.5403226), wk = 0.0017422 k( 565) = ( 0.5362903 0.0725806 0.5362903), wk = 0.0017422 k( 566) = ( 0.5322581 0.0645161 0.5322581), wk = 0.0017422 k( 567) = ( 0.5282258 0.0564516 0.5282258), wk = 0.0017422 k( 568) = ( 0.5241936 0.0483871 0.5241936), wk = 0.0017422 k( 569) = ( 0.5201613 0.0403226 0.5201613), wk = 0.0017422 k( 570) = ( 0.5161290 0.0322581 0.5161290), wk = 0.0017422 k( 571) = ( 0.5120968 0.0241935 0.5120968), wk = 0.0017422 k( 572) = ( 0.5080645 0.0161290 0.5080645), wk = 0.0017422 k( 573) = ( 0.5040323 0.0080645 0.5040323), wk = 0.0017422 k( 574) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0017422 Dense grid: 7799 G-vectors FFT dimensions: ( 27, 27, 27) Smooth grid: 2733 G-vectors FFT dimensions: ( 20, 20, 20) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.00 Mb ( 24, 12) NL pseudopotentials 0.00 Mb ( 12, 14) Each V/rho on FFT grid 0.01 Mb ( 729) Each G-vector array 0.00 Mb ( 219) G-vector shells 0.00 Mb ( 95) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.02 Mb ( 24, 48) Each subspace H/S matrix 0.00 Mb ( 12, 12) Each matrix 0.01 Mb ( 14, 2, 12) Check: negative/imaginary core charge= -0.000012 0.000000 The potential is recalculated from file : ./C.save/charge-density.dat Starting wfc are 8 randomized atomic wfcs + 4 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.1 secs Computing kpt #: 2 total cpu time spent up to now is 1.2 secs Computing kpt #: 3 total cpu time spent up to now is 1.2 secs Computing kpt #: 4 total cpu time spent up to now is 1.2 secs Computing kpt #: 5 total cpu time spent up to now is 1.3 secs Computing kpt #: 6 total cpu time spent up to now is 1.3 secs Computing kpt #: 7 total cpu time spent up to now is 1.4 secs Computing kpt #: 8 total cpu time spent up to now is 1.4 secs Computing kpt #: 9 total cpu time spent up to now is 1.4 secs Computing kpt #: 10 total cpu time spent up to now is 1.4 secs Computing kpt #: 11 total cpu time spent up to now is 1.5 secs Computing kpt #: 12 total cpu time spent up to now is 1.5 secs Computing kpt #: 13 total cpu time spent up to now is 1.5 secs Computing kpt #: 14 total cpu time spent up to now is 1.6 secs Computing kpt #: 15 total cpu time spent up to now is 1.6 secs Computing kpt #: 16 total cpu time spent up to now is 1.6 secs Computing kpt #: 17 total cpu time spent up to now is 1.7 secs Computing kpt #: 18 total cpu time spent up to now is 1.7 secs Computing kpt #: 19 total cpu time spent up to now is 1.7 secs Computing kpt #: 20 total cpu time spent up to now is 1.8 secs Computing kpt #: 21 total cpu time spent up to now is 1.8 secs Computing kpt #: 22 total cpu time spent up to now is 1.8 secs Computing kpt #: 23 total cpu time spent up to now is 1.9 secs Computing kpt #: 24 total cpu time spent up to now is 1.9 secs Computing kpt #: 25 total cpu time spent up to now is 1.9 secs Computing kpt #: 26 total cpu time spent up to now is 1.9 secs Computing kpt #: 27 total cpu time spent up to now is 2.0 secs Computing kpt #: 28 total cpu time spent up to now is 2.0 secs Computing kpt #: 29 total cpu time spent up to now is 2.0 secs Computing kpt #: 30 total cpu time spent up to now is 2.1 secs Computing kpt #: 31 total cpu time spent up to now is 2.1 secs Computing kpt #: 32 total cpu time spent up to now is 2.1 secs Computing kpt #: 33 total cpu time spent up to now is 2.2 secs Computing kpt #: 34 total cpu time spent up to now is 2.2 secs Computing kpt #: 35 total cpu time spent up to now is 2.2 secs Computing kpt #: 36 total cpu time spent up to now is 2.2 secs Computing kpt #: 37 total cpu time spent up to now is 2.3 secs Computing kpt #: 38 total cpu time spent up to now is 2.3 secs Computing kpt #: 39 total cpu time spent up to now is 2.3 secs Computing kpt #: 40 total cpu time spent up to now is 2.4 secs Computing kpt #: 41 total cpu time spent up to now is 2.4 secs Computing kpt #: 42 total cpu time spent up to now is 2.4 secs Computing kpt #: 43 total cpu time spent up to now is 2.4 secs Computing kpt #: 44 total cpu time spent up to now is 2.5 secs Computing kpt #: 45 total cpu time spent up to now is 2.5 secs Computing kpt #: 46 total cpu time spent up to now is 2.5 secs Computing kpt #: 47 total cpu time spent up to now is 2.6 secs Computing kpt #: 48 total cpu time spent up to now is 2.6 secs Computing kpt #: 49 total cpu time spent up to now is 2.6 secs Computing kpt #: 50 total cpu time spent up to now is 2.6 secs Computing kpt #: 51 total cpu time spent up to now is 2.7 secs Computing kpt #: 52 total cpu time spent up to now is 2.7 secs Computing kpt #: 53 total cpu time spent up to now is 2.7 secs Computing kpt #: 54 total cpu time spent up to now is 2.8 secs Computing kpt #: 55 total cpu time spent up to now is 2.8 secs Computing kpt #: 56 total cpu time spent up to now is 2.8 secs Computing kpt #: 57 total cpu time spent up to now is 2.8 secs Computing kpt #: 58 total cpu time spent up to now is 2.9 secs Computing kpt #: 59 total cpu time spent up to now is 2.9 secs Computing kpt #: 60 total cpu time spent up to now is 2.9 secs Computing kpt #: 61 total cpu time spent up to now is 3.0 secs Computing kpt #: 62 total cpu time spent up to now is 3.0 secs Computing kpt #: 63 total cpu time spent up to now is 3.0 secs Computing kpt #: 64 total cpu time spent up to now is 3.0 secs Computing kpt #: 65 total cpu time spent up to now is 3.1 secs Computing kpt #: 66 total cpu time spent up to now is 3.1 secs Computing kpt #: 67 total cpu time spent up to now is 3.1 secs Computing kpt #: 68 total cpu time spent up to now is 3.1 secs Computing kpt #: 69 total cpu time spent up to now is 3.2 secs Computing kpt #: 70 total cpu time spent up to now is 3.2 secs Computing kpt #: 71 total cpu time spent up to now is 3.2 secs Computing kpt #: 72 total cpu time spent up to now is 3.3 secs Computing kpt #: 73 total cpu time spent up to now is 3.3 secs Computing kpt #: 74 total cpu time spent up to now is 3.3 secs Computing kpt #: 75 total cpu time spent up to now is 3.3 secs Computing kpt #: 76 total cpu time spent up to now is 3.4 secs Computing kpt #: 77 total cpu time spent up to now is 3.4 secs Computing kpt #: 78 total cpu time spent up to now is 3.4 secs Computing kpt #: 79 total cpu time spent up to now is 3.4 secs Computing kpt #: 80 total cpu time spent up to now is 3.5 secs Computing kpt #: 81 total cpu time spent up to now is 3.5 secs Computing kpt #: 82 total cpu time spent up to now is 3.5 secs Computing kpt #: 83 total cpu time spent up to now is 3.6 secs Computing kpt #: 84 total cpu time spent up to now is 3.6 secs Computing kpt #: 85 total cpu time spent up to now is 3.6 secs Computing kpt #: 86 total cpu time spent up to now is 3.6 secs Computing kpt #: 87 total cpu time spent up to now is 3.7 secs Computing kpt #: 88 total cpu time spent up to now is 3.7 secs Computing kpt #: 89 total cpu time spent up to now is 3.7 secs Computing kpt #: 90 total cpu time spent up to now is 3.7 secs Computing kpt #: 91 total cpu time spent up to now is 3.8 secs Computing kpt #: 92 total cpu time spent up to now is 3.8 secs Computing kpt #: 93 total cpu time spent up to now is 3.8 secs Computing kpt #: 94 total cpu time spent up to now is 3.8 secs Computing kpt #: 95 total cpu time spent up to now is 3.9 secs Computing kpt #: 96 total cpu time spent up to now is 3.9 secs Computing kpt #: 97 total cpu time spent up to now is 3.9 secs Computing kpt #: 98 total cpu time spent up to now is 3.9 secs Computing kpt #: 99 total cpu time spent up to now is 4.0 secs Computing kpt #: 100 total cpu time spent up to now is 4.0 secs Computing kpt #: 101 total cpu time spent up to now is 4.0 secs Computing kpt #: 102 total cpu time spent up to now is 4.0 secs Computing kpt #: 103 total cpu time spent up to now is 4.0 secs Computing kpt #: 104 total cpu time spent up to now is 4.1 secs Computing kpt #: 105 total cpu time spent up to now is 4.1 secs Computing kpt #: 106 total cpu time spent up to now is 4.1 secs Computing kpt #: 107 total cpu time spent up to now is 4.1 secs Computing kpt #: 108 total cpu time spent up to now is 4.2 secs Computing kpt #: 109 total cpu time spent up to now is 4.2 secs Computing kpt #: 110 total cpu time spent up to now is 4.2 secs Computing kpt #: 111 total cpu time spent up to now is 4.2 secs Computing kpt #: 112 total cpu time spent up to now is 4.3 secs Computing kpt #: 113 total cpu time spent up to now is 4.3 secs Computing kpt #: 114 total cpu time spent up to now is 4.7 secs Computing kpt #: 115 total cpu time spent up to now is 4.7 secs Computing kpt #: 116 total cpu time spent up to now is 4.7 secs Computing kpt #: 117 total cpu time spent up to now is 4.8 secs Computing kpt #: 118 total cpu time spent up to now is 4.8 secs Computing kpt #: 119 total cpu time spent up to now is 4.8 secs Computing kpt #: 120 total cpu time spent up to now is 4.8 secs Computing kpt #: 121 total cpu time spent up to now is 4.9 secs Computing kpt #: 122 total cpu time spent up to now is 4.9 secs Computing kpt #: 123 total cpu time spent up to now is 4.9 secs Computing kpt #: 124 total cpu time spent up to now is 4.9 secs Computing kpt #: 125 total cpu time spent up to now is 5.0 secs Computing kpt #: 126 total cpu time spent up to now is 5.0 secs Computing kpt #: 127 total cpu time spent up to now is 5.0 secs Computing kpt #: 128 total cpu time spent up to now is 5.0 secs Computing kpt #: 129 total cpu time spent up to now is 5.1 secs Computing kpt #: 130 total cpu time spent up to now is 5.1 secs Computing kpt #: 131 total cpu time spent up to now is 5.1 secs Computing kpt #: 132 total cpu time spent up to now is 5.2 secs Computing kpt #: 133 total cpu time spent up to now is 5.2 secs Computing kpt #: 134 total cpu time spent up to now is 5.2 secs Computing kpt #: 135 total cpu time spent up to now is 5.4 secs Computing kpt #: 136 total cpu time spent up to now is 5.4 secs Computing kpt #: 137 total cpu time spent up to now is 5.5 secs Computing kpt #: 138 total cpu time spent up to now is 5.5 secs Computing kpt #: 139 total cpu time spent up to now is 5.5 secs Computing kpt #: 140 total cpu time spent up to now is 5.6 secs Computing kpt #: 141 total cpu time spent up to now is 5.6 secs Computing kpt #: 142 total cpu time spent up to now is 5.6 secs Computing kpt #: 143 total cpu time spent up to now is 5.6 secs Computing kpt #: 144 total cpu time spent up to now is 5.7 secs Computing kpt #: 145 total cpu time spent up to now is 5.7 secs Computing kpt #: 146 total cpu time spent up to now is 5.7 secs Computing kpt #: 147 total cpu time spent up to now is 5.7 secs Computing kpt #: 148 total cpu time spent up to now is 5.8 secs Computing kpt #: 149 total cpu time spent up to now is 5.8 secs Computing kpt #: 150 total cpu time spent up to now is 5.8 secs Computing kpt #: 151 total cpu time spent up to now is 5.9 secs Computing kpt #: 152 total cpu time spent up to now is 5.9 secs Computing kpt #: 153 total cpu time spent up to now is 5.9 secs Computing kpt #: 154 total cpu time spent up to now is 5.9 secs Computing kpt #: 155 total cpu time spent up to now is 6.0 secs Computing kpt #: 156 total cpu time spent up to now is 6.0 secs Computing kpt #: 157 total cpu time spent up to now is 6.0 secs Computing kpt #: 158 total cpu time spent up to now is 6.0 secs Computing kpt #: 159 total cpu time spent up to now is 6.1 secs Computing kpt #: 160 total cpu time spent up to now is 6.1 secs Computing kpt #: 161 total cpu time spent up to now is 6.1 secs Computing kpt #: 162 total cpu time spent up to now is 6.1 secs Computing kpt #: 163 total cpu time spent up to now is 6.2 secs Computing kpt #: 164 total cpu time spent up to now is 6.2 secs Computing kpt #: 165 total cpu time spent up to now is 6.2 secs Computing kpt #: 166 total cpu time spent up to now is 6.2 secs Computing kpt #: 167 total cpu time spent up to now is 6.3 secs Computing kpt #: 168 total cpu time spent up to now is 6.3 secs Computing kpt #: 169 total cpu time spent up to now is 6.3 secs Computing kpt #: 170 total cpu time spent up to now is 6.3 secs Computing kpt #: 171 total cpu time spent up to now is 6.4 secs Computing kpt #: 172 total cpu time spent up to now is 6.4 secs Computing kpt #: 173 total cpu time spent up to now is 6.4 secs Computing kpt #: 174 total cpu time spent up to now is 6.5 secs Computing kpt #: 175 total cpu time spent up to now is 6.5 secs Computing kpt #: 176 total cpu time spent up to now is 6.5 secs Computing kpt #: 177 total cpu time spent up to now is 6.5 secs Computing kpt #: 178 total cpu time spent up to now is 6.6 secs Computing kpt #: 179 total cpu time spent up to now is 6.6 secs Computing kpt #: 180 total cpu time spent up to now is 6.6 secs Computing kpt #: 181 total cpu time spent up to now is 6.7 secs Computing kpt #: 182 total cpu time spent up to now is 6.7 secs Computing kpt #: 183 total cpu time spent up to now is 6.7 secs Computing kpt #: 184 total cpu time spent up to now is 6.8 secs Computing kpt #: 185 total cpu time spent up to now is 6.8 secs Computing kpt #: 186 total cpu time spent up to now is 6.8 secs Computing kpt #: 187 total cpu time spent up to now is 6.9 secs Computing kpt #: 188 total cpu time spent up to now is 6.9 secs Computing kpt #: 189 total cpu time spent up to now is 6.9 secs Computing kpt #: 190 total cpu time spent up to now is 7.0 secs Computing kpt #: 191 total cpu time spent up to now is 7.0 secs Computing kpt #: 192 total cpu time spent up to now is 7.0 secs Computing kpt #: 193 total cpu time spent up to now is 7.1 secs Computing kpt #: 194 total cpu time spent up to now is 7.1 secs Computing kpt #: 195 total cpu time spent up to now is 7.1 secs Computing kpt #: 196 total cpu time spent up to now is 7.2 secs Computing kpt #: 197 total cpu time spent up to now is 7.2 secs Computing kpt #: 198 total cpu time spent up to now is 7.2 secs Computing kpt #: 199 total cpu time spent up to now is 7.2 secs Computing kpt #: 200 total cpu time spent up to now is 7.3 secs Computing kpt #: 201 total cpu time spent up to now is 7.3 secs Computing kpt #: 202 total cpu time spent up to now is 7.3 secs Computing kpt #: 203 total cpu time spent up to now is 7.4 secs Computing kpt #: 204 total cpu time spent up to now is 7.4 secs Computing kpt #: 205 total cpu time spent up to now is 7.4 secs Computing kpt #: 206 total cpu time spent up to now is 7.4 secs Computing kpt #: 207 total cpu time spent up to now is 7.5 secs Computing kpt #: 208 total cpu time spent up to now is 7.5 secs Computing kpt #: 209 total cpu time spent up to now is 7.5 secs Computing kpt #: 210 total cpu time spent up to now is 7.6 secs Computing kpt #: 211 total cpu time spent up to now is 7.6 secs Computing kpt #: 212 total cpu time spent up to now is 7.6 secs Computing kpt #: 213 total cpu time spent up to now is 7.7 secs Computing kpt #: 214 total cpu time spent up to now is 7.7 secs Computing kpt #: 215 total cpu time spent up to now is 7.7 secs Computing kpt #: 216 total cpu time spent up to now is 7.8 secs Computing kpt #: 217 total cpu time spent up to now is 7.8 secs Computing kpt #: 218 total cpu time spent up to now is 7.8 secs Computing kpt #: 219 total cpu time spent up to now is 7.8 secs Computing kpt #: 220 total cpu time spent up to now is 7.9 secs Computing kpt #: 221 total cpu time spent up to now is 7.9 secs Computing kpt #: 222 total cpu time spent up to now is 7.9 secs Computing kpt #: 223 total cpu time spent up to now is 8.0 secs Computing kpt #: 224 total cpu time spent up to now is 8.0 secs Computing kpt #: 225 total cpu time spent up to now is 8.0 secs Computing kpt #: 226 total cpu time spent up to now is 8.0 secs Computing kpt #: 227 total cpu time spent up to now is 8.1 secs Computing kpt #: 228 total cpu time spent up to now is 8.1 secs Computing kpt #: 229 total cpu time spent up to now is 8.1 secs Computing kpt #: 230 total cpu time spent up to now is 8.1 secs Computing kpt #: 231 total cpu time spent up to now is 8.2 secs Computing kpt #: 232 total cpu time spent up to now is 8.2 secs Computing kpt #: 233 total cpu time spent up to now is 8.2 secs Computing kpt #: 234 total cpu time spent up to now is 8.2 secs Computing kpt #: 235 total cpu time spent up to now is 8.3 secs Computing kpt #: 236 total cpu time spent up to now is 8.3 secs Computing kpt #: 237 total cpu time spent up to now is 8.3 secs Computing kpt #: 238 total cpu time spent up to now is 8.4 secs Computing kpt #: 239 total cpu time spent up to now is 8.4 secs Computing kpt #: 240 total cpu time spent up to now is 8.4 secs Computing kpt #: 241 total cpu time spent up to now is 8.4 secs Computing kpt #: 242 total cpu time spent up to now is 8.5 secs Computing kpt #: 243 total cpu time spent up to now is 8.5 secs Computing kpt #: 244 total cpu time spent up to now is 8.5 secs Computing kpt #: 245 total cpu time spent up to now is 8.5 secs Computing kpt #: 246 total cpu time spent up to now is 8.6 secs Computing kpt #: 247 total cpu time spent up to now is 8.6 secs Computing kpt #: 248 total cpu time spent up to now is 8.6 secs Computing kpt #: 249 total cpu time spent up to now is 8.7 secs Computing kpt #: 250 total cpu time spent up to now is 8.7 secs Computing kpt #: 251 total cpu time spent up to now is 8.7 secs Computing kpt #: 252 total cpu time spent up to now is 8.8 secs Computing kpt #: 253 total cpu time spent up to now is 8.8 secs Computing kpt #: 254 total cpu time spent up to now is 8.8 secs Computing kpt #: 255 total cpu time spent up to now is 8.9 secs Computing kpt #: 256 total cpu time spent up to now is 8.9 secs Computing kpt #: 257 total cpu time spent up to now is 9.0 secs Computing kpt #: 258 total cpu time spent up to now is 9.0 secs Computing kpt #: 259 total cpu time spent up to now is 9.1 secs Computing kpt #: 260 total cpu time spent up to now is 9.1 secs Computing kpt #: 261 total cpu time spent up to now is 9.1 secs Computing kpt #: 262 total cpu time spent up to now is 9.2 secs Computing kpt #: 263 total cpu time spent up to now is 9.2 secs Computing kpt #: 264 total cpu time spent up to now is 9.2 secs Computing kpt #: 265 total cpu time spent up to now is 9.3 secs Computing kpt #: 266 total cpu time spent up to now is 9.3 secs Computing kpt #: 267 total cpu time spent up to now is 9.4 secs Computing kpt #: 268 total cpu time spent up to now is 9.4 secs Computing kpt #: 269 total cpu time spent up to now is 9.4 secs Computing kpt #: 270 total cpu time spent up to now is 9.5 secs Computing kpt #: 271 total cpu time spent up to now is 9.5 secs Computing kpt #: 272 total cpu time spent up to now is 9.5 secs Computing kpt #: 273 total cpu time spent up to now is 9.6 secs Computing kpt #: 274 total cpu time spent up to now is 9.6 secs Computing kpt #: 275 total cpu time spent up to now is 9.6 secs Computing kpt #: 276 total cpu time spent up to now is 9.7 secs Computing kpt #: 277 total cpu time spent up to now is 9.7 secs Computing kpt #: 278 total cpu time spent up to now is 9.7 secs Computing kpt #: 279 total cpu time spent up to now is 9.7 secs Computing kpt #: 280 total cpu time spent up to now is 9.8 secs Computing kpt #: 281 total cpu time spent up to now is 9.8 secs Computing kpt #: 282 total cpu time spent up to now is 9.8 secs Computing kpt #: 283 total cpu time spent up to now is 9.8 secs Computing kpt #: 284 total cpu time spent up to now is 9.9 secs Computing kpt #: 285 total cpu time spent up to now is 9.9 secs Computing kpt #: 286 total cpu time spent up to now is 9.9 secs Computing kpt #: 287 total cpu time spent up to now is 9.9 secs Computing kpt #: 288 total cpu time spent up to now is 10.0 secs Computing kpt #: 289 total cpu time spent up to now is 10.0 secs Computing kpt #: 290 total cpu time spent up to now is 10.0 secs Computing kpt #: 291 total cpu time spent up to now is 10.0 secs Computing kpt #: 292 total cpu time spent up to now is 10.1 secs Computing kpt #: 293 total cpu time spent up to now is 10.1 secs Computing kpt #: 294 total cpu time spent up to now is 10.1 secs Computing kpt #: 295 total cpu time spent up to now is 10.1 secs Computing kpt #: 296 total cpu time spent up to now is 10.2 secs Computing kpt #: 297 total cpu time spent up to now is 10.2 secs Computing kpt #: 298 total cpu time spent up to now is 10.2 secs Computing kpt #: 299 total cpu time spent up to now is 10.2 secs Computing kpt #: 300 total cpu time spent up to now is 10.3 secs Computing kpt #: 301 total cpu time spent up to now is 10.3 secs Computing kpt #: 302 total cpu time spent up to now is 10.3 secs Computing kpt #: 303 total cpu time spent up to now is 10.3 secs Computing kpt #: 304 total cpu time spent up to now is 10.4 secs Computing kpt #: 305 total cpu time spent up to now is 10.4 secs Computing kpt #: 306 total cpu time spent up to now is 10.4 secs Computing kpt #: 307 total cpu time spent up to now is 10.5 secs Computing kpt #: 308 total cpu time spent up to now is 10.5 secs Computing kpt #: 309 total cpu time spent up to now is 10.5 secs Computing kpt #: 310 total cpu time spent up to now is 10.5 secs Computing kpt #: 311 total cpu time spent up to now is 10.6 secs Computing kpt #: 312 total cpu time spent up to now is 10.6 secs Computing kpt #: 313 total cpu time spent up to now is 10.6 secs Computing kpt #: 314 total cpu time spent up to now is 10.6 secs Computing kpt #: 315 total cpu time spent up to now is 10.7 secs Computing kpt #: 316 total cpu time spent up to now is 10.7 secs Computing kpt #: 317 total cpu time spent up to now is 10.7 secs Computing kpt #: 318 total cpu time spent up to now is 10.8 secs Computing kpt #: 319 total cpu time spent up to now is 10.8 secs Computing kpt #: 320 total cpu time spent up to now is 10.8 secs Computing kpt #: 321 total cpu time spent up to now is 10.9 secs Computing kpt #: 322 total cpu time spent up to now is 10.9 secs Computing kpt #: 323 total cpu time spent up to now is 10.9 secs Computing kpt #: 324 total cpu time spent up to now is 10.9 secs Computing kpt #: 325 total cpu time spent up to now is 11.0 secs Computing kpt #: 326 total cpu time spent up to now is 11.0 secs Computing kpt #: 327 total cpu time spent up to now is 11.0 secs Computing kpt #: 328 total cpu time spent up to now is 11.1 secs Computing kpt #: 329 total cpu time spent up to now is 11.1 secs Computing kpt #: 330 total cpu time spent up to now is 11.1 secs Computing kpt #: 331 total cpu time spent up to now is 11.2 secs Computing kpt #: 332 total cpu time spent up to now is 11.2 secs Computing kpt #: 333 total cpu time spent up to now is 11.2 secs Computing kpt #: 334 total cpu time spent up to now is 11.3 secs Computing kpt #: 335 total cpu time spent up to now is 11.3 secs Computing kpt #: 336 total cpu time spent up to now is 11.3 secs Computing kpt #: 337 total cpu time spent up to now is 11.3 secs Computing kpt #: 338 total cpu time spent up to now is 11.4 secs Computing kpt #: 339 total cpu time spent up to now is 11.4 secs Computing kpt #: 340 total cpu time spent up to now is 11.4 secs Computing kpt #: 341 total cpu time spent up to now is 11.5 secs Computing kpt #: 342 total cpu time spent up to now is 11.5 secs Computing kpt #: 343 total cpu time spent up to now is 11.5 secs Computing kpt #: 344 total cpu time spent up to now is 11.5 secs Computing kpt #: 345 total cpu time spent up to now is 11.6 secs Computing kpt #: 346 total cpu time spent up to now is 11.6 secs Computing kpt #: 347 total cpu time spent up to now is 11.6 secs Computing kpt #: 348 total cpu time spent up to now is 11.7 secs Computing kpt #: 349 total cpu time spent up to now is 11.7 secs Computing kpt #: 350 total cpu time spent up to now is 11.7 secs Computing kpt #: 351 total cpu time spent up to now is 11.7 secs Computing kpt #: 352 total cpu time spent up to now is 11.8 secs Computing kpt #: 353 total cpu time spent up to now is 11.8 secs Computing kpt #: 354 total cpu time spent up to now is 11.8 secs Computing kpt #: 355 total cpu time spent up to now is 11.8 secs Computing kpt #: 356 total cpu time spent up to now is 11.9 secs Computing kpt #: 357 total cpu time spent up to now is 11.9 secs Computing kpt #: 358 total cpu time spent up to now is 11.9 secs Computing kpt #: 359 total cpu time spent up to now is 12.0 secs Computing kpt #: 360 total cpu time spent up to now is 12.0 secs Computing kpt #: 361 total cpu time spent up to now is 12.0 secs Computing kpt #: 362 total cpu time spent up to now is 12.0 secs Computing kpt #: 363 total cpu time spent up to now is 12.1 secs Computing kpt #: 364 total cpu time spent up to now is 12.1 secs Computing kpt #: 365 total cpu time spent up to now is 12.1 secs Computing kpt #: 366 total cpu time spent up to now is 12.1 secs Computing kpt #: 367 total cpu time spent up to now is 12.2 secs Computing kpt #: 368 total cpu time spent up to now is 12.2 secs Computing kpt #: 369 total cpu time spent up to now is 12.2 secs Computing kpt #: 370 total cpu time spent up to now is 12.3 secs Computing kpt #: 371 total cpu time spent up to now is 12.3 secs Computing kpt #: 372 total cpu time spent up to now is 12.3 secs Computing kpt #: 373 total cpu time spent up to now is 12.3 secs Computing kpt #: 374 total cpu time spent up to now is 12.4 secs Computing kpt #: 375 total cpu time spent up to now is 12.4 secs Computing kpt #: 376 total cpu time spent up to now is 12.4 secs Computing kpt #: 377 total cpu time spent up to now is 12.5 secs Computing kpt #: 378 total cpu time spent up to now is 12.5 secs Computing kpt #: 379 total cpu time spent up to now is 12.5 secs Computing kpt #: 380 total cpu time spent up to now is 12.5 secs Computing kpt #: 381 total cpu time spent up to now is 12.6 secs Computing kpt #: 382 total cpu time spent up to now is 12.6 secs Computing kpt #: 383 total cpu time spent up to now is 12.6 secs Computing kpt #: 384 total cpu time spent up to now is 12.7 secs Computing kpt #: 385 total cpu time spent up to now is 12.7 secs Computing kpt #: 386 total cpu time spent up to now is 12.7 secs Computing kpt #: 387 total cpu time spent up to now is 12.7 secs Computing kpt #: 388 total cpu time spent up to now is 12.8 secs Computing kpt #: 389 total cpu time spent up to now is 12.8 secs Computing kpt #: 390 total cpu time spent up to now is 12.8 secs Computing kpt #: 391 total cpu time spent up to now is 12.8 secs Computing kpt #: 392 total cpu time spent up to now is 12.9 secs Computing kpt #: 393 total cpu time spent up to now is 12.9 secs Computing kpt #: 394 total cpu time spent up to now is 12.9 secs Computing kpt #: 395 total cpu time spent up to now is 12.9 secs Computing kpt #: 396 total cpu time spent up to now is 13.0 secs Computing kpt #: 397 total cpu time spent up to now is 13.0 secs Computing kpt #: 398 total cpu time spent up to now is 13.0 secs Computing kpt #: 399 total cpu time spent up to now is 13.0 secs Computing kpt #: 400 total cpu time spent up to now is 13.1 secs Computing kpt #: 401 total cpu time spent up to now is 13.1 secs Computing kpt #: 402 total cpu time spent up to now is 13.1 secs Computing kpt #: 403 total cpu time spent up to now is 13.1 secs Computing kpt #: 404 total cpu time spent up to now is 13.2 secs Computing kpt #: 405 total cpu time spent up to now is 13.2 secs Computing kpt #: 406 total cpu time spent up to now is 13.2 secs Computing kpt #: 407 total cpu time spent up to now is 13.2 secs Computing kpt #: 408 total cpu time spent up to now is 13.3 secs Computing kpt #: 409 total cpu time spent up to now is 13.3 secs Computing kpt #: 410 total cpu time spent up to now is 13.3 secs Computing kpt #: 411 total cpu time spent up to now is 13.4 secs Computing kpt #: 412 total cpu time spent up to now is 13.4 secs Computing kpt #: 413 total cpu time spent up to now is 13.4 secs Computing kpt #: 414 total cpu time spent up to now is 13.4 secs Computing kpt #: 415 total cpu time spent up to now is 13.5 secs Computing kpt #: 416 total cpu time spent up to now is 13.5 secs Computing kpt #: 417 total cpu time spent up to now is 13.5 secs Computing kpt #: 418 total cpu time spent up to now is 13.5 secs Computing kpt #: 419 total cpu time spent up to now is 13.6 secs Computing kpt #: 420 total cpu time spent up to now is 13.6 secs Computing kpt #: 421 total cpu time spent up to now is 13.6 secs Computing kpt #: 422 total cpu time spent up to now is 13.7 secs Computing kpt #: 423 total cpu time spent up to now is 13.7 secs Computing kpt #: 424 total cpu time spent up to now is 13.7 secs Computing kpt #: 425 total cpu time spent up to now is 13.8 secs Computing kpt #: 426 total cpu time spent up to now is 13.8 secs Computing kpt #: 427 total cpu time spent up to now is 13.8 secs Computing kpt #: 428 total cpu time spent up to now is 13.9 secs Computing kpt #: 429 total cpu time spent up to now is 13.9 secs Computing kpt #: 430 total cpu time spent up to now is 13.9 secs Computing kpt #: 431 total cpu time spent up to now is 14.0 secs Computing kpt #: 432 total cpu time spent up to now is 14.0 secs Computing kpt #: 433 total cpu time spent up to now is 14.0 secs Computing kpt #: 434 total cpu time spent up to now is 14.1 secs Computing kpt #: 435 total cpu time spent up to now is 14.1 secs Computing kpt #: 436 total cpu time spent up to now is 14.1 secs Computing kpt #: 437 total cpu time spent up to now is 14.2 secs Computing kpt #: 438 total cpu time spent up to now is 14.2 secs Computing kpt #: 439 total cpu time spent up to now is 14.2 secs Computing kpt #: 440 total cpu time spent up to now is 14.3 secs Computing kpt #: 441 total cpu time spent up to now is 14.3 secs Computing kpt #: 442 total cpu time spent up to now is 14.3 secs Computing kpt #: 443 total cpu time spent up to now is 14.3 secs Computing kpt #: 444 total cpu time spent up to now is 14.4 secs Computing kpt #: 445 total cpu time spent up to now is 14.4 secs Computing kpt #: 446 total cpu time spent up to now is 14.4 secs Computing kpt #: 447 total cpu time spent up to now is 14.5 secs Computing kpt #: 448 total cpu time spent up to now is 14.5 secs Computing kpt #: 449 total cpu time spent up to now is 14.5 secs Computing kpt #: 450 total cpu time spent up to now is 14.5 secs Computing kpt #: 451 total cpu time spent up to now is 14.6 secs Computing kpt #: 452 total cpu time spent up to now is 14.6 secs Computing kpt #: 453 total cpu time spent up to now is 14.6 secs Computing kpt #: 454 total cpu time spent up to now is 14.7 secs Computing kpt #: 455 total cpu time spent up to now is 14.7 secs Computing kpt #: 456 total cpu time spent up to now is 14.7 secs Computing kpt #: 457 total cpu time spent up to now is 14.7 secs Computing kpt #: 458 total cpu time spent up to now is 14.8 secs Computing kpt #: 459 total cpu time spent up to now is 14.8 secs Computing kpt #: 460 total cpu time spent up to now is 14.8 secs Computing kpt #: 461 total cpu time spent up to now is 14.8 secs Computing kpt #: 462 total cpu time spent up to now is 14.9 secs Computing kpt #: 463 total cpu time spent up to now is 14.9 secs Computing kpt #: 464 total cpu time spent up to now is 14.9 secs Computing kpt #: 465 total cpu time spent up to now is 14.9 secs Computing kpt #: 466 total cpu time spent up to now is 15.0 secs Computing kpt #: 467 total cpu time spent up to now is 15.0 secs Computing kpt #: 468 total cpu time spent up to now is 15.0 secs Computing kpt #: 469 total cpu time spent up to now is 15.0 secs Computing kpt #: 470 total cpu time spent up to now is 15.1 secs Computing kpt #: 471 total cpu time spent up to now is 15.1 secs Computing kpt #: 472 total cpu time spent up to now is 15.1 secs Computing kpt #: 473 total cpu time spent up to now is 15.1 secs Computing kpt #: 474 total cpu time spent up to now is 15.2 secs Computing kpt #: 475 total cpu time spent up to now is 15.2 secs Computing kpt #: 476 total cpu time spent up to now is 15.2 secs Computing kpt #: 477 total cpu time spent up to now is 15.3 secs Computing kpt #: 478 total cpu time spent up to now is 15.4 secs Computing kpt #: 479 total cpu time spent up to now is 15.4 secs Computing kpt #: 480 total cpu time spent up to now is 15.5 secs Computing kpt #: 481 total cpu time spent up to now is 15.5 secs Computing kpt #: 482 total cpu time spent up to now is 15.5 secs Computing kpt #: 483 total cpu time spent up to now is 15.6 secs Computing kpt #: 484 total cpu time spent up to now is 15.6 secs Computing kpt #: 485 total cpu time spent up to now is 15.6 secs Computing kpt #: 486 total cpu time spent up to now is 15.6 secs Computing kpt #: 487 total cpu time spent up to now is 15.7 secs Computing kpt #: 488 total cpu time spent up to now is 15.7 secs Computing kpt #: 489 total cpu time spent up to now is 15.7 secs Computing kpt #: 490 total cpu time spent up to now is 15.8 secs Computing kpt #: 491 total cpu time spent up to now is 15.8 secs Computing kpt #: 492 total cpu time spent up to now is 15.8 secs Computing kpt #: 493 total cpu time spent up to now is 15.9 secs Computing kpt #: 494 total cpu time spent up to now is 15.9 secs Computing kpt #: 495 total cpu time spent up to now is 15.9 secs Computing kpt #: 496 total cpu time spent up to now is 15.9 secs Computing kpt #: 497 total cpu time spent up to now is 16.0 secs Computing kpt #: 498 total cpu time spent up to now is 16.0 secs Computing kpt #: 499 total cpu time spent up to now is 16.0 secs Computing kpt #: 500 total cpu time spent up to now is 16.1 secs Computing kpt #: 501 total cpu time spent up to now is 16.1 secs Computing kpt #: 502 total cpu time spent up to now is 16.1 secs Computing kpt #: 503 total cpu time spent up to now is 16.1 secs Computing kpt #: 504 total cpu time spent up to now is 16.2 secs Computing kpt #: 505 total cpu time spent up to now is 16.2 secs Computing kpt #: 506 total cpu time spent up to now is 16.2 secs Computing kpt #: 507 total cpu time spent up to now is 16.2 secs Computing kpt #: 508 total cpu time spent up to now is 16.3 secs Computing kpt #: 509 total cpu time spent up to now is 16.3 secs Computing kpt #: 510 total cpu time spent up to now is 16.3 secs Computing kpt #: 511 total cpu time spent up to now is 16.4 secs Computing kpt #: 512 total cpu time spent up to now is 16.4 secs Computing kpt #: 513 total cpu time spent up to now is 16.4 secs Computing kpt #: 514 total cpu time spent up to now is 16.4 secs Computing kpt #: 515 total cpu time spent up to now is 16.5 secs Computing kpt #: 516 total cpu time spent up to now is 16.5 secs Computing kpt #: 517 total cpu time spent up to now is 16.5 secs Computing kpt #: 518 total cpu time spent up to now is 16.5 secs Computing kpt #: 519 total cpu time spent up to now is 16.6 secs Computing kpt #: 520 total cpu time spent up to now is 16.6 secs Computing kpt #: 521 total cpu time spent up to now is 16.6 secs Computing kpt #: 522 total cpu time spent up to now is 16.7 secs Computing kpt #: 523 total cpu time spent up to now is 16.7 secs Computing kpt #: 524 total cpu time spent up to now is 16.7 secs Computing kpt #: 525 total cpu time spent up to now is 16.7 secs Computing kpt #: 526 total cpu time spent up to now is 16.8 secs Computing kpt #: 527 total cpu time spent up to now is 16.8 secs Computing kpt #: 528 total cpu time spent up to now is 16.8 secs Computing kpt #: 529 total cpu time spent up to now is 16.9 secs Computing kpt #: 530 total cpu time spent up to now is 16.9 secs Computing kpt #: 531 total cpu time spent up to now is 16.9 secs Computing kpt #: 532 total cpu time spent up to now is 17.0 secs Computing kpt #: 533 total cpu time spent up to now is 17.0 secs Computing kpt #: 534 total cpu time spent up to now is 17.0 secs Computing kpt #: 535 total cpu time spent up to now is 17.0 secs Computing kpt #: 536 total cpu time spent up to now is 17.1 secs Computing kpt #: 537 total cpu time spent up to now is 17.1 secs Computing kpt #: 538 total cpu time spent up to now is 17.1 secs Computing kpt #: 539 total cpu time spent up to now is 17.1 secs Computing kpt #: 540 total cpu time spent up to now is 17.2 secs Computing kpt #: 541 total cpu time spent up to now is 17.2 secs Computing kpt #: 542 total cpu time spent up to now is 17.2 secs Computing kpt #: 543 total cpu time spent up to now is 17.2 secs Computing kpt #: 544 total cpu time spent up to now is 17.3 secs Computing kpt #: 545 total cpu time spent up to now is 17.3 secs Computing kpt #: 546 total cpu time spent up to now is 17.3 secs Computing kpt #: 547 total cpu time spent up to now is 17.3 secs Computing kpt #: 548 total cpu time spent up to now is 17.4 secs Computing kpt #: 549 total cpu time spent up to now is 17.4 secs Computing kpt #: 550 total cpu time spent up to now is 17.4 secs Computing kpt #: 551 total cpu time spent up to now is 17.4 secs Computing kpt #: 552 total cpu time spent up to now is 17.5 secs Computing kpt #: 553 total cpu time spent up to now is 17.5 secs Computing kpt #: 554 total cpu time spent up to now is 17.5 secs Computing kpt #: 555 total cpu time spent up to now is 17.5 secs Computing kpt #: 556 total cpu time spent up to now is 17.6 secs Computing kpt #: 557 total cpu time spent up to now is 17.6 secs Computing kpt #: 558 total cpu time spent up to now is 17.6 secs Computing kpt #: 559 total cpu time spent up to now is 17.6 secs Computing kpt #: 560 total cpu time spent up to now is 17.6 secs Computing kpt #: 561 total cpu time spent up to now is 17.7 secs Computing kpt #: 562 total cpu time spent up to now is 17.7 secs Computing kpt #: 563 total cpu time spent up to now is 17.7 secs Computing kpt #: 564 total cpu time spent up to now is 17.7 secs Computing kpt #: 565 total cpu time spent up to now is 17.8 secs Computing kpt #: 566 total cpu time spent up to now is 17.8 secs Computing kpt #: 567 total cpu time spent up to now is 17.8 secs Computing kpt #: 568 total cpu time spent up to now is 17.8 secs Computing kpt #: 569 total cpu time spent up to now is 17.9 secs Computing kpt #: 570 total cpu time spent up to now is 17.9 secs Computing kpt #: 571 total cpu time spent up to now is 17.9 secs Computing kpt #: 572 total cpu time spent up to now is 17.9 secs Computing kpt #: 573 total cpu time spent up to now is 18.0 secs Computing kpt #: 574 total cpu time spent up to now is 18.0 secs ethr = 2.50E-07, avg # of iterations = 9.8 total cpu time spent up to now is 18.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 331 PWs) bands (ev): -9.5173 -9.5173 9.2020 9.2020 9.2178 9.2178 9.2178 9.2178 23.8480 23.8480 28.9380 28.9380 k = 0.0057-0.0033 0.0046 ( 331 PWs) bands (ev): -9.5161 -9.5161 9.2006 9.2006 9.2161 9.2161 9.2165 9.2165 23.8491 23.8491 28.9199 28.9199 k = 0.0114-0.0066 0.0093 ( 335 PWs) bands (ev): -9.5125 -9.5125 9.1959 9.1959 9.2110 9.2110 9.2123 9.2123 23.8524 23.8524 28.8668 28.8668 k = 0.0170-0.0098 0.0139 ( 335 PWs) bands (ev): -9.5065 -9.5065 9.1883 9.1883 9.2031 9.2031 9.2058 9.2058 23.8579 23.8579 28.7824 28.7824 k = 0.0227-0.0131 0.0186 ( 335 PWs) bands (ev): -9.4980 -9.4980 9.1773 9.1773 9.1923 9.1923 9.1966 9.1966 23.8656 23.8656 28.6710 28.6710 k = 0.0284-0.0164 0.0232 ( 335 PWs) bands (ev): -9.4872 -9.4872 9.1627 9.1627 9.1791 9.1791 9.1849 9.1849 23.8752 23.8752 28.5377 28.5377 k = 0.0341-0.0197 0.0278 ( 335 PWs) bands (ev): -9.4739 -9.4739 9.1442 9.1442 9.1636 9.1636 9.1706 9.1706 23.8868 23.8868 28.3871 28.3871 k = 0.0398-0.0230 0.0325 ( 335 PWs) bands (ev): -9.4582 -9.4582 9.1218 9.1218 9.1459 9.1459 9.1538 9.1538 23.9001 23.9001 28.2231 28.2231 k = 0.0455-0.0262 0.0371 ( 335 PWs) bands (ev): -9.4401 -9.4401 9.0957 9.0957 9.1261 9.1261 9.1346 9.1346 23.9150 23.9150 28.0490 28.0490 k = 0.0511-0.0295 0.0418 ( 335 PWs) bands (ev): -9.4197 -9.4197 9.0660 9.0660 9.1040 9.1040 9.1129 9.1129 23.9313 23.9313 27.8675 27.8675 k = 0.0568-0.0328 0.0464 ( 335 PWs) bands (ev): -9.3968 -9.3968 9.0327 9.0327 9.0797 9.0797 9.0889 9.0889 23.9487 23.9487 27.6805 27.6805 k = 0.0625-0.0361 0.0510 ( 335 PWs) bands (ev): -9.3715 -9.3715 8.9960 8.9960 9.0532 9.0532 9.0626 9.0626 23.9670 23.9670 27.4896 27.4896 k = 0.0682-0.0394 0.0557 ( 335 PWs) bands (ev): -9.3438 -9.3438 8.9559 8.9559 9.0245 9.0245 9.0340 9.0340 23.9859 23.9859 27.2962 27.2962 k = 0.0739-0.0426 0.0603 ( 335 PWs) bands (ev): -9.3137 -9.3137 8.9126 8.9126 8.9936 8.9936 9.0032 9.0032 24.0049 24.0049 27.1011 27.1011 k = 0.0795-0.0459 0.0649 ( 335 PWs) bands (ev): -9.2813 -9.2813 8.8659 8.8659 8.9607 8.9607 8.9704 8.9704 24.0238 24.0238 26.9053 26.9053 k = 0.0852-0.0492 0.0696 ( 335 PWs) bands (ev): -9.2464 -9.2464 8.8162 8.8162 8.9257 8.9257 8.9355 8.9355 24.0420 24.0420 26.7093 26.7093 k = 0.0909-0.0525 0.0742 ( 335 PWs) bands (ev): -9.2092 -9.2092 8.7633 8.7633 8.8888 8.8888 8.8986 8.8986 24.0590 24.0590 26.5135 26.5135 k = 0.0966-0.0558 0.0789 ( 335 PWs) bands (ev): -9.1696 -9.1696 8.7073 8.7073 8.8501 8.8501 8.8598 8.8598 24.0744 24.0744 26.3185 26.3185 k = 0.1023-0.0590 0.0835 ( 335 PWs) bands (ev): -9.1276 -9.1276 8.6484 8.6484 8.8095 8.8095 8.8193 8.8193 24.0875 24.0875 26.1245 26.1245 k = 0.1080-0.0623 0.0881 ( 335 PWs) bands (ev): -9.0833 -9.0833 8.5865 8.5865 8.7673 8.7673 8.7771 8.7771 24.0976 24.0976 25.9318 25.9318 k = 0.1136-0.0656 0.0928 ( 339 PWs) bands (ev): -9.0366 -9.0366 8.5212 8.5212 8.7234 8.7234 8.7332 8.7332 24.1039 24.1039 25.7407 25.7407 k = 0.1193-0.0689 0.0974 ( 339 PWs) bands (ev): -8.9875 -8.9875 8.4536 8.4536 8.6780 8.6780 8.6878 8.6878 24.1057 24.1057 25.5513 25.5513 k = 0.1250-0.0722 0.1021 ( 339 PWs) bands (ev): -8.9361 -8.9361 8.3833 8.3833 8.6312 8.6312 8.6409 8.6409 24.1022 24.1022 25.3637 25.3637 k = 0.1307-0.0754 0.1067 ( 339 PWs) bands (ev): -8.8823 -8.8823 8.3102 8.3102 8.5831 8.5831 8.5927 8.5927 24.0923 24.0923 25.1782 25.1782 k = 0.1364-0.0787 0.1113 ( 339 PWs) bands (ev): -8.8262 -8.8262 8.2345 8.2345 8.5336 8.5336 8.5433 8.5433 24.0752 24.0752 24.9948 24.9948 k = 0.1420-0.0820 0.1160 ( 339 PWs) bands (ev): -8.7678 -8.7678 8.1563 8.1563 8.4830 8.4830 8.4926 8.4926 24.0498 24.0498 24.8136 24.8136 k = 0.1477-0.0853 0.1206 ( 339 PWs) bands (ev): -8.7071 -8.7071 8.0754 8.0754 8.4314 8.4314 8.4409 8.4409 24.0152 24.0152 24.6347 24.6347 k = 0.1534-0.0886 0.1253 ( 339 PWs) bands (ev): -8.6440 -8.6440 7.9921 7.9921 8.3787 8.3787 8.3883 8.3883 23.9704 23.9704 24.4582 24.4582 k = 0.1591-0.0919 0.1299 ( 335 PWs) bands (ev): -8.5786 -8.5786 7.9066 7.9066 8.3252 8.3252 8.3347 8.3347 23.9146 23.9146 24.2842 24.2842 k = 0.1648-0.0951 0.1345 ( 343 PWs) bands (ev): -8.5110 -8.5110 7.8178 7.8178 8.2705 8.2705 8.2800 8.2800 23.8468 23.8468 24.1126 24.1126 k = 0.1705-0.0984 0.1392 ( 343 PWs) bands (ev): -8.4411 -8.4411 7.7272 7.7272 8.2155 8.2155 8.2249 8.2249 23.7669 23.7669 23.9436 23.9436 k = 0.1761-0.1017 0.1438 ( 343 PWs) bands (ev): -8.3689 -8.3689 7.6343 7.6343 8.1598 8.1598 8.1692 8.1692 23.6744 23.6744 23.7771 23.7771 k = 0.1818-0.1050 0.1485 ( 347 PWs) bands (ev): -8.2944 -8.2944 7.5387 7.5387 8.1035 8.1035 8.1128 8.1128 23.5691 23.5691 23.6133 23.6133 k = 0.1875-0.1083 0.1531 ( 347 PWs) bands (ev): -8.2177 -8.2177 7.4412 7.4412 8.0468 8.0468 8.0561 8.0561 23.4515 23.4515 23.4521 23.4521 k = 0.1932-0.1115 0.1577 ( 347 PWs) bands (ev): -8.1387 -8.1387 7.3415 7.3415 7.9897 7.9897 7.9990 7.9990 23.2936 23.2936 23.3219 23.3219 k = 0.1989-0.1148 0.1624 ( 347 PWs) bands (ev): -8.0575 -8.0575 7.2396 7.2396 7.9324 7.9324 7.9416 7.9416 23.1378 23.1378 23.1812 23.1812 k = 0.2045-0.1181 0.1670 ( 347 PWs) bands (ev): -7.9741 -7.9741 7.1355 7.1355 7.8749 7.8749 7.8840 7.8840 22.9848 22.9848 23.0302 23.0302 k = 0.2102-0.1214 0.1716 ( 347 PWs) bands (ev): -7.8885 -7.8885 7.0293 7.0293 7.8172 7.8172 7.8263 7.8263 22.8344 22.8344 22.8699 22.8699 k = 0.2159-0.1247 0.1763 ( 347 PWs) bands (ev): -7.8007 -7.8007 6.9210 6.9210 7.7595 7.7595 7.7686 7.7686 22.6869 22.6869 22.7016 22.7016 k = 0.2216-0.1279 0.1809 ( 347 PWs) bands (ev): -7.7108 -7.7108 6.8107 6.8107 7.7019 7.7019 7.7109 7.7109 22.5262 22.5262 22.5421 22.5421 k = 0.2273-0.1312 0.1856 ( 347 PWs) bands (ev): -7.6187 -7.6187 6.6982 6.6982 7.6443 7.6443 7.6533 7.6533 22.3451 22.3451 22.4002 22.4002 k = 0.2330-0.1345 0.1902 ( 347 PWs) bands (ev): -7.5245 -7.5245 6.5838 6.5838 7.5869 7.5869 7.5958 7.5958 22.1593 22.1593 22.2610 22.2610 k = 0.2386-0.1378 0.1948 ( 343 PWs) bands (ev): -7.4281 -7.4281 6.4674 6.4674 7.5298 7.5298 7.5387 7.5387 21.9698 21.9698 22.1247 22.1247 k = 0.2443-0.1411 0.1995 ( 343 PWs) bands (ev): -7.3296 -7.3296 6.3489 6.3489 7.4730 7.4730 7.4818 7.4818 21.7777 21.7777 21.9912 21.9912 k = 0.2500-0.1443 0.2041 ( 343 PWs) bands (ev): -7.2291 -7.2291 6.2285 6.2285 7.4166 7.4166 7.4254 7.4254 21.5839 21.5839 21.8606 21.8606 k = 0.2557-0.1476 0.2088 ( 343 PWs) bands (ev): -7.1265 -7.1265 6.1061 6.1061 7.3606 7.3606 7.3693 7.3693 21.3891 21.3891 21.7328 21.7328 k = 0.2614-0.1509 0.2134 ( 343 PWs) bands (ev): -7.0219 -7.0219 5.9818 5.9818 7.3051 7.3051 7.3138 7.3138 21.1942 21.1942 21.6079 21.6079 k = 0.2670-0.1542 0.2180 ( 343 PWs) bands (ev): -6.9153 -6.9153 5.8556 5.8556 7.2501 7.2501 7.2588 7.2588 20.9998 20.9998 21.4858 21.4858 k = 0.2727-0.1575 0.2227 ( 343 PWs) bands (ev): -6.8067 -6.8067 5.7275 5.7275 7.1958 7.1958 7.2045 7.2045 20.8064 20.8064 21.3667 21.3667 k = 0.2784-0.1607 0.2273 ( 347 PWs) bands (ev): -6.6962 -6.6962 5.5974 5.5974 7.1420 7.1420 7.1506 7.1506 20.6147 20.6147 21.2504 21.2504 k = 0.2841-0.1640 0.2320 ( 347 PWs) bands (ev): -6.5837 -6.5837 5.4657 5.4657 7.0891 7.0891 7.0977 7.0977 20.4250 20.4250 21.1370 21.1370 k = 0.2898-0.1673 0.2366 ( 347 PWs) bands (ev): -6.4694 -6.4694 5.3322 5.3322 7.0370 7.0370 7.0456 7.0456 20.2379 20.2379 21.0265 21.0265 k = 0.2955-0.1706 0.2412 ( 347 PWs) bands (ev): -6.3532 -6.3532 5.1969 5.1969 6.9858 6.9858 6.9943 6.9943 20.0536 20.0536 20.9189 20.9189 k = 0.3011-0.1739 0.2459 ( 347 PWs) bands (ev): -6.2351 -6.2351 5.0600 5.0600 6.9354 6.9354 6.9439 6.9439 19.8725 19.8725 20.8143 20.8143 k = 0.3068-0.1771 0.2505 ( 347 PWs) bands (ev): -6.1153 -6.1153 4.9214 4.9214 6.8860 6.8860 6.8944 6.8944 19.6950 19.6950 20.7125 20.7125 k = 0.3125-0.1804 0.2552 ( 343 PWs) bands (ev): -5.9937 -5.9937 4.7814 4.7814 6.8375 6.8375 6.8459 6.8459 19.5212 19.5212 20.6136 20.6136 k = 0.3182-0.1837 0.2598 ( 343 PWs) bands (ev): -5.8704 -5.8704 4.6396 4.6396 6.7901 6.7901 6.7984 6.7984 19.3514 19.3514 20.5177 20.5177 k = 0.3239-0.1870 0.2644 ( 343 PWs) bands (ev): -5.7455 -5.7455 4.4964 4.4964 6.7437 6.7437 6.7520 6.7520 19.1858 19.1858 20.4247 20.4247 k = 0.3295-0.1903 0.2691 ( 343 PWs) bands (ev): -5.6190 -5.6190 4.3517 4.3517 6.6984 6.6984 6.7067 6.7067 19.0247 19.0247 20.3346 20.3346 k = 0.3352-0.1935 0.2737 ( 343 PWs) bands (ev): -5.4909 -5.4909 4.2057 4.2057 6.6543 6.6543 6.6626 6.6626 18.8680 18.8680 20.2475 20.2475 k = 0.3409-0.1968 0.2784 ( 343 PWs) bands (ev): -5.3613 -5.3613 4.0584 4.0584 6.6114 6.6114 6.6196 6.6196 18.7160 18.7160 20.1633 20.1633 k = 0.3466-0.2001 0.2830 ( 343 PWs) bands (ev): -5.2304 -5.2304 3.9099 3.9099 6.5696 6.5696 6.5778 6.5778 18.5689 18.5689 20.0820 20.0820 k = 0.3523-0.2034 0.2876 ( 343 PWs) bands (ev): -5.0980 -5.0980 3.7604 3.7604 6.5291 6.5291 6.5373 6.5373 18.4266 18.4266 20.0037 20.0037 k = 0.3580-0.2067 0.2923 ( 343 PWs) bands (ev): -4.9644 -4.9644 3.6098 3.6098 6.4899 6.4899 6.4981 6.4981 18.2894 18.2894 19.9283 19.9283 k = 0.3636-0.2099 0.2969 ( 343 PWs) bands (ev): -4.8296 -4.8296 3.4580 3.4580 6.4521 6.4521 6.4602 6.4602 18.1572 18.1572 19.8559 19.8559 k = 0.3693-0.2132 0.3015 ( 343 PWs) bands (ev): -4.6937 -4.6937 3.3058 3.3058 6.4155 6.4155 6.4236 6.4236 18.0302 18.0302 19.7864 19.7864 k = 0.3750-0.2165 0.3062 ( 343 PWs) bands (ev): -4.5569 -4.5569 3.1530 3.1530 6.3803 6.3803 6.3884 6.3884 17.9084 17.9084 19.7198 19.7198 k = 0.3807-0.2198 0.3108 ( 343 PWs) bands (ev): -4.4192 -4.4192 2.9997 2.9997 6.3464 6.3464 6.3545 6.3545 17.7919 17.7919 19.6562 19.6562 k = 0.3864-0.2231 0.3155 ( 343 PWs) bands (ev): -4.2808 -4.2808 2.8461 2.8461 6.3140 6.3140 6.3221 6.3221 17.6807 17.6807 19.5955 19.5955 k = 0.3920-0.2263 0.3201 ( 343 PWs) bands (ev): -4.1418 -4.1418 2.6925 2.6925 6.2831 6.2831 6.2911 6.2911 17.5748 17.5748 19.5378 19.5378 k = 0.3977-0.2296 0.3247 ( 343 PWs) bands (ev): -4.0025 -4.0025 2.5390 2.5390 6.2535 6.2535 6.2615 6.2615 17.4744 17.4744 19.4830 19.4830 k = 0.4034-0.2329 0.3294 ( 343 PWs) bands (ev): -3.8630 -3.8630 2.3858 2.3858 6.2255 6.2255 6.2335 6.2335 17.3793 17.3793 19.4312 19.4312 k = 0.4091-0.2362 0.3340 ( 335 PWs) bands (ev): -3.7235 -3.7235 2.2334 2.2334 6.1993 6.1993 6.2073 6.2073 17.2897 17.2897 19.3824 19.3824 k = 0.4148-0.2395 0.3387 ( 335 PWs) bands (ev): -3.5845 -3.5845 2.0818 2.0818 6.1743 6.1743 6.1822 6.1822 17.2054 17.2054 19.3365 19.3365 k = 0.4205-0.2427 0.3433 ( 335 PWs) bands (ev): -3.4462 -3.4462 1.9317 1.9317 6.1508 6.1508 6.1587 6.1587 17.1266 17.1266 19.2936 19.2936 k = 0.4261-0.2460 0.3479 ( 343 PWs) bands (ev): -3.3091 -3.3091 1.7827 1.7827 6.1288 6.1288 6.1367 6.1367 17.0531 17.0531 19.2536 19.2536 k = 0.4318-0.2493 0.3526 ( 343 PWs) bands (ev): -3.1736 -3.1736 1.6367 1.6367 6.1084 6.1084 6.1163 6.1163 16.9852 16.9852 19.2166 19.2166 k = 0.4375-0.2526 0.3572 ( 343 PWs) bands (ev): -3.0403 -3.0403 1.4936 1.4936 6.0896 6.0896 6.0975 6.0975 16.9228 16.9228 19.1825 19.1825 k = 0.4432-0.2559 0.3619 ( 343 PWs) bands (ev): -2.9100 -2.9100 1.3542 1.3542 6.0724 6.0724 6.0803 6.0803 16.8657 16.8657 19.1514 19.1514 k = 0.4489-0.2592 0.3665 ( 343 PWs) bands (ev): -2.7837 -2.7837 1.2195 1.2195 6.0568 6.0568 6.0647 6.0647 16.8142 16.8142 19.1233 19.1233 k = 0.4545-0.2624 0.3711 ( 343 PWs) bands (ev): -2.6623 -2.6623 1.0906 1.0906 6.0428 6.0428 6.0507 6.0507 16.7680 16.7680 19.0981 19.0981 k = 0.4602-0.2657 0.3758 ( 342 PWs) bands (ev): -2.5473 -2.5473 0.9690 0.9690 6.0305 6.0305 6.0384 6.0384 16.7274 16.7274 19.0759 19.0759 k = 0.4659-0.2690 0.3804 ( 342 PWs) bands (ev): -2.4403 -2.4403 0.8562 0.8562 6.0198 6.0198 6.0276 6.0276 16.6921 16.6921 19.0566 19.0566 k = 0.4716-0.2723 0.3851 ( 342 PWs) bands (ev): -2.3435 -2.3435 0.7544 0.7544 6.0107 6.0107 6.0185 6.0185 16.6623 16.6623 19.0403 19.0403 k = 0.4773-0.2756 0.3897 ( 342 PWs) bands (ev): -2.2589 -2.2589 0.6658 0.6658 6.0032 6.0032 6.0111 6.0111 16.6379 16.6379 19.0270 19.0270 k = 0.4830-0.2788 0.3943 ( 342 PWs) bands (ev): -2.1893 -2.1893 0.5930 0.5930 5.9974 5.9974 6.0053 6.0053 16.6189 16.6189 19.0166 19.0166 k = 0.4886-0.2821 0.3990 ( 342 PWs) bands (ev): -2.1372 -2.1372 0.5386 0.5386 5.9933 5.9933 6.0011 6.0011 16.6054 16.6054 19.0092 19.0092 k = 0.4943-0.2854 0.4036 ( 342 PWs) bands (ev): -2.1048 -2.1048 0.5048 0.5048 5.9908 5.9908 5.9987 5.9987 16.5973 16.5973 19.0047 19.0047 k = 0.5000-0.2887 0.4082 ( 342 PWs) bands (ev): -2.0939 -2.0939 0.4934 0.4934 5.9900 5.9900 5.9978 5.9978 16.5946 16.5946 19.0033 19.0033 k = 0.5000-0.2887 0.4082 ( 342 PWs) bands (ev): -2.0939 -2.0939 0.4934 0.4934 5.9900 5.9900 5.9978 5.9978 16.5946 16.5946 19.0033 19.0033 k = 0.5000-0.2821 0.4129 ( 342 PWs) bands (ev): -2.0935 -2.0935 0.4946 0.4946 5.9875 5.9875 5.9954 5.9954 16.5982 16.5982 19.0082 19.0082 k = 0.5000-0.2756 0.4175 ( 342 PWs) bands (ev): -2.0923 -2.0923 0.4981 0.4981 5.9795 5.9795 5.9887 5.9887 16.6093 16.6093 19.0232 19.0232 k = 0.5000-0.2690 0.4222 ( 342 PWs) bands (ev): -2.0904 -2.0904 0.5039 0.5039 5.9652 5.9652 5.9785 5.9785 16.6276 16.6276 19.0480 19.0480 k = 0.5000-0.2624 0.4268 ( 342 PWs) bands (ev): -2.0878 -2.0878 0.5121 0.5121 5.9445 5.9445 5.9651 5.9651 16.6531 16.6531 19.0826 19.0826 k = 0.5000-0.2559 0.4314 ( 342 PWs) bands (ev): -2.0844 -2.0844 0.5226 0.5226 5.9178 5.9178 5.9485 5.9485 16.6858 16.6858 19.1268 19.1268 k = 0.5000-0.2493 0.4361 ( 342 PWs) bands (ev): -2.0802 -2.0802 0.5354 0.5354 5.8851 5.8851 5.9286 5.9286 16.7254 16.7254 19.1806 19.1806 k = 0.5000-0.2427 0.4407 ( 342 PWs) bands (ev): -2.0754 -2.0754 0.5505 0.5505 5.8469 5.8469 5.9055 5.9055 16.7717 16.7717 19.2437 19.2437 k = 0.5000-0.2362 0.4454 ( 342 PWs) bands (ev): -2.0698 -2.0698 0.5680 0.5680 5.8033 5.8033 5.8794 5.8794 16.8246 16.8246 19.3160 19.3160 k = 0.5000-0.2296 0.4500 ( 346 PWs) bands (ev): -2.0636 -2.0636 0.5877 0.5877 5.7545 5.7545 5.8500 5.8500 16.8839 16.8839 19.3970 19.3970 k = 0.5000-0.2231 0.4546 ( 346 PWs) bands (ev): -2.0567 -2.0567 0.6098 0.6098 5.7008 5.7008 5.8182 5.8182 16.9492 16.9492 19.4868 19.4868 k = 0.5000-0.2165 0.4593 ( 346 PWs) bands (ev): -2.0492 -2.0492 0.6342 0.6342 5.6424 5.6424 5.7839 5.7839 17.0203 17.0203 19.5849 19.5849 k = 0.5000-0.2099 0.4639 ( 346 PWs) bands (ev): -2.0411 -2.0411 0.6609 0.6609 5.5796 5.5796 5.7474 5.7474 17.0970 17.0970 19.6910 19.6910 k = 0.5000-0.2034 0.4686 ( 346 PWs) bands (ev): -2.0325 -2.0325 0.6898 0.6898 5.5126 5.5126 5.7087 5.7087 17.1788 17.1788 19.8049 19.8049 k = 0.5000-0.1968 0.4732 ( 348 PWs) bands (ev): -2.0233 -2.0233 0.7211 0.7211 5.4417 5.4417 5.6681 5.6681 17.2654 17.2654 19.9263 19.9263 k = 0.5000-0.1903 0.4778 ( 348 PWs) bands (ev): -2.0136 -2.0136 0.7546 0.7546 5.3672 5.3672 5.6260 5.6260 17.3565 17.3565 20.0547 20.0547 k = 0.5000-0.1837 0.4825 ( 348 PWs) bands (ev): -2.0035 -2.0035 0.7903 0.7903 5.2893 5.2893 5.5826 5.5826 17.4517 17.4517 20.1900 20.1900 k = 0.5000-0.1771 0.4871 ( 348 PWs) bands (ev): -1.9930 -1.9930 0.8283 0.8283 5.2084 5.2084 5.5381 5.5381 17.5507 17.5507 20.3318 20.3318 k = 0.5000-0.1706 0.4918 ( 348 PWs) bands (ev): -1.9821 -1.9821 0.8686 0.8686 5.1246 5.1246 5.4927 5.4927 17.6529 17.6529 20.4798 20.4798 k = 0.5000-0.1640 0.4964 ( 348 PWs) bands (ev): -1.9709 -1.9709 0.9110 0.9110 5.0382 5.0382 5.4467 5.4467 17.7581 17.7581 20.6336 20.6336 k = 0.5000-0.1575 0.5010 ( 354 PWs) bands (ev): -1.9595 -1.9595 0.9556 0.9556 4.9493 4.9493 5.4000 5.4000 17.8657 17.8657 20.7929 20.7929 k = 0.5000-0.1509 0.5057 ( 352 PWs) bands (ev): -1.9479 -1.9479 1.0025 1.0025 4.8585 4.8585 5.3536 5.3536 17.9755 17.9755 20.9574 20.9574 k = 0.5000-0.1443 0.5103 ( 352 PWs) bands (ev): -1.9361 -1.9361 1.0515 1.0515 4.7659 4.7659 5.3071 5.3071 18.0867 18.0867 21.1268 21.1268 k = 0.5000-0.1378 0.5149 ( 352 PWs) bands (ev): -1.9243 -1.9243 1.1027 1.1027 4.6716 4.6716 5.2610 5.2610 18.1990 18.1990 21.3008 21.3008 k = 0.5000-0.1312 0.5196 ( 352 PWs) bands (ev): -1.9124 -1.9124 1.1560 1.1560 4.5760 4.5760 5.2153 5.2153 18.3119 18.3119 21.4791 21.4791 k = 0.5000-0.1247 0.5242 ( 352 PWs) bands (ev): -1.9005 -1.9005 1.2114 1.2114 4.4792 4.4792 5.1705 5.1705 18.4248 18.4248 21.6614 21.6614 k = 0.5000-0.1181 0.5289 ( 352 PWs) bands (ev): -1.8888 -1.8888 1.2689 1.2689 4.3814 4.3814 5.1266 5.1266 18.5373 18.5373 21.8474 21.8474 k = 0.5000-0.1115 0.5335 ( 352 PWs) bands (ev): -1.8771 -1.8771 1.3287 1.3287 4.2826 4.2826 5.0839 5.0839 18.6488 18.6488 22.0367 22.0367 k = 0.5000-0.1050 0.5381 ( 352 PWs) bands (ev): -1.8658 -1.8658 1.3903 1.3903 4.1833 4.1833 5.0424 5.0424 18.7587 18.7587 22.2292 22.2292 k = 0.5000-0.0984 0.5428 ( 352 PWs) bands (ev): -1.8547 -1.8547 1.4539 1.4539 4.0837 4.0837 5.0026 5.0026 18.8664 18.8664 22.4244 22.4244 k = 0.5000-0.0919 0.5474 ( 352 PWs) bands (ev): -1.8439 -1.8439 1.5196 1.5196 3.9838 3.9838 4.9644 4.9644 18.9713 18.9713 22.6222 22.6222 k = 0.5000-0.0853 0.5521 ( 348 PWs) bands (ev): -1.8336 -1.8336 1.5873 1.5873 3.8837 3.8837 4.9282 4.9282 19.0729 19.0729 22.8224 22.8224 k = 0.5000-0.0787 0.5567 ( 348 PWs) bands (ev): -1.8237 -1.8237 1.6569 1.6569 3.7837 3.7837 4.8939 4.8939 19.1703 19.1703 23.0244 23.0244 k = 0.5000-0.0722 0.5613 ( 348 PWs) bands (ev): -1.8144 -1.8144 1.7283 1.7283 3.6838 3.6838 4.8618 4.8618 19.2632 19.2632 23.2281 23.2281 k = 0.5000-0.0656 0.5660 ( 352 PWs) bands (ev): -1.8057 -1.8057 1.8015 1.8015 3.5841 3.5841 4.8320 4.8320 19.3507 19.3507 23.4333 23.4333 k = 0.5000-0.0590 0.5706 ( 352 PWs) bands (ev): -1.7976 -1.7976 1.8767 1.8767 3.4849 3.4849 4.8046 4.8046 19.4323 19.4323 23.6397 23.6397 k = 0.5000-0.0525 0.5753 ( 352 PWs) bands (ev): -1.7903 -1.7903 1.9536 1.9536 3.3863 3.3863 4.7798 4.7798 19.5073 19.5073 23.8469 23.8469 k = 0.5000-0.0459 0.5799 ( 352 PWs) bands (ev): -1.7836 -1.7836 2.0323 2.0323 3.2883 3.2883 4.7577 4.7577 19.5751 19.5751 24.0548 24.0548 k = 0.5000-0.0394 0.5845 ( 352 PWs) bands (ev): -1.7778 -1.7778 2.1127 2.1127 3.1910 3.1910 4.7383 4.7383 19.6352 19.6352 24.2631 24.2631 k = 0.5000-0.0328 0.5892 ( 356 PWs) bands (ev): -1.7728 -1.7728 2.1947 2.1947 3.0945 3.0945 4.7215 4.7215 19.6870 19.6870 24.4714 24.4714 k = 0.5000-0.0262 0.5938 ( 360 PWs) bands (ev): -1.7687 -1.7687 2.2784 2.2784 2.9990 2.9990 4.7076 4.7076 19.7299 19.7299 24.6797 24.6797 k = 0.5000-0.0197 0.5985 ( 360 PWs) bands (ev): -1.7654 -1.7654 2.3636 2.3636 2.9045 2.9045 4.6970 4.6970 19.7639 19.7639 24.8875 24.8875 k = 0.5000-0.0131 0.6031 ( 360 PWs) bands (ev): -1.7631 -1.7631 2.4503 2.4503 2.8112 2.8112 4.6893 4.6893 19.7884 19.7884 25.0946 25.0946 k = 0.5000-0.0066 0.6077 ( 360 PWs) bands (ev): -1.7617 -1.7617 2.5385 2.5385 2.7191 2.7191 4.6847 4.6847 19.8032 19.8032 25.3009 25.3009 k = 0.5000 0.0000 0.6124 ( 360 PWs) bands (ev): -1.7612 -1.7612 2.6254 2.6254 2.6308 2.6308 4.6832 4.6832 19.8081 19.8081 25.5032 25.5032 k = 0.5000 0.0000 0.6124 ( 360 PWs) bands (ev): -1.7612 -1.7612 2.6254 2.6254 2.6308 2.6308 4.6832 4.6832 19.8081 19.8081 25.5032 25.5032 k = 0.4960 0.0070 0.6124 ( 360 PWs) bands (ev): -1.7629 -1.7629 2.5649 2.5649 2.6908 2.6908 4.6875 4.6875 19.8060 19.8060 25.3606 25.3606 k = 0.4919 0.0140 0.6124 ( 360 PWs) bands (ev): -1.7675 -1.7675 2.5035 2.5035 2.7498 2.7498 4.7011 4.7011 19.7995 19.7995 25.2152 25.2152 k = 0.4879 0.0210 0.6124 ( 360 PWs) bands (ev): -1.7747 -1.7747 2.4440 2.4440 2.8039 2.8039 4.7246 4.7246 19.7884 19.7884 25.0705 25.0705 k = 0.4839 0.0279 0.6124 ( 360 PWs) bands (ev): -1.7842 -1.7842 2.3863 2.3863 2.8521 2.8521 4.7584 4.7584 19.7726 19.7726 24.9272 24.9272 k = 0.4798 0.0349 0.6124 ( 358 PWs) bands (ev): -1.7954 -1.7954 2.3305 2.3305 2.8938 2.8938 4.8029 4.8029 19.7517 19.7517 24.7861 24.7861 k = 0.4758 0.0419 0.6124 ( 352 PWs) bands (ev): -1.8082 -1.8082 2.2766 2.2766 2.9286 2.9286 4.8577 4.8577 19.7258 19.7258 24.6478 24.6478 k = 0.4718 0.0489 0.6124 ( 352 PWs) bands (ev): -1.8223 -1.8223 2.2246 2.2246 2.9565 2.9565 4.9220 4.9220 19.6946 19.6946 24.5130 24.5130 k = 0.4677 0.0559 0.6124 ( 350 PWs) bands (ev): -1.8372 -1.8372 2.1746 2.1746 2.9777 2.9777 4.9954 4.9954 19.6583 19.6583 24.3825 24.3825 k = 0.4637 0.0629 0.6124 ( 350 PWs) bands (ev): -1.8529 -1.8529 2.1265 2.1265 2.9928 2.9928 5.0765 5.0765 19.6167 19.6167 24.2567 24.2567 k = 0.4597 0.0698 0.6124 ( 350 PWs) bands (ev): -1.8691 -1.8691 2.0804 2.0804 3.0026 3.0026 5.1643 5.1643 19.5701 19.5701 24.1363 24.1363 k = 0.4556 0.0768 0.6124 ( 350 PWs) bands (ev): -1.8855 -1.8855 2.0364 2.0364 3.0077 3.0077 5.2575 5.2575 19.5187 19.5187 24.0216 24.0216 k = 0.4516 0.0838 0.6124 ( 350 PWs) bands (ev): -1.9020 -1.9020 1.9944 1.9944 3.0090 3.0090 5.3548 5.3548 19.4629 19.4629 23.9131 23.9131 k = 0.4476 0.0908 0.6124 ( 350 PWs) bands (ev): -1.9185 -1.9185 1.9544 1.9544 3.0071 3.0071 5.4550 5.4550 19.4030 19.4030 23.8109 23.8109 k = 0.4435 0.0978 0.6124 ( 353 PWs) bands (ev): -1.9347 -1.9347 1.9164 1.9164 3.0026 3.0026 5.5569 5.5569 19.3395 19.3395 23.7154 23.7154 k = 0.4395 0.1048 0.6124 ( 353 PWs) bands (ev): -1.9506 -1.9506 1.8806 1.8806 2.9962 2.9962 5.6594 5.6594 19.2732 19.2732 23.6266 23.6266 k = 0.4355 0.1117 0.6124 ( 353 PWs) bands (ev): -1.9660 -1.9660 1.8469 1.8469 2.9885 2.9885 5.7614 5.7614 19.2047 19.2047 23.5444 23.5444 k = 0.4315 0.1187 0.6124 ( 352 PWs) bands (ev): -1.9808 -1.9808 1.8153 1.8153 2.9797 2.9797 5.8620 5.8620 19.1347 19.1347 23.4690 23.4690 k = 0.4274 0.1257 0.6124 ( 352 PWs) bands (ev): -1.9949 -1.9949 1.7858 1.7858 2.9704 2.9704 5.9602 5.9602 19.0642 19.0642 23.4000 23.4000 k = 0.4234 0.1327 0.6124 ( 352 PWs) bands (ev): -2.0083 -2.0083 1.7585 1.7585 2.9608 2.9608 6.0550 6.0550 18.9940 18.9940 23.3375 23.3375 k = 0.4194 0.1397 0.6124 ( 354 PWs) bands (ev): -2.0209 -2.0209 1.7332 1.7332 2.9512 2.9512 6.1456 6.1456 18.9251 18.9251 23.2810 23.2810 k = 0.4153 0.1467 0.6124 ( 354 PWs) bands (ev): -2.0325 -2.0325 1.7102 1.7102 2.9418 2.9418 6.2314 6.2314 18.8582 18.8582 23.2306 23.2306 k = 0.4113 0.1536 0.6124 ( 352 PWs) bands (ev): -2.0432 -2.0432 1.6894 1.6894 2.9328 2.9328 6.3117 6.3117 18.7944 18.7944 23.1858 23.1858 k = 0.4073 0.1606 0.6124 ( 352 PWs) bands (ev): -2.0529 -2.0529 1.6707 1.6707 2.9245 2.9245 6.3854 6.3854 18.7346 18.7346 23.1465 23.1465 k = 0.4032 0.1676 0.6124 ( 346 PWs) bands (ev): -2.0615 -2.0615 1.6544 1.6544 2.9171 2.9171 6.4522 6.4522 18.6796 18.6796 23.1125 23.1125 k = 0.3992 0.1746 0.6124 ( 346 PWs) bands (ev): -2.0691 -2.0691 1.6401 1.6401 2.9102 2.9102 6.5113 6.5113 18.6302 18.6302 23.0835 23.0835 k = 0.3952 0.1816 0.6124 ( 349 PWs) bands (ev): -2.0756 -2.0756 1.6279 1.6279 2.9042 2.9042 6.5621 6.5621 18.5870 18.5870 23.0591 23.0591 k = 0.3911 0.1886 0.6124 ( 349 PWs) bands (ev): -2.0809 -2.0809 1.6180 1.6180 2.8992 2.8992 6.6045 6.6045 18.5508 18.5508 23.0395 23.0395 k = 0.3871 0.1956 0.6124 ( 349 PWs) bands (ev): -2.0851 -2.0851 1.6103 1.6103 2.8953 2.8953 6.6379 6.6379 18.5220 18.5220 23.0244 23.0244 k = 0.3831 0.2025 0.6124 ( 347 PWs) bands (ev): -2.0881 -2.0881 1.6048 1.6048 2.8926 2.8926 6.6620 6.6620 18.5012 18.5012 23.0138 23.0138 k = 0.3790 0.2095 0.6124 ( 347 PWs) bands (ev): -2.0899 -2.0899 1.6015 1.6015 2.8909 2.8909 6.6766 6.6766 18.4886 18.4886 23.0074 23.0074 k = 0.3750 0.2165 0.6124 ( 347 PWs) bands (ev): -2.0905 -2.0905 1.6004 1.6004 2.8903 2.8903 6.6814 6.6814 18.4844 18.4844 23.0052 23.0052 k = 0.3750 0.2165 0.6124 ( 347 PWs) bands (ev): -2.0905 -2.0905 1.6004 1.6004 2.8903 2.8903 6.6814 6.6814 18.4844 18.4844 23.0052 23.0052 k = 0.3710 0.2142 0.6058 ( 347 PWs) bands (ev): -2.1214 -2.1214 1.6712 1.6712 2.7953 2.7953 6.7231 6.7231 18.5764 18.5764 23.1879 23.1879 k = 0.3669 0.2119 0.5992 ( 351 PWs) bands (ev): -2.1577 -2.1577 1.7440 1.7440 2.7071 2.7071 6.7657 6.7657 18.6704 18.6704 23.3672 23.3672 k = 0.3629 0.2095 0.5926 ( 351 PWs) bands (ev): -2.1994 -2.1994 1.8188 1.8188 2.6267 2.6267 6.8091 6.8091 18.7664 18.7664 23.5425 23.5425 k = 0.3589 0.2072 0.5860 ( 351 PWs) bands (ev): -2.2469 -2.2469 1.8956 1.8956 2.5542 2.5542 6.8533 6.8533 18.8644 18.8644 23.7132 23.7132 k = 0.3548 0.2049 0.5794 ( 351 PWs) bands (ev): -2.3004 -2.3004 1.9743 1.9743 2.4899 2.4899 6.8983 6.8983 18.9645 18.9645 23.8791 23.8791 k = 0.3508 0.2025 0.5729 ( 351 PWs) bands (ev): -2.3599 -2.3599 2.0549 2.0549 2.4340 2.4340 6.9440 6.9440 19.0667 19.0667 24.0395 24.0395 k = 0.3468 0.2002 0.5663 ( 351 PWs) bands (ev): -2.4254 -2.4254 2.1374 2.1374 2.3866 2.3866 6.9903 6.9903 19.1710 19.1710 24.1941 24.1941 k = 0.3427 0.1979 0.5597 ( 351 PWs) bands (ev): -2.4971 -2.4971 2.2217 2.2217 2.3479 2.3479 7.0372 7.0372 19.2774 19.2774 24.3426 24.3426 k = 0.3387 0.1956 0.5531 ( 353 PWs) bands (ev): -2.5746 -2.5746 2.3073 2.3073 2.3181 2.3181 7.0847 7.0847 19.3859 19.3859 24.4846 24.4846 k = 0.3347 0.1932 0.5465 ( 353 PWs) bands (ev): -2.6579 -2.6579 2.2957 2.2957 2.3959 2.3959 7.1327 7.1327 19.4966 19.4966 24.6199 24.6199 k = 0.3306 0.1909 0.5399 ( 353 PWs) bands (ev): -2.7466 -2.7466 2.2823 2.2823 2.4856 2.4856 7.1812 7.1812 19.6094 19.6094 24.7484 24.7484 k = 0.3266 0.1886 0.5334 ( 353 PWs) bands (ev): -2.8404 -2.8404 2.2770 2.2770 2.5769 2.5769 7.2300 7.2300 19.7243 19.7243 24.8698 24.8698 k = 0.3226 0.1862 0.5268 ( 353 PWs) bands (ev): -2.9392 -2.9392 2.2794 2.2794 2.6700 2.6700 7.2792 7.2792 19.8414 19.8414 24.9841 24.9841 k = 0.3185 0.1839 0.5202 ( 353 PWs) bands (ev): -3.0423 -3.0423 2.2893 2.2893 2.7646 2.7646 7.3287 7.3287 19.9606 19.9606 25.0912 25.0912 k = 0.3145 0.1816 0.5136 ( 353 PWs) bands (ev): -3.1496 -3.1496 2.3064 2.3064 2.8609 2.8609 7.3784 7.3784 20.0819 20.0819 25.1912 25.1912 k = 0.3105 0.1793 0.5070 ( 353 PWs) bands (ev): -3.2605 -3.2605 2.3303 2.3303 2.9587 2.9587 7.4283 7.4283 20.2053 20.2053 25.2841 25.2841 k = 0.3065 0.1769 0.5004 ( 353 PWs) bands (ev): -3.3747 -3.3747 2.3607 2.3607 3.0580 3.0580 7.4784 7.4784 20.3308 20.3308 25.3700 25.3700 k = 0.3024 0.1746 0.4938 ( 349 PWs) bands (ev): -3.4918 -3.4918 2.3972 2.3972 3.1590 3.1590 7.5285 7.5285 20.4583 20.4583 25.4491 25.4491 k = 0.2984 0.1723 0.4873 ( 353 PWs) bands (ev): -3.6115 -3.6115 2.4394 2.4394 3.2611 3.2611 7.5785 7.5785 20.5878 20.5878 25.5213 25.5213 k = 0.2944 0.1699 0.4807 ( 347 PWs) bands (ev): -3.7333 -3.7333 2.4874 2.4874 3.3646 3.3646 7.6286 7.6286 20.7194 20.7194 25.5881 25.5881 k = 0.2903 0.1676 0.4741 ( 347 PWs) bands (ev): -3.8569 -3.8569 2.5402 2.5402 3.4694 3.4694 7.6785 7.6785 20.8528 20.8528 25.6479 25.6479 k = 0.2863 0.1653 0.4675 ( 347 PWs) bands (ev): -3.9820 -3.9820 2.5978 2.5978 3.5754 3.5754 7.7282 7.7282 20.9881 20.9881 25.7017 25.7017 k = 0.2823 0.1630 0.4609 ( 347 PWs) bands (ev): -4.1084 -4.1084 2.6600 2.6600 3.6826 3.6826 7.7777 7.7777 21.1251 21.1251 25.7498 25.7498 k = 0.2782 0.1606 0.4543 ( 347 PWs) bands (ev): -4.2356 -4.2356 2.7264 2.7264 3.7908 3.7908 7.8269 7.8269 21.2639 21.2639 25.6778 25.6778 k = 0.2742 0.1583 0.4478 ( 347 PWs) bands (ev): -4.3635 -4.3635 2.7970 2.7970 3.9002 3.9002 7.8758 7.8758 21.4043 21.4043 25.5829 25.5829 k = 0.2702 0.1560 0.4412 ( 343 PWs) bands (ev): -4.4918 -4.4918 2.8715 2.8715 4.0107 4.0107 7.9244 7.9244 21.5463 21.5463 25.4906 25.4906 k = 0.2661 0.1536 0.4346 ( 343 PWs) bands (ev): -4.6204 -4.6204 2.9494 2.9494 4.1219 4.1219 7.9724 7.9724 21.6897 21.6897 25.4010 25.4010 k = 0.2621 0.1513 0.4280 ( 343 PWs) bands (ev): -4.7489 -4.7489 3.0307 3.0307 4.2340 4.2340 8.0199 8.0199 21.8344 21.8344 25.3142 25.3142 k = 0.2581 0.1490 0.4214 ( 343 PWs) bands (ev): -4.8773 -4.8773 3.1153 3.1153 4.3469 4.3469 8.0668 8.0668 21.9803 21.9803 25.2304 25.2304 k = 0.2540 0.1467 0.4148 ( 343 PWs) bands (ev): -5.0053 -5.0053 3.2029 3.2029 4.4604 4.4604 8.1131 8.1131 22.1271 22.1271 25.1497 25.1497 k = 0.2500 0.1443 0.4082 ( 343 PWs) bands (ev): -5.1329 -5.1329 3.2934 3.2934 4.5746 4.5746 8.1587 8.1587 22.2747 22.2747 25.0722 25.0722 k = 0.2460 0.1420 0.4017 ( 343 PWs) bands (ev): -5.2597 -5.2597 3.3867 3.3867 4.6894 4.6894 8.2036 8.2036 22.4228 22.4228 24.9980 24.9980 k = 0.2419 0.1397 0.3951 ( 343 PWs) bands (ev): -5.3858 -5.3858 3.4825 3.4825 4.8046 4.8046 8.2477 8.2477 22.5712 22.5712 24.9272 24.9272 k = 0.2379 0.1374 0.3885 ( 343 PWs) bands (ev): -5.5110 -5.5110 3.5808 3.5808 4.9201 4.9201 8.2910 8.2910 22.7195 22.7195 24.8600 24.8600 k = 0.2339 0.1350 0.3819 ( 343 PWs) bands (ev): -5.6352 -5.6352 3.6814 3.6814 5.0360 5.0360 8.3335 8.3335 22.8673 22.8673 24.7965 24.7965 k = 0.2298 0.1327 0.3753 ( 345 PWs) bands (ev): -5.7583 -5.7583 3.7841 3.7841 5.1520 5.1520 8.3750 8.3750 23.0141 23.0141 24.7368 24.7368 k = 0.2258 0.1304 0.3687 ( 345 PWs) bands (ev): -5.8801 -5.8801 3.8890 3.8890 5.2682 5.2682 8.4156 8.4156 23.1594 23.1594 24.6810 24.6810 k = 0.2218 0.1280 0.3622 ( 345 PWs) bands (ev): -6.0007 -6.0007 3.9959 3.9959 5.3843 5.3843 8.4552 8.4552 23.3026 23.3026 24.6292 24.6292 k = 0.2177 0.1257 0.3556 ( 347 PWs) bands (ev): -6.1199 -6.1199 4.1046 4.1046 5.5005 5.5005 8.4937 8.4937 23.4428 23.4428 24.5812 24.5812 k = 0.2137 0.1234 0.3490 ( 347 PWs) bands (ev): -6.2376 -6.2376 4.2151 4.2151 5.6164 5.6164 8.5313 8.5313 23.5793 23.5793 24.5378 24.5378 k = 0.2097 0.1211 0.3424 ( 343 PWs) bands (ev): -6.3538 -6.3538 4.3275 4.3275 5.7320 5.7320 8.5678 8.5678 23.7111 23.7111 24.4989 24.4989 k = 0.2056 0.1187 0.3358 ( 343 PWs) bands (ev): -6.4685 -6.4685 4.4412 4.4412 5.8472 5.8472 8.6032 8.6032 23.8369 23.8369 24.4644 24.4644 k = 0.2016 0.1164 0.3292 ( 343 PWs) bands (ev): -6.5814 -6.5814 4.5562 4.5562 5.9619 5.9619 8.6375 8.6375 23.9555 23.9555 24.4345 24.4345 k = 0.1976 0.1141 0.3226 ( 343 PWs) bands (ev): -6.6927 -6.6927 4.6727 4.6727 6.0760 6.0760 8.6707 8.6707 24.0659 24.0659 24.4093 24.4093 k = 0.1935 0.1117 0.3161 ( 343 PWs) bands (ev): -6.8023 -6.8023 4.7904 4.7904 6.1893 6.1893 8.7027 8.7027 24.1666 24.1666 24.3890 24.3890 k = 0.1895 0.1094 0.3095 ( 345 PWs) bands (ev): -6.9100 -6.9100 4.9091 4.9091 6.3018 6.3018 8.7336 8.7336 24.2568 24.2568 24.3734 24.3734 k = 0.1855 0.1071 0.3029 ( 345 PWs) bands (ev): -7.0160 -7.0160 5.0290 5.0290 6.4135 6.4135 8.7633 8.7633 24.3357 24.3357 24.3632 24.3632 k = 0.1815 0.1048 0.2963 ( 341 PWs) bands (ev): -7.1200 -7.1200 5.1499 5.1499 6.5242 6.5242 8.7921 8.7921 24.3578 24.3578 24.4034 24.4034 k = 0.1774 0.1024 0.2897 ( 341 PWs) bands (ev): -7.2221 -7.2221 5.2715 5.2715 6.6337 6.6337 8.8195 8.8195 24.3580 24.3580 24.4593 24.4593 k = 0.1734 0.1001 0.2831 ( 341 PWs) bands (ev): -7.3223 -7.3223 5.3938 5.3938 6.7419 6.7419 8.8457 8.8457 24.3635 24.3635 24.5042 24.5042 k = 0.1694 0.0978 0.2766 ( 341 PWs) bands (ev): -7.4205 -7.4205 5.5168 5.5168 6.8487 6.8487 8.8708 8.8708 24.3745 24.3745 24.5387 24.5387 k = 0.1653 0.0954 0.2700 ( 341 PWs) bands (ev): -7.5166 -7.5166 5.6402 5.6402 6.9541 6.9541 8.8947 8.8947 24.3910 24.3910 24.5639 24.5639 k = 0.1613 0.0931 0.2634 ( 341 PWs) bands (ev): -7.6108 -7.6108 5.7640 5.7640 7.0578 7.0578 8.9175 8.9175 24.4132 24.4132 24.5808 24.5808 k = 0.1573 0.0908 0.2568 ( 341 PWs) bands (ev): -7.7029 -7.7029 5.8882 5.8882 7.1600 7.1600 8.9392 8.9392 24.4411 24.4411 24.5905 24.5905 k = 0.1532 0.0885 0.2502 ( 341 PWs) bands (ev): -7.7928 -7.7928 6.0124 6.0124 7.2603 7.2603 8.9597 8.9597 24.4749 24.4749 24.5938 24.5938 k = 0.1492 0.0861 0.2436 ( 341 PWs) bands (ev): -7.8807 -7.8807 6.1367 6.1367 7.3588 7.3588 8.9792 8.9792 24.5145 24.5145 24.5918 24.5918 k = 0.1452 0.0838 0.2370 ( 345 PWs) bands (ev): -7.9665 -7.9665 6.2606 6.2606 7.4552 7.4552 8.9976 8.9976 24.5599 24.5599 24.5851 24.5851 k = 0.1411 0.0815 0.2305 ( 345 PWs) bands (ev): -8.0500 -8.0500 6.3845 6.3845 7.5497 7.5497 9.0150 9.0150 24.5744 24.5744 24.6116 24.6116 k = 0.1371 0.0792 0.2239 ( 345 PWs) bands (ev): -8.1314 -8.1314 6.5081 6.5081 7.6420 7.6420 9.0313 9.0313 24.5605 24.5605 24.6693 24.6693 k = 0.1331 0.0768 0.2173 ( 337 PWs) bands (ev): -8.2106 -8.2106 6.6314 6.6314 7.7324 7.7324 9.0472 9.0472 24.5439 24.5439 24.7330 24.7330 k = 0.1290 0.0745 0.2107 ( 337 PWs) bands (ev): -8.2875 -8.2875 6.7538 6.7538 7.8201 7.8201 9.0616 9.0616 24.5248 24.5248 24.8030 24.8030 k = 0.1250 0.0722 0.2041 ( 337 PWs) bands (ev): -8.3622 -8.3622 6.8753 6.8753 7.9055 7.9055 9.0751 9.0751 24.5037 24.5037 24.8790 24.8790 k = 0.1210 0.0698 0.1975 ( 337 PWs) bands (ev): -8.4347 -8.4347 6.9959 6.9959 7.9885 7.9885 9.0877 9.0877 24.4809 24.4809 24.9613 24.9613 k = 0.1169 0.0675 0.1910 ( 341 PWs) bands (ev): -8.5050 -8.5050 7.1150 7.1150 8.0689 8.0689 9.0993 9.0993 24.4565 24.4565 25.0496 25.0496 k = 0.1129 0.0652 0.1844 ( 341 PWs) bands (ev): -8.5730 -8.5730 7.2331 7.2331 8.1468 8.1468 9.1102 9.1102 24.4311 24.4311 25.1441 25.1441 k = 0.1089 0.0629 0.1778 ( 341 PWs) bands (ev): -8.6386 -8.6386 7.3497 7.3497 8.2221 8.2221 9.1203 9.1203 24.4047 24.4047 25.2448 25.2448 k = 0.1048 0.0605 0.1712 ( 339 PWs) bands (ev): -8.7020 -8.7020 7.4649 7.4649 8.2947 8.2947 9.1297 9.1297 24.3776 24.3776 25.3515 25.3515 k = 0.1008 0.0582 0.1646 ( 339 PWs) bands (ev): -8.7630 -8.7630 7.5780 7.5780 8.3646 8.3646 9.1384 9.1384 24.3498 24.3498 25.4642 25.4642 k = 0.0968 0.0559 0.1580 ( 335 PWs) bands (ev): -8.8218 -8.8218 7.6894 7.6894 8.4318 8.4318 9.1465 9.1465 24.3216 24.3216 25.5828 25.5828 k = 0.0927 0.0535 0.1514 ( 335 PWs) bands (ev): -8.8782 -8.8782 7.7981 7.7981 8.4963 8.4963 9.1538 9.1538 24.2930 24.2930 25.7073 25.7073 k = 0.0887 0.0512 0.1449 ( 335 PWs) bands (ev): -8.9322 -8.9322 7.9045 7.9045 8.5580 8.5580 9.1605 9.1605 24.2643 24.2643 25.8374 25.8374 k = 0.0847 0.0489 0.1383 ( 335 PWs) bands (ev): -8.9839 -8.9839 8.0082 8.0082 8.6168 8.6168 9.1666 9.1666 24.2355 24.2355 25.9732 25.9732 k = 0.0806 0.0466 0.1317 ( 335 PWs) bands (ev): -9.0333 -9.0333 8.1090 8.1090 8.6729 8.6729 9.1722 9.1722 24.2069 24.2069 26.1142 26.1142 k = 0.0766 0.0442 0.1251 ( 333 PWs) bands (ev): -9.0803 -9.0803 8.2071 8.2071 8.7262 8.7262 9.1773 9.1773 24.1784 24.1784 26.2605 26.2605 k = 0.0726 0.0419 0.1185 ( 333 PWs) bands (ev): -9.1249 -9.1249 8.3016 8.3016 8.7766 8.7766 9.1819 9.1819 24.1503 24.1503 26.4117 26.4117 k = 0.0685 0.0396 0.1119 ( 333 PWs) bands (ev): -9.1672 -9.1672 8.3926 8.3926 8.8242 8.8242 9.1860 9.1860 24.1227 24.1227 26.5675 26.5675 k = 0.0645 0.0372 0.1054 ( 333 PWs) bands (ev): -9.2070 -9.2070 8.4799 8.4799 8.8691 8.8691 9.1898 9.1898 24.0957 24.0957 26.7276 26.7276 k = 0.0605 0.0349 0.0988 ( 333 PWs) bands (ev): -9.2445 -9.2445 8.5632 8.5632 8.9111 8.9111 9.1931 9.1931 24.0695 24.0695 26.8915 26.8915 k = 0.0565 0.0326 0.0922 ( 333 PWs) bands (ev): -9.2796 -9.2796 8.6424 8.6424 8.9503 8.9503 9.1961 9.1961 24.0440 24.0440 27.0588 27.0588 k = 0.0524 0.0303 0.0856 ( 333 PWs) bands (ev): -9.3123 -9.3123 8.7172 8.7172 8.9867 8.9867 9.1988 9.1988 24.0196 24.0196 27.2288 27.2288 k = 0.0484 0.0279 0.0790 ( 333 PWs) bands (ev): -9.3426 -9.3426 8.7875 8.7875 9.0203 9.0203 9.2012 9.2012 23.9964 23.9964 27.4009 27.4009 k = 0.0444 0.0256 0.0724 ( 333 PWs) bands (ev): -9.3704 -9.3704 8.8530 8.8530 9.0512 9.0512 9.2033 9.2033 23.9744 23.9744 27.5742 27.5742 k = 0.0403 0.0233 0.0658 ( 333 PWs) bands (ev): -9.3959 -9.3959 8.9135 8.9135 9.0793 9.0793 9.2052 9.2052 23.9537 23.9537 27.7474 27.7474 k = 0.0363 0.0210 0.0593 ( 333 PWs) bands (ev): -9.4189 -9.4189 8.9688 8.9688 9.1047 9.1047 9.2068 9.2068 23.9346 23.9346 27.9193 27.9193 k = 0.0323 0.0186 0.0527 ( 333 PWs) bands (ev): -9.4396 -9.4396 9.0188 9.0188 9.1274 9.1274 9.2083 9.2083 23.9171 23.9171 28.0881 28.0881 k = 0.0282 0.0163 0.0461 ( 333 PWs) bands (ev): -9.4578 -9.4578 9.0633 9.0633 9.1473 9.1473 9.2096 9.2096 23.9014 23.9014 28.2516 28.2516 k = 0.0242 0.0140 0.0395 ( 333 PWs) bands (ev): -9.4736 -9.4736 9.1021 9.1021 9.1646 9.1646 9.2108 9.2108 23.8876 23.8876 28.4070 28.4070 k = 0.0202 0.0116 0.0329 ( 333 PWs) bands (ev): -9.4869 -9.4869 9.1350 9.1350 9.1793 9.1793 9.2119 9.2119 23.8756 23.8756 28.5508 28.5508 k = 0.0161 0.0093 0.0263 ( 333 PWs) bands (ev): -9.4979 -9.4979 9.1617 9.1617 9.1913 9.1913 9.2130 9.2130 23.8658 23.8658 28.6790 28.6790 k = 0.0121 0.0070 0.0198 ( 333 PWs) bands (ev): -9.5064 -9.5064 9.1817 9.1817 9.2011 9.2011 9.2143 9.2143 23.8580 23.8580 28.7867 28.7867 k = 0.0081 0.0047 0.0132 ( 333 PWs) bands (ev): -9.5124 -9.5124 9.1944 9.1944 9.2092 9.2092 9.2158 9.2158 23.8524 23.8524 28.8687 28.8687 k = 0.0040 0.0023 0.0066 ( 333 PWs) bands (ev): -9.5161 -9.5161 9.2003 9.2003 9.2153 9.2153 9.2171 9.2171 23.8491 23.8491 28.9202 28.9202 k = 0.0000 0.0000 0.0000 ( 331 PWs) bands (ev): -9.5173 -9.5173 9.2020 9.2020 9.2178 9.2178 9.2178 9.2178 23.8480 23.8480 28.9380 28.9380 k = 0.0000 0.0000 0.0000 ( 331 PWs) bands (ev): -9.5173 -9.5173 9.2020 9.2020 9.2178 9.2178 9.2178 9.2178 23.8480 23.8480 28.9380 28.9380 k = 0.0066 0.0038 0.0027 ( 332 PWs) bands (ev): -9.5161 -9.5161 9.2004 9.2004 9.2153 9.2153 9.2173 9.2173 23.8491 23.8491 28.9205 28.9207 k = 0.0132 0.0076 0.0054 ( 332 PWs) bands (ev): -9.5124 -9.5124 9.1937 9.1937 9.2101 9.2101 9.2158 9.2158 23.8524 23.8524 28.8696 28.8696 k = 0.0197 0.0114 0.0081 ( 335 PWs) bands (ev): -9.5064 -9.5064 9.1787 9.1787 9.2050 9.2050 9.2132 9.2132 23.8580 23.8580 28.7886 28.7886 k = 0.0263 0.0152 0.0107 ( 335 PWs) bands (ev): -9.4979 -9.4979 9.1554 9.1554 9.2006 9.2006 9.2098 9.2098 23.8658 23.8658 28.6823 28.6823 k = 0.0329 0.0190 0.0134 ( 335 PWs) bands (ev): -9.4870 -9.4870 9.1247 9.1247 9.1958 9.1958 9.2055 9.2055 23.8757 23.8757 28.5559 28.5559 k = 0.0395 0.0228 0.0161 ( 335 PWs) bands (ev): -9.4737 -9.4737 9.0869 9.0869 9.1903 9.1903 9.2002 9.2002 23.8876 23.8876 28.4141 28.4141 k = 0.0461 0.0266 0.0188 ( 335 PWs) bands (ev): -9.4579 -9.4579 9.0423 9.0423 9.1839 9.1839 9.1940 9.1940 23.9015 23.9015 28.2610 28.2610 k = 0.0526 0.0304 0.0215 ( 335 PWs) bands (ev): -9.4397 -9.4397 8.9910 8.9910 9.1767 9.1767 9.1869 9.1869 23.9173 23.9173 28.1001 28.1001 k = 0.0592 0.0342 0.0242 ( 335 PWs) bands (ev): -9.4191 -9.4191 8.9331 8.9331 9.1687 9.1687 9.1789 9.1789 23.9349 23.9349 27.9342 27.9342 k = 0.0658 0.0380 0.0269 ( 335 PWs) bands (ev): -9.3961 -9.3961 8.8686 8.8686 9.1598 9.1598 9.1700 9.1700 23.9540 23.9540 27.7654 27.7654 k = 0.0724 0.0418 0.0295 ( 335 PWs) bands (ev): -9.3707 -9.3707 8.7978 8.7978 9.1500 9.1500 9.1603 9.1603 23.9746 23.9746 27.5956 27.5956 k = 0.0789 0.0456 0.0322 ( 335 PWs) bands (ev): -9.3429 -9.3429 8.7207 8.7207 9.1395 9.1395 9.1498 9.1498 23.9965 23.9965 27.4261 27.4261 k = 0.0855 0.0494 0.0349 ( 335 PWs) bands (ev): -9.3127 -9.3127 8.6374 8.6374 9.1281 9.1281 9.1384 9.1384 24.0194 24.0194 27.2581 27.2581 k = 0.0921 0.0532 0.0376 ( 335 PWs) bands (ev): -9.2800 -9.2800 8.5482 8.5482 9.1160 9.1160 9.1263 9.1263 24.0430 24.0430 27.0926 27.0926 k = 0.0987 0.0570 0.0403 ( 335 PWs) bands (ev): -9.2450 -9.2450 8.4531 8.4531 9.1032 9.1032 9.1135 9.1135 24.0671 24.0671 26.9305 26.9305 k = 0.1053 0.0608 0.0430 ( 335 PWs) bands (ev): -9.2076 -9.2076 8.3523 8.3523 9.0896 9.0896 9.0999 9.0999 24.0913 24.0913 26.7725 26.7725 k = 0.1118 0.0646 0.0457 ( 335 PWs) bands (ev): -9.1678 -9.1678 8.2460 8.2460 9.0754 9.0754 9.0857 9.0857 24.1152 24.1152 26.6194 26.6194 k = 0.1184 0.0684 0.0483 ( 335 PWs) bands (ev): -9.1257 -9.1257 8.1343 8.1343 9.0605 9.0605 9.0708 9.0708 24.1382 24.1382 26.4718 26.4718 k = 0.1250 0.0722 0.0510 ( 335 PWs) bands (ev): -9.0811 -9.0811 8.0174 8.0174 9.0451 9.0451 9.0553 9.0553 24.1597 24.1597 26.3306 26.3306 k = 0.1316 0.0760 0.0537 ( 335 PWs) bands (ev): -9.0342 -9.0342 7.8954 7.8954 9.0290 9.0290 9.0393 9.0393 24.1791 24.1791 26.1965 26.1965 k = 0.1382 0.0798 0.0564 ( 335 PWs) bands (ev): -8.9850 -8.9850 7.7686 7.7686 9.0124 9.0124 9.0227 9.0227 24.1955 24.1955 26.0704 26.0704 k = 0.1447 0.0836 0.0591 ( 338 PWs) bands (ev): -8.9334 -8.9334 7.6369 7.6369 8.9953 8.9953 9.0056 9.0056 24.2077 24.2077 25.9532 25.9532 k = 0.1513 0.0874 0.0618 ( 338 PWs) bands (ev): -8.8794 -8.8794 7.5009 7.5009 8.9778 8.9778 8.9880 8.9880 24.2148 24.2148 25.8462 25.8462 k = 0.1579 0.0912 0.0645 ( 338 PWs) bands (ev): -8.8232 -8.8232 7.3607 7.3607 8.9598 8.9598 8.9700 8.9700 24.2156 24.2156 25.7504 25.7504 k = 0.1645 0.0950 0.0671 ( 338 PWs) bands (ev): -8.7646 -8.7646 7.2164 7.2164 8.9414 8.9414 8.9516 8.9516 24.2087 24.2087 25.6669 25.6669 k = 0.1711 0.0988 0.0698 ( 338 PWs) bands (ev): -8.7037 -8.7037 7.0682 7.0682 8.9227 8.9227 8.9329 8.9329 24.1932 24.1932 25.5967 25.5967 k = 0.1776 0.1026 0.0725 ( 338 PWs) bands (ev): -8.6405 -8.6405 6.9163 6.9163 8.9037 8.9037 8.9139 8.9139 24.1684 24.1684 25.5403 25.5403 k = 0.1842 0.1064 0.0752 ( 344 PWs) bands (ev): -8.5750 -8.5750 6.7605 6.7605 8.8842 8.8842 8.8944 8.8944 24.1341 24.1341 25.4976 25.4976 k = 0.1908 0.1102 0.0779 ( 341 PWs) bands (ev): -8.5072 -8.5072 6.6020 6.6020 8.8647 8.8647 8.8749 8.8749 24.0908 24.0908 25.4685 25.4685 k = 0.1974 0.1140 0.0806 ( 341 PWs) bands (ev): -8.4372 -8.4372 6.4401 6.4401 8.8450 8.8450 8.8551 8.8551 24.0395 24.0395 25.4512 25.4512 k = 0.2039 0.1177 0.0833 ( 341 PWs) bands (ev): -8.3649 -8.3649 6.2753 6.2753 8.8251 8.8251 8.8352 8.8352 23.9814 23.9814 25.4444 25.4444 k = 0.2105 0.1215 0.0859 ( 341 PWs) bands (ev): -8.2905 -8.2905 6.1078 6.1078 8.8051 8.8051 8.8152 8.8152 23.9180 23.9180 25.4465 25.4465 k = 0.2171 0.1253 0.0886 ( 344 PWs) bands (ev): -8.2137 -8.2137 5.9374 5.9374 8.7849 8.7849 8.7950 8.7950 23.8507 23.8507 25.4562 25.4562 k = 0.2237 0.1291 0.0913 ( 344 PWs) bands (ev): -8.1349 -8.1349 5.7650 5.7650 8.7647 8.7647 8.7748 8.7748 23.7809 23.7809 25.4714 25.4714 k = 0.2303 0.1329 0.0940 ( 344 PWs) bands (ev): -8.0538 -8.0538 5.5904 5.5904 8.7446 8.7446 8.7547 8.7547 23.7096 23.7096 25.4912 25.4912 k = 0.2368 0.1367 0.0967 ( 350 PWs) bands (ev): -7.9706 -7.9706 5.4136 5.4136 8.7242 8.7242 8.7342 8.7342 23.6377 23.6377 25.5142 25.5142 k = 0.2434 0.1405 0.0994 ( 350 PWs) bands (ev): -7.8853 -7.8853 5.2353 5.2353 8.7041 8.7041 8.7141 8.7141 23.5658 23.5658 25.5400 25.5400 k = 0.2500 0.1443 0.1021 ( 350 PWs) bands (ev): -7.7979 -7.7979 5.0553 5.0553 8.6841 8.6841 8.6941 8.6941 23.4946 23.4946 25.5675 25.5675 k = 0.2566 0.1481 0.1047 ( 350 PWs) bands (ev): -7.7084 -7.7084 4.8739 4.8739 8.6643 8.6643 8.6743 8.6743 23.4245 23.4245 25.5963 25.5963 k = 0.2632 0.1519 0.1074 ( 350 PWs) bands (ev): -7.6169 -7.6169 4.6913 4.6913 8.6446 8.6446 8.6546 8.6546 23.3558 23.3558 25.6257 25.6257 k = 0.2697 0.1557 0.1101 ( 350 PWs) bands (ev): -7.5234 -7.5234 4.5076 4.5076 8.6251 8.6251 8.6351 8.6351 23.2887 23.2887 25.6554 25.6554 k = 0.2763 0.1595 0.1128 ( 350 PWs) bands (ev): -7.4279 -7.4279 4.3230 4.3230 8.6058 8.6058 8.6158 8.6158 23.2234 23.2234 25.6850 25.6850 k = 0.2829 0.1633 0.1155 ( 350 PWs) bands (ev): -7.3304 -7.3304 4.1376 4.1376 8.5868 8.5868 8.5967 8.5967 23.1601 23.1601 25.7142 25.7142 k = 0.2895 0.1671 0.1182 ( 350 PWs) bands (ev): -7.2311 -7.2311 3.9518 3.9518 8.5680 8.5680 8.5779 8.5779 23.0989 23.0989 25.7428 25.7428 k = 0.2961 0.1709 0.1209 ( 350 PWs) bands (ev): -7.1300 -7.1300 3.7655 3.7655 8.5496 8.5496 8.5595 8.5595 23.0398 23.0398 25.7705 25.7705 k = 0.3026 0.1747 0.1235 ( 344 PWs) bands (ev): -7.0270 -7.0270 3.5791 3.5791 8.5317 8.5317 8.5416 8.5416 22.9829 22.9829 25.7974 25.7974 k = 0.3092 0.1785 0.1262 ( 344 PWs) bands (ev): -6.9223 -6.9223 3.3926 3.3926 8.5139 8.5139 8.5238 8.5238 22.9281 22.9281 25.8229 25.8229 k = 0.3158 0.1823 0.1289 ( 344 PWs) bands (ev): -6.8160 -6.8160 3.2063 3.2063 8.4965 8.4965 8.5064 8.5064 22.8756 22.8756 25.8472 25.8472 k = 0.3224 0.1861 0.1316 ( 344 PWs) bands (ev): -6.7080 -6.7080 3.0202 3.0202 8.4796 8.4796 8.4894 8.4894 22.8254 22.8254 25.8701 25.8701 k = 0.3289 0.1899 0.1343 ( 344 PWs) bands (ev): -6.5986 -6.5986 2.8347 2.8347 8.4630 8.4630 8.4729 8.4729 22.7773 22.7773 25.8916 25.8916 k = 0.3355 0.1937 0.1370 ( 344 PWs) bands (ev): -6.4877 -6.4877 2.6498 2.6498 8.4469 8.4469 8.4567 8.4567 22.7314 22.7314 25.9116 25.9116 k = 0.3421 0.1975 0.1397 ( 344 PWs) bands (ev): -6.3755 -6.3755 2.4659 2.4659 8.4313 8.4313 8.4411 8.4411 22.6876 22.6876 25.9301 25.9301 k = 0.3487 0.2013 0.1423 ( 347 PWs) bands (ev): -6.2621 -6.2621 2.2829 2.2829 8.4159 8.4159 8.4258 8.4258 22.6460 22.6460 25.9471 25.9471 k = 0.3553 0.2051 0.1450 ( 353 PWs) bands (ev): -6.1477 -6.1477 2.1009 2.1009 8.4012 8.4012 8.4110 8.4110 22.6064 22.6064 25.9624 25.9624 k = 0.3618 0.2089 0.1477 ( 353 PWs) bands (ev): -6.0323 -6.0323 1.9208 1.9208 8.3871 8.3871 8.3969 8.3969 22.5690 22.5690 25.9765 25.9765 k = 0.3684 0.2127 0.1504 ( 353 PWs) bands (ev): -5.9161 -5.9161 1.7424 1.7424 8.3736 8.3736 8.3834 8.3834 22.5336 22.5336 25.9893 25.9893 k = 0.3750 0.2165 0.1531 ( 353 PWs) bands (ev): -5.7993 -5.7993 1.5661 1.5661 8.3606 8.3606 8.3704 8.3704 22.5003 22.5003 26.0007 26.0007 k = 0.3816 0.2203 0.1558 ( 353 PWs) bands (ev): -5.6822 -5.6822 1.3921 1.3921 8.3482 8.3482 8.3579 8.3579 22.4688 22.4688 26.0108 26.0108 k = 0.3882 0.2241 0.1585 ( 353 PWs) bands (ev): -5.5649 -5.5649 1.2207 1.2207 8.3363 8.3363 8.3461 8.3461 22.4394 22.4394 26.0197 26.0197 k = 0.3947 0.2279 0.1612 ( 353 PWs) bands (ev): -5.4479 -5.4479 1.0523 1.0523 8.3251 8.3251 8.3349 8.3349 22.4118 22.4118 26.0274 26.0274 k = 0.4013 0.2317 0.1638 ( 353 PWs) bands (ev): -5.3314 -5.3314 0.8873 0.8873 8.3145 8.3145 8.3242 8.3242 22.3861 22.3861 26.0342 26.0342 k = 0.4079 0.2355 0.1665 ( 353 PWs) bands (ev): -5.2158 -5.2158 0.7261 0.7261 8.3045 8.3045 8.3143 8.3143 22.3622 22.3622 26.0399 26.0399 k = 0.4145 0.2393 0.1692 ( 353 PWs) bands (ev): -5.1016 -5.1016 0.5692 0.5692 8.2952 8.2952 8.3049 8.3049 22.3401 22.3401 26.0448 26.0448 k = 0.4211 0.2431 0.1719 ( 353 PWs) bands (ev): -4.9893 -4.9893 0.4173 0.4173 8.2865 8.2865 8.2962 8.2962 22.3198 22.3198 26.0489 26.0489 k = 0.4276 0.2469 0.1746 ( 353 PWs) bands (ev): -4.8797 -4.8797 0.2710 0.2710 8.2785 8.2785 8.2882 8.2882 22.3012 22.3012 26.0523 26.0523 k = 0.4342 0.2507 0.1773 ( 347 PWs) bands (ev): -4.7733 -4.7733 0.1312 0.1312 8.2714 8.2714 8.2811 8.2811 22.2844 22.2844 26.0553 26.0553 k = 0.4408 0.2545 0.1800 ( 347 PWs) bands (ev): -4.6712 -4.6712 -0.0014 -0.0014 8.2647 8.2647 8.2745 8.2745 22.2692 22.2692 26.0576 26.0576 k = 0.4474 0.2583 0.1826 ( 347 PWs) bands (ev): -4.5744 -4.5744 -0.1256 -0.1256 8.2587 8.2587 8.2685 8.2685 22.2557 22.2557 26.0594 26.0594 k = 0.4539 0.2621 0.1853 ( 350 PWs) bands (ev): -4.4840 -4.4840 -0.2405 -0.2405 8.2534 8.2534 8.2631 8.2631 22.2437 22.2437 26.0606 26.0606 k = 0.4605 0.2659 0.1880 ( 344 PWs) bands (ev): -4.4011 -4.4011 -0.3441 -0.3441 8.2490 8.2490 8.2587 8.2587 22.2335 22.2335 26.0620 26.0620 k = 0.4671 0.2697 0.1907 ( 344 PWs) bands (ev): -4.3275 -4.3275 -0.4356 -0.4356 8.2450 8.2450 8.2547 8.2547 22.2248 22.2248 26.0628 26.0628 k = 0.4737 0.2735 0.1934 ( 344 PWs) bands (ev): -4.2645 -4.2645 -0.5132 -0.5132 8.2418 8.2418 8.2515 8.2515 22.2178 22.2178 26.0634 26.0634 k = 0.4803 0.2773 0.1961 ( 344 PWs) bands (ev): -4.2135 -4.2135 -0.5756 -0.5756 8.2393 8.2393 8.2490 8.2490 22.2123 22.2123 26.0638 26.0638 k = 0.4868 0.2811 0.1988 ( 344 PWs) bands (ev): -4.1760 -4.1760 -0.6213 -0.6213 8.2376 8.2376 8.2473 8.2473 22.2084 22.2084 26.0641 26.0641 k = 0.4934 0.2849 0.2014 ( 344 PWs) bands (ev): -4.1530 -4.1530 -0.6492 -0.6492 8.2365 8.2365 8.2462 8.2462 22.2061 22.2061 26.0642 26.0642 k = 0.5000 0.2887 0.2041 ( 344 PWs) bands (ev): -4.1452 -4.1452 -0.6585 -0.6585 8.2361 8.2361 8.2458 8.2458 22.2053 22.2053 26.0643 26.0643 k = 0.5000 0.2887 0.2041 ( 344 PWs) bands (ev): -4.1452 -4.1452 -0.6585 -0.6585 8.2361 8.2361 8.2458 8.2458 22.2053 22.2053 26.0643 26.0643 k = 0.5023 0.2820 0.2079 ( 344 PWs) bands (ev): -4.1442 -4.1442 -0.6574 -0.6574 8.2335 8.2335 8.2436 8.2436 22.2081 22.2081 26.0314 26.0314 k = 0.5046 0.2753 0.2117 ( 344 PWs) bands (ev): -4.1413 -4.1413 -0.6539 -0.6539 8.2239 8.2239 8.2387 8.2387 22.2165 22.2165 25.9414 25.9414 k = 0.5069 0.2686 0.2155 ( 344 PWs) bands (ev): -4.1365 -4.1365 -0.6481 -0.6481 8.2059 8.2059 8.2326 8.2326 22.2305 22.2305 25.8116 25.8116 k = 0.5093 0.2619 0.2192 ( 344 PWs) bands (ev): -4.1298 -4.1298 -0.6400 -0.6400 8.1798 8.1798 8.2250 8.2250 22.2499 22.2499 25.6566 25.6566 k = 0.5116 0.2553 0.2230 ( 344 PWs) bands (ev): -4.1212 -4.1212 -0.6295 -0.6295 8.1461 8.1461 8.2156 8.2156 22.2746 22.2746 25.4858 25.4858 k = 0.5139 0.2486 0.2268 ( 344 PWs) bands (ev): -4.1106 -4.1106 -0.6167 -0.6167 8.1051 8.1051 8.2043 8.2043 22.3043 22.3043 25.3050 25.3050 k = 0.5162 0.2419 0.2306 ( 346 PWs) bands (ev): -4.0981 -4.0981 -0.6017 -0.6017 8.0566 8.0566 8.1911 8.1911 22.3388 22.3388 25.1180 25.1180 k = 0.5185 0.2352 0.2344 ( 345 PWs) bands (ev): -4.0837 -4.0837 -0.5843 -0.5843 8.0014 8.0014 8.1760 8.1760 22.3777 22.3777 24.9274 24.9274 k = 0.5208 0.2285 0.2381 ( 345 PWs) bands (ev): -4.0675 -4.0675 -0.5646 -0.5646 7.9392 7.9392 8.1590 8.1590 22.4205 22.4205 24.7351 24.7351 k = 0.5231 0.2219 0.2419 ( 349 PWs) bands (ev): -4.0493 -4.0493 -0.5428 -0.5428 7.8701 7.8701 8.1402 8.1402 22.4666 22.4666 24.5426 24.5426 k = 0.5255 0.2152 0.2457 ( 349 PWs) bands (ev): -4.0293 -4.0293 -0.5185 -0.5185 7.7947 7.7947 8.1197 8.1197 22.5151 22.5151 24.3519 24.3519 k = 0.5278 0.2085 0.2495 ( 351 PWs) bands (ev): -4.0074 -4.0074 -0.4921 -0.4921 7.7131 7.7131 8.0974 8.0974 22.5647 22.5647 24.1643 24.1643 k = 0.5301 0.2018 0.2533 ( 351 PWs) bands (ev): -3.9837 -3.9837 -0.4633 -0.4633 7.6254 7.6254 8.0736 8.0736 22.6134 22.6134 23.9825 23.9825 k = 0.5324 0.1951 0.2570 ( 351 PWs) bands (ev): -3.9581 -3.9581 -0.4322 -0.4322 7.5320 7.5320 8.0483 8.0483 22.6579 22.6579 23.8099 23.8099 k = 0.5347 0.1884 0.2608 ( 349 PWs) bands (ev): -3.9306 -3.9306 -0.3989 -0.3989 7.4330 7.4330 8.0216 8.0216 22.6924 22.6924 23.6524 23.6524 k = 0.5370 0.1818 0.2646 ( 349 PWs) bands (ev): -3.9014 -3.9014 -0.3634 -0.3634 7.3287 7.3287 7.9934 7.9934 22.7067 22.7067 23.5200 23.5200 k = 0.5394 0.1751 0.2684 ( 349 PWs) bands (ev): -3.8703 -3.8703 -0.3257 -0.3257 7.2194 7.2194 7.9638 7.9638 22.6866 22.6866 23.4269 23.4269 k = 0.5417 0.1684 0.2722 ( 349 PWs) bands (ev): -3.8375 -3.8375 -0.2858 -0.2858 7.1052 7.1052 7.9331 7.9331 22.6212 22.6212 23.3840 23.3840 k = 0.5440 0.1617 0.2759 ( 349 PWs) bands (ev): -3.8030 -3.8030 -0.2437 -0.2437 6.9865 6.9865 7.9011 7.9011 22.5144 22.5144 23.3871 23.3871 k = 0.5463 0.1550 0.2797 ( 351 PWs) bands (ev): -3.7667 -3.7667 -0.1994 -0.1994 6.8632 6.8632 7.8681 7.8681 22.3803 22.3803 23.4217 23.4217 k = 0.5486 0.1483 0.2835 ( 350 PWs) bands (ev): -3.7287 -3.7287 -0.1530 -0.1530 6.7363 6.7363 7.8341 7.8341 22.2315 22.2315 23.4753 23.4753 k = 0.5509 0.1417 0.2873 ( 350 PWs) bands (ev): -3.6890 -3.6890 -0.1044 -0.1044 6.6055 6.6055 7.7992 7.7992 22.0754 22.0754 23.5394 23.5394 k = 0.5532 0.1350 0.2911 ( 352 PWs) bands (ev): -3.6477 -3.6477 -0.0538 -0.0538 6.4711 6.4711 7.7634 7.7634 21.9165 21.9165 23.6095 23.6095 k = 0.5556 0.1283 0.2948 ( 350 PWs) bands (ev): -3.6048 -3.6048 -0.0011 -0.0011 6.3337 6.3337 7.7270 7.7270 21.7571 21.7571 23.6828 23.6828 k = 0.5579 0.1216 0.2986 ( 350 PWs) bands (ev): -3.5603 -3.5603 0.0537 0.0537 6.1932 6.1932 7.6900 7.6900 21.5986 21.5986 23.7570 23.7570 k = 0.5602 0.1149 0.3024 ( 352 PWs) bands (ev): -3.5143 -3.5143 0.1104 0.1104 6.0500 6.0500 7.6522 7.6522 21.4420 21.4420 23.8307 23.8307 k = 0.5625 0.1083 0.3062 ( 356 PWs) bands (ev): -3.4669 -3.4669 0.1690 0.1690 5.9041 5.9041 7.6141 7.6141 21.2876 21.2876 23.9024 23.9024 k = 0.5648 0.1016 0.3100 ( 355 PWs) bands (ev): -3.4179 -3.4179 0.2297 0.2297 5.7563 5.7563 7.5756 7.5756 21.1362 21.1362 23.9712 23.9712 k = 0.5671 0.0949 0.3137 ( 355 PWs) bands (ev): -3.3676 -3.3676 0.2922 0.2922 5.6066 5.6066 7.5369 7.5369 20.9879 20.9879 24.0358 24.0358 k = 0.5694 0.0882 0.3175 ( 355 PWs) bands (ev): -3.3160 -3.3160 0.3565 0.3565 5.4553 5.4553 7.4980 7.4980 20.8428 20.8428 24.0951 24.0951 k = 0.5718 0.0815 0.3213 ( 355 PWs) bands (ev): -3.2631 -3.2631 0.4227 0.4227 5.3027 5.3027 7.4589 7.4589 20.7011 20.7011 24.1480 24.1480 k = 0.5741 0.0748 0.3251 ( 355 PWs) bands (ev): -3.2091 -3.2091 0.4905 0.4905 5.1490 5.1490 7.4198 7.4198 20.5630 20.5630 24.1933 24.1933 k = 0.5764 0.0682 0.3289 ( 353 PWs) bands (ev): -3.1539 -3.1539 0.5599 0.5599 4.9946 4.9946 7.3808 7.3808 20.4285 20.4285 24.2302 24.2302 k = 0.5787 0.0615 0.3326 ( 355 PWs) bands (ev): -3.0977 -3.0977 0.6309 0.6309 4.8395 4.8395 7.3417 7.3417 20.2977 20.2977 24.2575 24.2575 k = 0.5810 0.0548 0.3364 ( 355 PWs) bands (ev): -3.0407 -3.0407 0.7033 0.7033 4.6845 4.6845 7.3029 7.3029 20.1706 20.1706 24.2747 24.2747 k = 0.5833 0.0481 0.3402 ( 355 PWs) bands (ev): -2.9829 -2.9829 0.7770 0.7770 4.5298 4.5298 7.2643 7.2643 20.0473 20.0473 24.2812 24.2812 k = 0.5856 0.0414 0.3440 ( 355 PWs) bands (ev): -2.9245 -2.9245 0.8518 0.8518 4.3758 4.3758 7.2261 7.2261 19.9278 19.9278 24.2766 24.2766 k = 0.5880 0.0347 0.3478 ( 355 PWs) bands (ev): -2.8655 -2.8655 0.9276 0.9276 4.2228 4.2228 7.1882 7.1882 19.8121 19.8121 24.2610 24.2610 k = 0.5903 0.0281 0.3515 ( 355 PWs) bands (ev): -2.8062 -2.8062 1.0042 1.0042 4.0715 4.0715 7.1508 7.1508 19.7003 19.7003 24.2344 24.2344 k = 0.5926 0.0214 0.3553 ( 355 PWs) bands (ev): -2.7468 -2.7468 1.0811 1.0811 3.9222 3.9222 7.1139 7.1139 19.5923 19.5923 24.1975 24.1975 k = 0.5949 0.0147 0.3591 ( 355 PWs) bands (ev): -2.6874 -2.6874 1.1582 1.1582 3.7759 3.7759 7.0776 7.0776 19.4882 19.4882 24.1507 24.1507 k = 0.5972 0.0080 0.3629 ( 355 PWs) bands (ev): -2.6284 -2.6284 1.2348 1.2348 3.6333 3.6333 7.0419 7.0419 19.3879 19.3879 24.0948 24.0948 k = 0.5995 0.0013 0.3667 ( 355 PWs) bands (ev): -2.5699 -2.5699 1.3102 1.3102 3.4953 3.4953 7.0069 7.0069 19.2914 19.2914 24.0306 24.0306 k = 0.6019-0.0053 0.3704 ( 353 PWs) bands (ev): -2.5123 -2.5123 1.3838 1.3838 3.3633 3.3633 6.9726 6.9726 19.1988 19.1988 23.9590 23.9590 k = 0.6042-0.0120 0.3742 ( 353 PWs) bands (ev): -2.4560 -2.4560 1.4541 1.4541 3.2387 3.2387 6.9392 6.9392 19.1101 19.1101 23.8809 23.8809 k = 0.6065-0.0187 0.3780 ( 353 PWs) bands (ev): -2.4013 -2.4013 1.5195 1.5195 3.1238 3.1238 6.9065 6.9065 19.0252 19.0252 23.7971 23.7971 k = 0.6088-0.0254 0.3818 ( 351 PWs) bands (ev): -2.3487 -2.3487 1.5780 1.5780 3.0213 3.0213 6.8748 6.8748 18.9442 18.9442 23.7085 23.7085 k = 0.6111-0.0321 0.3856 ( 351 PWs) bands (ev): -2.2988 -2.2988 1.6265 1.6265 2.9344 2.9344 6.8440 6.8440 18.8670 18.8670 23.6157 23.6157 k = 0.6134-0.0388 0.3893 ( 353 PWs) bands (ev): -2.2520 -2.2520 1.6617 1.6617 2.8671 2.8671 6.8142 6.8142 18.7936 18.7936 23.5193 23.5193 k = 0.6157-0.0454 0.3931 ( 353 PWs) bands (ev): -2.2091 -2.2091 1.6808 1.6808 2.8231 2.8231 6.7854 6.7854 18.7241 18.7241 23.4201 23.4201 k = 0.6181-0.0521 0.3969 ( 349 PWs) bands (ev): -2.1707 -2.1707 1.6823 1.6823 2.8049 2.8049 6.7577 6.7577 18.6584 18.6584 23.3186 23.3186 k = 0.6204-0.0588 0.4007 ( 347 PWs) bands (ev): -2.1375 -2.1375 1.6668 1.6668 2.8120 2.8120 6.7312 6.7312 18.5966 18.5966 23.2153 23.2153 k = 0.6227-0.0655 0.4045 ( 347 PWs) bands (ev): -2.1105 -2.1105 1.6379 1.6379 2.8418 2.8418 6.7057 6.7057 18.5386 18.5386 23.1107 23.1107 k = 0.6250-0.0722 0.4082 ( 347 PWs) bands (ev): -2.0905 -2.0905 1.6004 1.6004 2.8903 2.8903 6.6814 6.6814 18.4844 18.4844 23.0052 23.0052 k = 0.6250-0.0722 0.4082 ( 347 PWs) bands (ev): -2.0905 -2.0905 1.6004 1.6004 2.8903 2.8903 6.6814 6.6814 18.4844 18.4844 23.0052 23.0052 k = 0.6210-0.0698 0.4148 ( 347 PWs) bands (ev): -2.0899 -2.0899 1.6015 1.6015 2.8909 2.8909 6.6766 6.6766 18.4886 18.4886 23.0074 23.0074 k = 0.6169-0.0675 0.4214 ( 347 PWs) bands (ev): -2.0881 -2.0881 1.6048 1.6048 2.8926 2.8926 6.6620 6.6620 18.5012 18.5012 23.0138 23.0138 k = 0.6129-0.0652 0.4280 ( 349 PWs) bands (ev): -2.0851 -2.0851 1.6103 1.6103 2.8953 2.8953 6.6379 6.6379 18.5220 18.5220 23.0244 23.0244 k = 0.6089-0.0629 0.4346 ( 349 PWs) bands (ev): -2.0809 -2.0809 1.6180 1.6180 2.8992 2.8992 6.6045 6.6045 18.5508 18.5508 23.0395 23.0395 k = 0.6048-0.0605 0.4412 ( 349 PWs) bands (ev): -2.0756 -2.0756 1.6279 1.6279 2.9042 2.9042 6.5621 6.5621 18.5870 18.5870 23.0591 23.0591 k = 0.6008-0.0582 0.4478 ( 346 PWs) bands (ev): -2.0691 -2.0691 1.6401 1.6401 2.9102 2.9102 6.5113 6.5113 18.6302 18.6302 23.0835 23.0835 k = 0.5968-0.0559 0.4543 ( 346 PWs) bands (ev): -2.0615 -2.0615 1.6544 1.6544 2.9171 2.9171 6.4522 6.4522 18.6796 18.6796 23.1125 23.1125 k = 0.5927-0.0535 0.4609 ( 352 PWs) bands (ev): -2.0529 -2.0529 1.6707 1.6707 2.9245 2.9245 6.3854 6.3854 18.7346 18.7346 23.1465 23.1465 k = 0.5887-0.0512 0.4675 ( 352 PWs) bands (ev): -2.0432 -2.0432 1.6894 1.6894 2.9328 2.9328 6.3117 6.3117 18.7944 18.7944 23.1858 23.1858 k = 0.5847-0.0489 0.4741 ( 354 PWs) bands (ev): -2.0325 -2.0325 1.7102 1.7102 2.9418 2.9418 6.2314 6.2314 18.8582 18.8582 23.2306 23.2306 k = 0.5806-0.0466 0.4807 ( 354 PWs) bands (ev): -2.0209 -2.0209 1.7332 1.7332 2.9512 2.9512 6.1456 6.1456 18.9251 18.9251 23.2810 23.2810 k = 0.5766-0.0442 0.4873 ( 352 PWs) bands (ev): -2.0083 -2.0083 1.7585 1.7585 2.9608 2.9608 6.0550 6.0550 18.9940 18.9940 23.3375 23.3375 k = 0.5726-0.0419 0.4938 ( 352 PWs) bands (ev): -1.9949 -1.9949 1.7858 1.7858 2.9704 2.9704 5.9602 5.9602 19.0642 19.0642 23.4000 23.4000 k = 0.5685-0.0396 0.5004 ( 352 PWs) bands (ev): -1.9808 -1.9808 1.8153 1.8153 2.9797 2.9797 5.8620 5.8620 19.1347 19.1347 23.4690 23.4690 k = 0.5645-0.0372 0.5070 ( 353 PWs) bands (ev): -1.9660 -1.9660 1.8469 1.8469 2.9885 2.9885 5.7614 5.7614 19.2047 19.2047 23.5444 23.5444 k = 0.5605-0.0349 0.5136 ( 353 PWs) bands (ev): -1.9506 -1.9506 1.8806 1.8806 2.9962 2.9962 5.6594 5.6594 19.2732 19.2732 23.6266 23.6266 k = 0.5565-0.0326 0.5202 ( 353 PWs) bands (ev): -1.9347 -1.9347 1.9164 1.9164 3.0026 3.0026 5.5569 5.5569 19.3395 19.3395 23.7154 23.7154 k = 0.5524-0.0303 0.5268 ( 350 PWs) bands (ev): -1.9185 -1.9185 1.9544 1.9544 3.0071 3.0071 5.4550 5.4550 19.4030 19.4030 23.8109 23.8109 k = 0.5484-0.0279 0.5334 ( 350 PWs) bands (ev): -1.9020 -1.9020 1.9944 1.9944 3.0090 3.0090 5.3548 5.3548 19.4629 19.4629 23.9131 23.9131 k = 0.5444-0.0256 0.5399 ( 350 PWs) bands (ev): -1.8855 -1.8855 2.0364 2.0364 3.0077 3.0077 5.2575 5.2575 19.5187 19.5187 24.0216 24.0216 k = 0.5403-0.0233 0.5465 ( 350 PWs) bands (ev): -1.8691 -1.8691 2.0804 2.0804 3.0026 3.0026 5.1643 5.1643 19.5701 19.5701 24.1363 24.1363 k = 0.5363-0.0210 0.5531 ( 350 PWs) bands (ev): -1.8529 -1.8529 2.1265 2.1265 2.9928 2.9928 5.0765 5.0765 19.6167 19.6167 24.2567 24.2567 k = 0.5323-0.0186 0.5597 ( 350 PWs) bands (ev): -1.8372 -1.8372 2.1746 2.1746 2.9777 2.9777 4.9954 4.9954 19.6583 19.6583 24.3825 24.3825 k = 0.5282-0.0163 0.5663 ( 352 PWs) bands (ev): -1.8223 -1.8223 2.2246 2.2246 2.9565 2.9565 4.9220 4.9220 19.6946 19.6946 24.5130 24.5130 k = 0.5242-0.0140 0.5729 ( 352 PWs) bands (ev): -1.8082 -1.8082 2.2766 2.2766 2.9286 2.9286 4.8577 4.8577 19.7258 19.7258 24.6478 24.6478 k = 0.5202-0.0116 0.5794 ( 358 PWs) bands (ev): -1.7954 -1.7954 2.3305 2.3305 2.8938 2.8938 4.8029 4.8029 19.7517 19.7517 24.7861 24.7861 k = 0.5161-0.0093 0.5860 ( 360 PWs) bands (ev): -1.7842 -1.7842 2.3863 2.3863 2.8521 2.8521 4.7584 4.7584 19.7726 19.7726 24.9272 24.9272 k = 0.5121-0.0070 0.5926 ( 360 PWs) bands (ev): -1.7747 -1.7747 2.4440 2.4440 2.8039 2.8039 4.7246 4.7246 19.7884 19.7884 25.0705 25.0705 k = 0.5081-0.0047 0.5992 ( 360 PWs) bands (ev): -1.7675 -1.7675 2.5035 2.5035 2.7498 2.7498 4.7011 4.7011 19.7995 19.7995 25.2152 25.2152 k = 0.5040-0.0023 0.6058 ( 360 PWs) bands (ev): -1.7629 -1.7629 2.5649 2.5649 2.6908 2.6908 4.6875 4.6875 19.8060 19.8060 25.3606 25.3606 k = 0.5000 0.0000 0.6124 ( 360 PWs) bands (ev): -1.7612 -1.7612 2.6254 2.6254 2.6308 2.6308 4.6832 4.6832 19.8081 19.8081 25.5032 25.5032 k = 0.5000 0.0000 0.6124 ( 360 PWs) bands (ev): -1.7612 -1.7612 2.6254 2.6254 2.6308 2.6308 4.6832 4.6832 19.8081 19.8081 25.5032 25.5032 k = 0.5000 0.0047 0.6058 ( 360 PWs) bands (ev): -1.7642 -1.7642 2.6210 2.6210 2.6333 2.6333 4.6901 4.6901 19.8090 19.8090 25.5024 25.5024 k = 0.5000 0.0093 0.5992 ( 360 PWs) bands (ev): -1.7730 -1.7730 2.6025 2.6025 2.6464 2.6464 4.7105 4.7105 19.8116 19.8116 25.4963 25.4963 k = 0.5000 0.0140 0.5926 ( 360 PWs) bands (ev): -1.7875 -1.7875 2.5718 2.5718 2.6687 2.6687 4.7436 4.7436 19.8160 19.8160 25.4851 25.4851 k = 0.5000 0.0186 0.5860 ( 360 PWs) bands (ev): -1.8076 -1.8076 2.5303 2.5303 2.6998 2.6998 4.7883 4.7883 19.8222 19.8222 25.4692 25.4692 k = 0.5000 0.0233 0.5794 ( 356 PWs) bands (ev): -1.8329 -1.8329 2.4795 2.4795 2.7395 2.7395 4.8433 4.8433 19.8303 19.8303 25.4491 25.4491 k = 0.5000 0.0279 0.5729 ( 356 PWs) bands (ev): -1.8632 -1.8632 2.4207 2.4207 2.7871 2.7871 4.9071 4.9071 19.8404 19.8404 25.4245 25.4245 k = 0.5000 0.0326 0.5663 ( 356 PWs) bands (ev): -1.8981 -1.8981 2.3552 2.3552 2.8425 2.8425 4.9782 4.9782 19.8525 19.8525 25.3957 25.3957 k = 0.5000 0.0372 0.5597 ( 354 PWs) bands (ev): -1.9373 -1.9373 2.2844 2.2844 2.9052 2.9052 5.0558 5.0558 19.8669 19.8669 25.3631 25.3631 k = 0.5000 0.0419 0.5531 ( 354 PWs) bands (ev): -1.9803 -1.9803 2.2093 2.2093 2.9747 2.9747 5.1382 5.1382 19.8835 19.8835 25.3267 25.3267 k = 0.5000 0.0466 0.5465 ( 354 PWs) bands (ev): -2.0267 -2.0267 2.1307 2.1307 3.0507 3.0507 5.2247 5.2247 19.9025 19.9025 25.2867 25.2867 k = 0.5000 0.0512 0.5399 ( 354 PWs) bands (ev): -2.0762 -2.0762 2.0496 2.0496 3.1327 3.1327 5.3144 5.3144 19.9242 19.9242 25.2434 25.2434 k = 0.5000 0.0559 0.5334 ( 354 PWs) bands (ev): -2.1283 -2.1283 1.9665 1.9665 3.2204 3.2204 5.4067 5.4067 19.9485 19.9485 25.1969 25.1969 k = 0.5000 0.0605 0.5268 ( 354 PWs) bands (ev): -2.1828 -2.1828 1.8818 1.8818 3.3131 3.3131 5.5012 5.5012 19.9759 19.9759 25.1474 25.1474 k = 0.5000 0.0652 0.5202 ( 354 PWs) bands (ev): -2.2391 -2.2391 1.7964 1.7964 3.4107 3.4107 5.5967 5.5967 20.0063 20.0063 25.0952 25.0952 k = 0.5000 0.0698 0.5136 ( 354 PWs) bands (ev): -2.2970 -2.2970 1.7104 1.7104 3.5128 3.5128 5.6931 5.6931 20.0399 20.0399 25.0404 25.0404 k = 0.5000 0.0745 0.5070 ( 354 PWs) bands (ev): -2.3563 -2.3563 1.6243 1.6243 3.6189 3.6189 5.7901 5.7901 20.0769 20.0769 24.9833 24.9833 k = 0.5000 0.0792 0.5004 ( 354 PWs) bands (ev): -2.4165 -2.4165 1.5382 1.5382 3.7288 3.7288 5.8872 5.8872 20.1175 20.1175 24.9240 24.9240 k = 0.5000 0.0838 0.4938 ( 354 PWs) bands (ev): -2.4775 -2.4775 1.4524 1.4524 3.8422 3.8422 5.9841 5.9841 20.1620 20.1620 24.8628 24.8628 k = 0.5000 0.0885 0.4873 ( 354 PWs) bands (ev): -2.5390 -2.5390 1.3672 1.3672 3.9585 3.9585 6.0805 6.0805 20.2103 20.2103 24.7997 24.7997 k = 0.5000 0.0931 0.4807 ( 354 PWs) bands (ev): -2.6008 -2.6008 1.2827 1.2827 4.0776 4.0776 6.1763 6.1763 20.2628 20.2628 24.7349 24.7349 k = 0.5000 0.0978 0.4741 ( 354 PWs) bands (ev): -2.6626 -2.6626 1.1991 1.1991 4.1992 4.1992 6.2711 6.2711 20.3196 20.3196 24.6686 24.6686 k = 0.5000 0.1024 0.4675 ( 354 PWs) bands (ev): -2.7244 -2.7244 1.1166 1.1166 4.3231 4.3231 6.3647 6.3647 20.3808 20.3808 24.6010 24.6010 k = 0.5000 0.1071 0.4609 ( 352 PWs) bands (ev): -2.7858 -2.7858 1.0352 1.0352 4.4491 4.4491 6.4570 6.4570 20.4466 20.4466 24.5321 24.5321 k = 0.5000 0.1117 0.4543 ( 354 PWs) bands (ev): -2.8469 -2.8469 0.9551 0.9551 4.5767 4.5767 6.5478 6.5478 20.5171 20.5171 24.4619 24.4619 k = 0.5000 0.1164 0.4478 ( 354 PWs) bands (ev): -2.9074 -2.9074 0.8763 0.8763 4.7058 4.7058 6.6368 6.6368 20.5925 20.5925 24.3909 24.3909 k = 0.5000 0.1211 0.4412 ( 354 PWs) bands (ev): -2.9673 -2.9673 0.7990 0.7990 4.8362 4.8362 6.7240 6.7240 20.6729 20.6729 24.3189 24.3189 k = 0.5000 0.1257 0.4346 ( 354 PWs) bands (ev): -3.0263 -3.0263 0.7231 0.7231 4.9676 4.9676 6.8093 6.8093 20.7584 20.7584 24.2461 24.2461 k = 0.5000 0.1304 0.4280 ( 354 PWs) bands (ev): -3.0844 -3.0844 0.6489 0.6489 5.0998 5.0998 6.8925 6.8925 20.8491 20.8491 24.1726 24.1726 k = 0.5000 0.1350 0.4214 ( 354 PWs) bands (ev): -3.1415 -3.1415 0.5764 0.5764 5.2326 5.2326 6.9734 6.9734 20.9450 20.9450 24.0985 24.0985 k = 0.5000 0.1397 0.4148 ( 354 PWs) bands (ev): -3.1976 -3.1976 0.5056 0.5056 5.3657 5.3657 7.0521 7.0521 21.0463 21.0463 24.0237 24.0237 k = 0.5000 0.1443 0.4082 ( 358 PWs) bands (ev): -3.2525 -3.2525 0.4364 0.4364 5.4989 5.4989 7.1284 7.1284 21.1529 21.1529 23.9485 23.9485 k = 0.5000 0.1490 0.4017 ( 350 PWs) bands (ev): -3.3061 -3.3061 0.3693 0.3693 5.6324 5.6324 7.2027 7.2027 21.2651 21.2651 23.8729 23.8729 k = 0.5000 0.1536 0.3951 ( 350 PWs) bands (ev): -3.3584 -3.3584 0.3039 0.3039 5.7652 5.7652 7.2740 7.2740 21.3826 21.3826 23.7970 23.7970 k = 0.5000 0.1583 0.3885 ( 350 PWs) bands (ev): -3.4094 -3.4094 0.2405 0.2405 5.8974 5.8974 7.3428 7.3428 21.5056 21.5056 23.7208 23.7208 k = 0.5000 0.1630 0.3819 ( 350 PWs) bands (ev): -3.4590 -3.4590 0.1790 0.1790 6.0288 6.0288 7.4090 7.4090 21.6341 21.6341 23.6446 23.6446 k = 0.5000 0.1676 0.3753 ( 350 PWs) bands (ev): -3.5070 -3.5070 0.1195 0.1195 6.1591 6.1591 7.4725 7.4725 21.7679 21.7679 23.5682 23.5682 k = 0.5000 0.1723 0.3687 ( 350 PWs) bands (ev): -3.5536 -3.5536 0.0620 0.0620 6.2881 6.2881 7.5335 7.5335 21.9071 21.9071 23.4919 23.4919 k = 0.5000 0.1769 0.3622 ( 350 PWs) bands (ev): -3.5986 -3.5986 0.0066 0.0066 6.4155 6.4155 7.5917 7.5917 22.0515 22.0515 23.4158 23.4158 k = 0.5000 0.1816 0.3556 ( 354 PWs) bands (ev): -3.6421 -3.6421 -0.0468 -0.0468 6.5408 6.5408 7.6472 7.6472 22.2011 22.2011 23.3399 23.3399 k = 0.5000 0.1862 0.3490 ( 352 PWs) bands (ev): -3.6839 -3.6839 -0.0980 -0.0980 6.6643 6.6643 7.7001 7.7001 22.3558 22.3558 23.2645 23.2645 k = 0.5000 0.1909 0.3424 ( 352 PWs) bands (ev): -3.7240 -3.7240 -0.1471 -0.1471 6.7852 6.7852 7.7503 7.7503 22.5154 22.5154 23.1898 23.1898 k = 0.5000 0.1956 0.3358 ( 352 PWs) bands (ev): -3.7624 -3.7624 -0.1941 -0.1941 6.9035 6.9035 7.7979 7.7979 22.6798 22.6798 23.1159 23.1159 k = 0.5000 0.2002 0.3292 ( 352 PWs) bands (ev): -3.7991 -3.7991 -0.2389 -0.2389 7.0188 7.0188 7.8429 7.8429 22.8488 22.8488 23.0429 23.0429 k = 0.5000 0.2049 0.3226 ( 350 PWs) bands (ev): -3.8341 -3.8341 -0.2815 -0.2815 7.1310 7.1310 7.8852 7.8852 22.9712 22.9712 23.0221 23.0221 k = 0.5000 0.2095 0.3161 ( 350 PWs) bands (ev): -3.8672 -3.8672 -0.3219 -0.3219 7.2393 7.2393 7.9250 7.9250 22.9009 22.9009 23.1995 23.1995 k = 0.5000 0.2142 0.3095 ( 350 PWs) bands (ev): -3.8986 -3.8986 -0.3601 -0.3601 7.3437 7.3437 7.9623 7.9623 22.8324 22.8324 23.3808 23.3808 k = 0.5000 0.2188 0.3029 ( 350 PWs) bands (ev): -3.9282 -3.9282 -0.3960 -0.3960 7.4439 7.4439 7.9970 7.9970 22.7658 22.7658 23.5655 23.5655 k = 0.5000 0.2235 0.2963 ( 350 PWs) bands (ev): -3.9559 -3.9559 -0.4296 -0.4296 7.5395 7.5395 8.0293 8.0293 22.7014 22.7014 23.7534 23.7534 k = 0.5000 0.2281 0.2897 ( 348 PWs) bands (ev): -3.9818 -3.9818 -0.4610 -0.4610 7.6303 7.6303 8.0592 8.0592 22.6397 22.6397 23.9441 23.9441 k = 0.5000 0.2328 0.2831 ( 348 PWs) bands (ev): -4.0058 -4.0058 -0.4901 -0.4901 7.7159 7.7159 8.0867 8.0867 22.5808 22.5808 24.1369 24.1369 k = 0.5000 0.2375 0.2766 ( 348 PWs) bands (ev): -4.0280 -4.0280 -0.5169 -0.5169 7.7960 7.7960 8.1118 8.1118 22.5252 22.5252 24.3314 24.3314 k = 0.5000 0.2421 0.2700 ( 348 PWs) bands (ev): -4.0482 -4.0482 -0.5414 -0.5414 7.8703 7.8703 8.1346 8.1346 22.4730 22.4730 24.5269 24.5269 k = 0.5000 0.2468 0.2634 ( 344 PWs) bands (ev): -4.0666 -4.0666 -0.5636 -0.5636 7.9387 7.9387 8.1552 8.1552 22.4247 22.4247 24.7226 24.7226 k = 0.5000 0.2514 0.2568 ( 346 PWs) bands (ev): -4.0830 -4.0830 -0.5835 -0.5835 8.0004 8.0004 8.1734 8.1734 22.3804 22.3804 24.9173 24.9173 k = 0.5000 0.2561 0.2502 ( 346 PWs) bands (ev): -4.0976 -4.0976 -0.6011 -0.6011 8.0556 8.0556 8.1894 8.1894 22.3406 22.3406 25.1098 25.1098 k = 0.5000 0.2607 0.2436 ( 344 PWs) bands (ev): -4.1102 -4.1102 -0.6163 -0.6163 8.1041 8.1041 8.2033 8.2033 22.3055 22.3055 25.2984 25.2984 k = 0.5000 0.2654 0.2370 ( 344 PWs) bands (ev): -4.1209 -4.1209 -0.6292 -0.6292 8.1453 8.1453 8.2150 8.2150 22.2754 22.2754 25.4806 25.4806 k = 0.5000 0.2701 0.2305 ( 344 PWs) bands (ev): -4.1296 -4.1296 -0.6397 -0.6397 8.1793 8.1793 8.2247 8.2247 22.2504 22.2504 25.6528 25.6528 k = 0.5000 0.2747 0.2239 ( 344 PWs) bands (ev): -4.1364 -4.1364 -0.6480 -0.6480 8.2055 8.2055 8.2324 8.2324 22.2308 22.2308 25.8091 25.8091 k = 0.5000 0.2794 0.2173 ( 344 PWs) bands (ev): -4.1413 -4.1413 -0.6538 -0.6538 8.2238 8.2238 8.2386 8.2386 22.2167 22.2167 25.9401 25.9401 k = 0.5000 0.2840 0.2107 ( 344 PWs) bands (ev): -4.1442 -4.1442 -0.6574 -0.6574 8.2335 8.2335 8.2436 8.2436 22.2081 22.2081 26.0310 26.0310 k = 0.5000 0.2887 0.2041 ( 344 PWs) bands (ev): -4.1452 -4.1452 -0.6585 -0.6585 8.2361 8.2361 8.2458 8.2458 22.2053 22.2053 26.0643 26.0643 k = 0.5000 0.2887 0.2041 ( 344 PWs) bands (ev): -4.1452 -4.1452 -0.6585 -0.6585 8.2361 8.2361 8.2458 8.2458 22.2053 22.2053 26.0643 26.0643 k = 0.4977 0.2873 0.2117 ( 344 PWs) bands (ev): -4.1442 -4.1442 -0.6574 -0.6574 8.2335 8.2335 8.2436 8.2436 22.2081 22.2081 26.0314 26.0314 k = 0.4954 0.2860 0.2192 ( 344 PWs) bands (ev): -4.1413 -4.1413 -0.6539 -0.6539 8.2239 8.2239 8.2387 8.2387 22.2165 22.2165 25.9414 25.9414 k = 0.4931 0.2847 0.2268 ( 344 PWs) bands (ev): -4.1365 -4.1365 -0.6481 -0.6481 8.2059 8.2059 8.2326 8.2326 22.2305 22.2305 25.8116 25.8116 k = 0.4907 0.2833 0.2344 ( 344 PWs) bands (ev): -4.1298 -4.1298 -0.6400 -0.6400 8.1798 8.1798 8.2250 8.2250 22.2499 22.2499 25.6566 25.6566 k = 0.4884 0.2820 0.2419 ( 344 PWs) bands (ev): -4.1212 -4.1212 -0.6295 -0.6295 8.1461 8.1461 8.2156 8.2156 22.2746 22.2746 25.4858 25.4858 k = 0.4861 0.2807 0.2495 ( 344 PWs) bands (ev): -4.1106 -4.1106 -0.6167 -0.6167 8.1051 8.1051 8.2043 8.2043 22.3043 22.3043 25.3050 25.3050 k = 0.4838 0.2793 0.2570 ( 346 PWs) bands (ev): -4.0981 -4.0981 -0.6017 -0.6017 8.0566 8.0566 8.1911 8.1911 22.3388 22.3388 25.1180 25.1180 k = 0.4815 0.2780 0.2646 ( 345 PWs) bands (ev): -4.0837 -4.0837 -0.5843 -0.5843 8.0014 8.0014 8.1760 8.1760 22.3777 22.3777 24.9274 24.9274 k = 0.4792 0.2766 0.2722 ( 345 PWs) bands (ev): -4.0675 -4.0675 -0.5646 -0.5646 7.9392 7.9392 8.1590 8.1590 22.4205 22.4205 24.7351 24.7351 k = 0.4769 0.2753 0.2797 ( 349 PWs) bands (ev): -4.0493 -4.0493 -0.5428 -0.5428 7.8701 7.8701 8.1402 8.1402 22.4666 22.4666 24.5426 24.5426 k = 0.4745 0.2740 0.2873 ( 349 PWs) bands (ev): -4.0293 -4.0293 -0.5185 -0.5185 7.7947 7.7947 8.1197 8.1197 22.5151 22.5151 24.3519 24.3519 k = 0.4722 0.2726 0.2948 ( 351 PWs) bands (ev): -4.0074 -4.0074 -0.4921 -0.4921 7.7131 7.7131 8.0974 8.0974 22.5647 22.5647 24.1643 24.1643 k = 0.4699 0.2713 0.3024 ( 351 PWs) bands (ev): -3.9837 -3.9837 -0.4633 -0.4633 7.6254 7.6254 8.0736 8.0736 22.6134 22.6134 23.9825 23.9825 k = 0.4676 0.2700 0.3100 ( 351 PWs) bands (ev): -3.9581 -3.9581 -0.4322 -0.4322 7.5320 7.5320 8.0483 8.0483 22.6579 22.6579 23.8099 23.8099 k = 0.4653 0.2686 0.3175 ( 349 PWs) bands (ev): -3.9306 -3.9306 -0.3989 -0.3989 7.4330 7.4330 8.0216 8.0216 22.6924 22.6924 23.6524 23.6524 k = 0.4630 0.2673 0.3251 ( 349 PWs) bands (ev): -3.9014 -3.9014 -0.3634 -0.3634 7.3287 7.3287 7.9934 7.9934 22.7067 22.7067 23.5200 23.5200 k = 0.4606 0.2660 0.3326 ( 349 PWs) bands (ev): -3.8703 -3.8703 -0.3257 -0.3257 7.2194 7.2194 7.9638 7.9638 22.6866 22.6866 23.4269 23.4269 k = 0.4583 0.2646 0.3402 ( 349 PWs) bands (ev): -3.8375 -3.8375 -0.2858 -0.2858 7.1052 7.1052 7.9331 7.9331 22.6212 22.6212 23.3840 23.3840 k = 0.4560 0.2633 0.3478 ( 349 PWs) bands (ev): -3.8030 -3.8030 -0.2437 -0.2437 6.9865 6.9865 7.9011 7.9011 22.5144 22.5144 23.3871 23.3871 k = 0.4537 0.2619 0.3553 ( 351 PWs) bands (ev): -3.7667 -3.7667 -0.1994 -0.1994 6.8632 6.8632 7.8681 7.8681 22.3803 22.3803 23.4217 23.4217 k = 0.4514 0.2606 0.3629 ( 350 PWs) bands (ev): -3.7287 -3.7287 -0.1530 -0.1530 6.7363 6.7363 7.8341 7.8341 22.2315 22.2315 23.4753 23.4753 k = 0.4491 0.2593 0.3704 ( 350 PWs) bands (ev): -3.6890 -3.6890 -0.1044 -0.1044 6.6055 6.6055 7.7992 7.7992 22.0754 22.0754 23.5394 23.5394 k = 0.4468 0.2579 0.3780 ( 352 PWs) bands (ev): -3.6477 -3.6477 -0.0538 -0.0538 6.4711 6.4711 7.7634 7.7634 21.9165 21.9165 23.6095 23.6095 k = 0.4444 0.2566 0.3856 ( 350 PWs) bands (ev): -3.6048 -3.6048 -0.0011 -0.0011 6.3337 6.3337 7.7270 7.7270 21.7571 21.7571 23.6828 23.6828 k = 0.4421 0.2553 0.3931 ( 350 PWs) bands (ev): -3.5603 -3.5603 0.0537 0.0537 6.1932 6.1932 7.6900 7.6900 21.5986 21.5986 23.7570 23.7570 k = 0.4398 0.2539 0.4007 ( 352 PWs) bands (ev): -3.5143 -3.5143 0.1104 0.1104 6.0500 6.0500 7.6522 7.6522 21.4420 21.4420 23.8307 23.8307 k = 0.4375 0.2526 0.4082 ( 356 PWs) bands (ev): -3.4669 -3.4669 0.1690 0.1690 5.9041 5.9041 7.6141 7.6141 21.2876 21.2876 23.9024 23.9024 k = 0.4352 0.2513 0.4158 ( 355 PWs) bands (ev): -3.4179 -3.4179 0.2297 0.2297 5.7563 5.7563 7.5756 7.5756 21.1362 21.1362 23.9712 23.9712 k = 0.4329 0.2499 0.4234 ( 355 PWs) bands (ev): -3.3676 -3.3676 0.2922 0.2922 5.6066 5.6066 7.5369 7.5369 20.9879 20.9879 24.0358 24.0358 k = 0.4306 0.2486 0.4309 ( 355 PWs) bands (ev): -3.3160 -3.3160 0.3565 0.3565 5.4553 5.4553 7.4980 7.4980 20.8428 20.8428 24.0951 24.0951 k = 0.4282 0.2472 0.4385 ( 355 PWs) bands (ev): -3.2631 -3.2631 0.4227 0.4227 5.3027 5.3027 7.4589 7.4589 20.7011 20.7011 24.1480 24.1480 k = 0.4259 0.2459 0.4460 ( 355 PWs) bands (ev): -3.2091 -3.2091 0.4905 0.4905 5.1490 5.1490 7.4198 7.4198 20.5630 20.5630 24.1933 24.1933 k = 0.4236 0.2446 0.4536 ( 353 PWs) bands (ev): -3.1539 -3.1539 0.5599 0.5599 4.9946 4.9946 7.3808 7.3808 20.4285 20.4285 24.2302 24.2302 k = 0.4213 0.2432 0.4612 ( 355 PWs) bands (ev): -3.0977 -3.0977 0.6309 0.6309 4.8395 4.8395 7.3417 7.3417 20.2977 20.2977 24.2575 24.2575 k = 0.4190 0.2419 0.4687 ( 355 PWs) bands (ev): -3.0407 -3.0407 0.7033 0.7033 4.6845 4.6845 7.3029 7.3029 20.1706 20.1706 24.2747 24.2747 k = 0.4167 0.2406 0.4763 ( 355 PWs) bands (ev): -2.9829 -2.9829 0.7770 0.7770 4.5298 4.5298 7.2643 7.2643 20.0473 20.0473 24.2812 24.2812 k = 0.4144 0.2392 0.4838 ( 355 PWs) bands (ev): -2.9245 -2.9245 0.8518 0.8518 4.3758 4.3758 7.2261 7.2261 19.9278 19.9278 24.2766 24.2766 k = 0.4120 0.2379 0.4914 ( 355 PWs) bands (ev): -2.8655 -2.8655 0.9276 0.9276 4.2228 4.2228 7.1882 7.1882 19.8121 19.8121 24.2610 24.2610 k = 0.4097 0.2366 0.4990 ( 355 PWs) bands (ev): -2.8062 -2.8062 1.0042 1.0042 4.0715 4.0715 7.1508 7.1508 19.7003 19.7003 24.2344 24.2344 k = 0.4074 0.2352 0.5065 ( 355 PWs) bands (ev): -2.7468 -2.7468 1.0811 1.0811 3.9222 3.9222 7.1139 7.1139 19.5923 19.5923 24.1975 24.1975 k = 0.4051 0.2339 0.5141 ( 355 PWs) bands (ev): -2.6874 -2.6874 1.1582 1.1582 3.7759 3.7759 7.0776 7.0776 19.4882 19.4882 24.1507 24.1507 k = 0.4028 0.2325 0.5217 ( 355 PWs) bands (ev): -2.6284 -2.6284 1.2348 1.2348 3.6333 3.6333 7.0419 7.0419 19.3879 19.3879 24.0948 24.0948 k = 0.4005 0.2312 0.5292 ( 355 PWs) bands (ev): -2.5699 -2.5699 1.3102 1.3102 3.4953 3.4953 7.0069 7.0069 19.2914 19.2914 24.0306 24.0306 k = 0.3981 0.2299 0.5368 ( 353 PWs) bands (ev): -2.5123 -2.5123 1.3838 1.3838 3.3633 3.3633 6.9726 6.9726 19.1988 19.1988 23.9590 23.9590 k = 0.3958 0.2285 0.5443 ( 353 PWs) bands (ev): -2.4560 -2.4560 1.4541 1.4541 3.2387 3.2387 6.9392 6.9392 19.1101 19.1101 23.8809 23.8809 k = 0.3935 0.2272 0.5519 ( 353 PWs) bands (ev): -2.4013 -2.4013 1.5195 1.5195 3.1238 3.1238 6.9065 6.9065 19.0252 19.0252 23.7971 23.7971 k = 0.3912 0.2259 0.5595 ( 351 PWs) bands (ev): -2.3487 -2.3487 1.5780 1.5780 3.0213 3.0213 6.8748 6.8748 18.9442 18.9442 23.7085 23.7085 k = 0.3889 0.2245 0.5670 ( 351 PWs) bands (ev): -2.2988 -2.2988 1.6265 1.6265 2.9344 2.9344 6.8440 6.8440 18.8670 18.8670 23.6157 23.6157 k = 0.3866 0.2232 0.5746 ( 353 PWs) bands (ev): -2.2520 -2.2520 1.6617 1.6617 2.8671 2.8671 6.8142 6.8142 18.7936 18.7936 23.5193 23.5193 k = 0.3843 0.2219 0.5821 ( 353 PWs) bands (ev): -2.2091 -2.2091 1.6808 1.6808 2.8231 2.8231 6.7854 6.7854 18.7241 18.7241 23.4201 23.4201 k = 0.3819 0.2205 0.5897 ( 349 PWs) bands (ev): -2.1707 -2.1707 1.6823 1.6823 2.8049 2.8049 6.7578 6.7578 18.6584 18.6584 23.3186 23.3186 k = 0.3796 0.2192 0.5973 ( 347 PWs) bands (ev): -2.1375 -2.1375 1.6668 1.6668 2.8120 2.8120 6.7312 6.7312 18.5966 18.5966 23.2153 23.2153 k = 0.3773 0.2178 0.6048 ( 347 PWs) bands (ev): -2.1105 -2.1105 1.6379 1.6379 2.8418 2.8418 6.7057 6.7057 18.5386 18.5386 23.1107 23.1107 k = 0.3750 0.2165 0.6124 ( 347 PWs) bands (ev): -2.0905 -2.0905 1.6004 1.6004 2.8903 2.8903 6.6814 6.6814 18.4844 18.4844 23.0052 23.0052 k = 0.6250-0.0722 0.4082 ( 347 PWs) bands (ev): -2.0905 -2.0905 1.6004 1.6004 2.8903 2.8903 6.6814 6.6814 18.4844 18.4844 23.0052 23.0052 k = 0.6210-0.0792 0.4082 ( 347 PWs) bands (ev): -2.0644 -2.0644 1.5316 1.5316 2.9918 2.9918 6.6407 6.6407 18.3942 18.3942 22.8197 22.8197 k = 0.6169-0.0861 0.4082 ( 347 PWs) bands (ev): -2.0430 -2.0430 1.4649 1.4649 3.0994 3.0994 6.6008 6.6008 18.3060 18.3060 22.6318 22.6318 k = 0.6129-0.0931 0.4082 ( 355 PWs) bands (ev): -2.0257 -2.0257 1.4000 1.4000 3.2121 3.2121 6.5618 6.5618 18.2195 18.2195 22.4420 22.4420 k = 0.6089-0.1001 0.4082 ( 359 PWs) bands (ev): -2.0123 -2.0123 1.3372 1.3372 3.3299 3.3299 6.5240 6.5240 18.1347 18.1347 22.2514 22.2514 k = 0.6048-0.1071 0.4082 ( 359 PWs) bands (ev): -2.0022 -2.0022 1.2768 1.2768 3.4521 3.4521 6.4873 6.4873 18.0517 18.0517 22.0604 22.0604 k = 0.6008-0.1141 0.4082 ( 359 PWs) bands (ev): -1.9952 -1.9952 1.2185 1.2185 3.5778 3.5778 6.4517 6.4517 17.9704 17.9704 21.8697 21.8697 k = 0.5968-0.1211 0.4082 ( 359 PWs) bands (ev): -1.9909 -1.9909 1.1624 1.1624 3.7066 3.7066 6.4172 6.4172 17.8906 17.8906 21.6800 21.6800 k = 0.5927-0.1280 0.4082 ( 359 PWs) bands (ev): -1.9889 -1.9889 1.1084 1.1084 3.8378 3.8378 6.3839 6.3839 17.8122 17.8122 21.4920 21.4920 k = 0.5887-0.1350 0.4082 ( 357 PWs) bands (ev): -1.9890 -1.9890 1.0566 1.0566 3.9707 3.9707 6.3520 6.3520 17.7353 17.7353 21.3063 21.3063 k = 0.5847-0.1420 0.4082 ( 357 PWs) bands (ev): -1.9908 -1.9908 1.0071 1.0071 4.1047 4.1047 6.3211 6.3211 17.6597 17.6597 21.1236 21.1236 k = 0.5806-0.1490 0.4082 ( 357 PWs) bands (ev): -1.9940 -1.9940 0.9597 0.9597 4.2392 4.2392 6.2915 6.2915 17.5855 17.5855 20.9447 20.9447 k = 0.5766-0.1560 0.4082 ( 357 PWs) bands (ev): -1.9984 -1.9984 0.9146 0.9146 4.3734 4.3734 6.2632 6.2632 17.5124 17.5124 20.7702 20.7702 k = 0.5726-0.1630 0.4082 ( 357 PWs) bands (ev): -2.0037 -2.0037 0.8717 0.8717 4.5068 4.5068 6.2362 6.2362 17.4406 17.4406 20.6009 20.6009 k = 0.5685-0.1699 0.4082 ( 353 PWs) bands (ev): -2.0097 -2.0097 0.8311 0.8311 4.6388 4.6388 6.2107 6.2107 17.3700 17.3700 20.4376 20.4376 k = 0.5645-0.1769 0.4082 ( 347 PWs) bands (ev): -2.0163 -2.0163 0.7928 0.7928 4.7689 4.7689 6.1865 6.1865 17.3006 17.3006 20.2807 20.2807 k = 0.5605-0.1839 0.4082 ( 347 PWs) bands (ev): -2.0233 -2.0233 0.7567 0.7567 4.8957 4.8957 6.1635 6.1635 17.2325 17.2325 20.1310 20.1310 k = 0.5565-0.1909 0.4082 ( 347 PWs) bands (ev): -2.0304 -2.0304 0.7229 0.7229 5.0190 5.0190 6.1419 6.1419 17.1658 17.1658 19.9891 19.9891 k = 0.5524-0.1979 0.4082 ( 346 PWs) bands (ev): -2.0376 -2.0376 0.6914 0.6914 5.1382 5.1382 6.1218 6.1218 17.1008 17.1008 19.8555 19.8555 k = 0.5484-0.2049 0.4082 ( 346 PWs) bands (ev): -2.0447 -2.0447 0.6622 0.6622 5.2522 5.2522 6.1030 6.1030 17.0377 17.0377 19.7306 19.7306 k = 0.5444-0.2119 0.4082 ( 346 PWs) bands (ev): -2.0517 -2.0517 0.6353 0.6353 5.3606 5.3606 6.0858 6.0858 16.9767 16.9767 19.6150 19.6150 k = 0.5403-0.2188 0.4082 ( 346 PWs) bands (ev): -2.0583 -2.0583 0.6107 0.6107 5.4627 5.4627 6.0699 6.0699 16.9184 16.9184 19.5090 19.5090 k = 0.5363-0.2258 0.4082 ( 346 PWs) bands (ev): -2.0646 -2.0646 0.5885 0.5885 5.5576 5.5576 6.0556 6.0556 16.8631 16.8631 19.4128 19.4128 k = 0.5323-0.2328 0.4082 ( 342 PWs) bands (ev): -2.0704 -2.0704 0.5686 0.5686 5.6451 5.6451 6.0427 6.0427 16.8115 16.8115 19.3266 19.3266 k = 0.5282-0.2398 0.4082 ( 342 PWs) bands (ev): -2.0757 -2.0757 0.5510 0.5510 5.7238 5.7238 6.0313 6.0313 16.7640 16.7640 19.2506 19.2506 k = 0.5242-0.2468 0.4082 ( 342 PWs) bands (ev): -2.0803 -2.0803 0.5357 0.5357 5.7934 5.7934 6.0215 6.0215 16.7213 16.7213 19.1848 19.1848 k = 0.5202-0.2538 0.4082 ( 342 PWs) bands (ev): -2.0844 -2.0844 0.5228 0.5228 5.8535 5.8535 6.0131 6.0131 16.6840 16.6840 19.1291 19.1291 k = 0.5161-0.2607 0.4082 ( 342 PWs) bands (ev): -2.0878 -2.0878 0.5122 0.5122 5.9033 5.9033 6.0063 6.0063 16.6525 16.6525 19.0837 19.0837 k = 0.5121-0.2677 0.4082 ( 342 PWs) bands (ev): -2.0904 -2.0904 0.5040 0.5040 5.9425 5.9425 6.0011 6.0011 16.6275 16.6275 19.0485 19.0485 k = 0.5081-0.2747 0.4082 ( 342 PWs) bands (ev): -2.0923 -2.0923 0.4981 0.4981 5.9705 5.9705 5.9976 5.9976 16.6093 16.6093 19.0233 19.0233 k = 0.5040-0.2817 0.4082 ( 342 PWs) bands (ev): -2.0935 -2.0935 0.4946 0.4946 5.9863 5.9863 5.9965 5.9965 16.5983 16.5983 19.0083 19.0083 k = 0.5000-0.2887 0.4082 ( 342 PWs) bands (ev): -2.0939 -2.0939 0.4934 0.4934 5.9900 5.9900 5.9978 5.9978 16.5946 16.5946 19.0033 19.0033 Writing output data file C.save init_run : 0.03s CPU 0.16s WALL ( 1 calls) electrons : 15.52s CPU 16.91s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.00s CPU 0.01s WALL ( 1 calls) Called by electrons: c_bands : 15.52s CPU 16.90s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.00s CPU 0.00s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.01s WALL ( 574 calls) cegterg : 14.17s CPU 14.52s WALL ( 575 calls) Called by sum_band: Called by *egterg: h_psi : 5.28s CPU 5.53s WALL ( 6758 calls) s_psi : 0.04s CPU 0.05s WALL ( 6758 calls) g_psi : 0.01s CPU 0.01s WALL ( 5609 calls) cdiaghg : 8.52s CPU 8.62s WALL ( 6183 calls) cegterg:over : 0.41s CPU 0.46s WALL ( 5609 calls) cegterg:upda : 0.28s CPU 0.33s WALL ( 5609 calls) cegterg:last : 0.10s CPU 0.14s WALL ( 1170 calls) cdiaghg:chol : 0.50s CPU 0.54s WALL ( 6183 calls) cdiaghg:inve : 0.14s CPU 0.13s WALL ( 6183 calls) cdiaghg:para : 0.74s CPU 0.69s WALL ( 12366 calls) Called by h_psi: h_psi:vloc : 5.00s CPU 5.24s WALL ( 6758 calls) h_psi:vnl : 0.24s CPU 0.27s WALL ( 6758 calls) add_vuspsi : 0.04s CPU 0.07s WALL ( 6758 calls) General routines calbec : 0.19s CPU 0.19s WALL ( 6758 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 4.78s CPU 4.97s WALL ( 204600 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.06s CPU 0.26s WALL ( 1148 calls) Parallel routines fft_scatter : 3.29s CPU 3.32s WALL ( 204623 calls) PWSCF : 20.44s CPU 41.84s WALL This run was terminated on: 17: 9: 2 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=