Program PWSCF v.5.1.1 starts on 26Jun2015 at 23:11:58 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./NbN.save/ file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 17 10 3 735 336 55 Max 18 11 4 741 353 62 Sum 817 499 151 35405 16437 2769 bravais-lattice index = 14 lattice parameter (alat) = 6.0660 a.u. unit-cell volume = 364.5689 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 36.00 number of Kohn-Sham states= 44 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 321.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.066020 celldm(2)= 1.000000 celldm(3)= 1.885981 celldm(4)= 0.000000 celldm(5)= 0.000000 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) = ( 0.000000 0.000000 1.885981 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.530228 ) PseudoPot. # 1 for Nb read from file: /home/autes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1227 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for N read from file: /home/autes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 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 Nb 13.00 92.90640 Nb( 1.00) N 5.00 14.00670 N( 1.00) 12 Sym. Ops. (no inversion) found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9429907 ) isym = 3 60 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 3) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9429907 ) isym = 4 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 4) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9429907 ) isym = 5 120 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 0 1 0 ) ( -1 -1 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 = 6 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 6) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9429907 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 1 1 0 ) ( 0 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. 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 9) = ( -0.5000000 0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9429907 ) isym = 10 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(10) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.9429907 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 1 1 0 ) ( 0 -1 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) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 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 C_6v (6mm) there are 9 classes and 3 irreducible representations the character table: E -E C2 2C3 -2C3 2C6 -2C6 3s_v 3s_d -C2 -3s_v -3s_d G_7 2.00 -2.00 0.00 1.00 -1.00 1.73 -1.73 0.00 0.00 G_8 2.00 -2.00 0.00 1.00 -1.00 -1.73 1.73 0.00 0.00 G_9 2.00 -2.00 0.00 -2.00 2.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 2C6 3 4 2C3 5 6 3s_v-3s_v 7 -7 9 10 -10 -9 3s_d-3s_d 8 -8 12 -11 11 -12 -E -1 -2C6 -3 -4 -2C3 -5 -6 Cartesian axes number of k points= 399 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 2) = ( 0.0087719 0.0050645 -0.0000000), wk = 0.0025063 k( 3) = ( 0.0175439 0.0101290 -0.0000000), wk = 0.0025063 k( 4) = ( 0.0263158 0.0151934 -0.0000000), wk = 0.0025063 k( 5) = ( 0.0350877 0.0202579 -0.0000000), wk = 0.0025063 k( 6) = ( 0.0438597 0.0253224 -0.0000000), wk = 0.0025063 k( 7) = ( 0.0526316 0.0303869 -0.0000000), wk = 0.0025063 k( 8) = ( 0.0614035 0.0354513 -0.0000000), wk = 0.0025063 k( 9) = ( 0.0701754 0.0405158 -0.0000000), wk = 0.0025063 k( 10) = ( 0.0789474 0.0455803 -0.0000000), wk = 0.0025063 k( 11) = ( 0.0877193 0.0506448 -0.0000000), wk = 0.0025063 k( 12) = ( 0.0964912 0.0557092 -0.0000000), wk = 0.0025063 k( 13) = ( 0.1052632 0.0607737 -0.0000000), wk = 0.0025063 k( 14) = ( 0.1140351 0.0658382 -0.0000000), wk = 0.0025063 k( 15) = ( 0.1228070 0.0709027 -0.0000000), wk = 0.0025063 k( 16) = ( 0.1315790 0.0759671 -0.0000000), wk = 0.0025063 k( 17) = ( 0.1403509 0.0810316 -0.0000000), wk = 0.0025063 k( 18) = ( 0.1491228 0.0860961 -0.0000000), wk = 0.0025063 k( 19) = ( 0.1578947 0.0911606 -0.0000000), wk = 0.0025063 k( 20) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0025063 k( 21) = ( 0.1754386 0.1012895 -0.0000000), wk = 0.0025063 k( 22) = ( 0.1842105 0.1063540 -0.0000000), wk = 0.0025063 k( 23) = ( 0.1929825 0.1114185 -0.0000000), wk = 0.0025063 k( 24) = ( 0.2017544 0.1164830 -0.0000000), wk = 0.0025063 k( 25) = ( 0.2105263 0.1215474 -0.0000000), wk = 0.0025063 k( 26) = ( 0.2192983 0.1266119 -0.0000000), wk = 0.0025063 k( 27) = ( 0.2280702 0.1316764 -0.0000000), wk = 0.0025063 k( 28) = ( 0.2368421 0.1367409 -0.0000000), wk = 0.0025063 k( 29) = ( 0.2456140 0.1418053 -0.0000000), wk = 0.0025063 k( 30) = ( 0.2543860 0.1468698 -0.0000000), wk = 0.0025063 k( 31) = ( 0.2631579 0.1519343 -0.0000000), wk = 0.0025063 k( 32) = ( 0.2719298 0.1569988 -0.0000000), wk = 0.0025063 k( 33) = ( 0.2807018 0.1620632 -0.0000000), wk = 0.0025063 k( 34) = ( 0.2894737 0.1671277 -0.0000000), wk = 0.0025063 k( 35) = ( 0.2982456 0.1721922 -0.0000000), wk = 0.0025063 k( 36) = ( 0.3070175 0.1772567 -0.0000000), wk = 0.0025063 k( 37) = ( 0.3157895 0.1823211 -0.0000000), wk = 0.0025063 k( 38) = ( 0.3245614 0.1873856 -0.0000000), wk = 0.0025063 k( 39) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0025063 k( 40) = ( 0.3421053 0.1975146 -0.0000000), wk = 0.0025063 k( 41) = ( 0.3508772 0.2025790 -0.0000000), wk = 0.0025063 k( 42) = ( 0.3596491 0.2076435 -0.0000000), wk = 0.0025063 k( 43) = ( 0.3684211 0.2127080 -0.0000000), wk = 0.0025063 k( 44) = ( 0.3771930 0.2177725 -0.0000000), wk = 0.0025063 k( 45) = ( 0.3859649 0.2228369 -0.0000000), wk = 0.0025063 k( 46) = ( 0.3947368 0.2279014 -0.0000000), wk = 0.0025063 k( 47) = ( 0.4035088 0.2329659 -0.0000000), wk = 0.0025063 k( 48) = ( 0.4122807 0.2380304 -0.0000000), wk = 0.0025063 k( 49) = ( 0.4210526 0.2430948 -0.0000000), wk = 0.0025063 k( 50) = ( 0.4298246 0.2481593 -0.0000000), wk = 0.0025063 k( 51) = ( 0.4385965 0.2532238 -0.0000000), wk = 0.0025063 k( 52) = ( 0.4473684 0.2582883 -0.0000000), wk = 0.0025063 k( 53) = ( 0.4561404 0.2633528 -0.0000000), wk = 0.0025063 k( 54) = ( 0.4649123 0.2684172 -0.0000000), wk = 0.0025063 k( 55) = ( 0.4736842 0.2734817 -0.0000000), wk = 0.0025063 k( 56) = ( 0.4824561 0.2785462 -0.0000000), wk = 0.0025063 k( 57) = ( 0.4912281 0.2836107 -0.0000000), wk = 0.0025063 k( 58) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0025063 k( 59) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0025063 k( 60) = ( 0.4949495 0.2974229 -0.0000000), wk = 0.0025063 k( 61) = ( 0.4898990 0.3061706 -0.0000000), wk = 0.0025063 k( 62) = ( 0.4848485 0.3149183 -0.0000000), wk = 0.0025063 k( 63) = ( 0.4797980 0.3236661 -0.0000000), wk = 0.0025063 k( 64) = ( 0.4747475 0.3324138 -0.0000000), wk = 0.0025063 k( 65) = ( 0.4696970 0.3411615 -0.0000000), wk = 0.0025063 k( 66) = ( 0.4646465 0.3499093 -0.0000000), wk = 0.0025063 k( 67) = ( 0.4595960 0.3586570 -0.0000000), wk = 0.0025063 k( 68) = ( 0.4545455 0.3674047 -0.0000000), wk = 0.0025063 k( 69) = ( 0.4494950 0.3761524 -0.0000000), wk = 0.0025063 k( 70) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0025063 k( 71) = ( 0.4393939 0.3936479 -0.0000000), wk = 0.0025063 k( 72) = ( 0.4343434 0.4023956 -0.0000000), wk = 0.0025063 k( 73) = ( 0.4292929 0.4111434 -0.0000000), wk = 0.0025063 k( 74) = ( 0.4242424 0.4198911 -0.0000000), wk = 0.0025063 k( 75) = ( 0.4191919 0.4286388 -0.0000000), wk = 0.0025063 k( 76) = ( 0.4141414 0.4373866 -0.0000000), wk = 0.0025063 k( 77) = ( 0.4090909 0.4461343 -0.0000000), wk = 0.0025063 k( 78) = ( 0.4040404 0.4548820 -0.0000000), wk = 0.0025063 k( 79) = ( 0.3989899 0.4636298 -0.0000000), wk = 0.0025063 k( 80) = ( 0.3939394 0.4723775 -0.0000000), wk = 0.0025063 k( 81) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0025063 k( 82) = ( 0.3838384 0.4898730 -0.0000000), wk = 0.0025063 k( 83) = ( 0.3787879 0.4986207 -0.0000000), wk = 0.0025063 k( 84) = ( 0.3737374 0.5073684 -0.0000000), wk = 0.0025063 k( 85) = ( 0.3686869 0.5161161 -0.0000000), wk = 0.0025063 k( 86) = ( 0.3636364 0.5248639 -0.0000000), wk = 0.0025063 k( 87) = ( 0.3585859 0.5336116 -0.0000000), wk = 0.0025063 k( 88) = ( 0.3535354 0.5423593 -0.0000000), wk = 0.0025063 k( 89) = ( 0.3484849 0.5511071 -0.0000000), wk = 0.0025063 k( 90) = ( 0.3434343 0.5598548 -0.0000000), wk = 0.0025063 k( 91) = ( 0.3383838 0.5686025 -0.0000000), wk = 0.0025063 k( 92) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0025063 k( 93) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0025063 k( 94) = ( 0.3282828 0.5686025 -0.0000000), wk = 0.0025063 k( 95) = ( 0.3232323 0.5598548 -0.0000000), wk = 0.0025063 k( 96) = ( 0.3181818 0.5511071 -0.0000000), wk = 0.0025063 k( 97) = ( 0.3131313 0.5423593 -0.0000000), wk = 0.0025063 k( 98) = ( 0.3080808 0.5336116 -0.0000000), wk = 0.0025063 k( 99) = ( 0.3030303 0.5248639 -0.0000000), wk = 0.0025063 k( 100) = ( 0.2979798 0.5161162 -0.0000000), wk = 0.0025063 k( 101) = ( 0.2929293 0.5073684 -0.0000000), wk = 0.0025063 k( 102) = ( 0.2878788 0.4986207 -0.0000000), wk = 0.0025063 k( 103) = ( 0.2828283 0.4898730 -0.0000000), wk = 0.0025063 k( 104) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0025063 k( 105) = ( 0.2727273 0.4723775 -0.0000000), wk = 0.0025063 k( 106) = ( 0.2676768 0.4636298 -0.0000000), wk = 0.0025063 k( 107) = ( 0.2626263 0.4548820 -0.0000000), wk = 0.0025063 k( 108) = ( 0.2575758 0.4461343 -0.0000000), wk = 0.0025063 k( 109) = ( 0.2525252 0.4373866 -0.0000000), wk = 0.0025063 k( 110) = ( 0.2474747 0.4286388 -0.0000000), wk = 0.0025063 k( 111) = ( 0.2424242 0.4198911 -0.0000000), wk = 0.0025063 k( 112) = ( 0.2373737 0.4111434 -0.0000000), wk = 0.0025063 k( 113) = ( 0.2323232 0.4023956 -0.0000000), wk = 0.0025063 k( 114) = ( 0.2272727 0.3936479 -0.0000000), wk = 0.0025063 k( 115) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0025063 k( 116) = ( 0.2171717 0.3761525 -0.0000000), wk = 0.0025063 k( 117) = ( 0.2121212 0.3674047 -0.0000000), wk = 0.0025063 k( 118) = ( 0.2070707 0.3586570 -0.0000000), wk = 0.0025063 k( 119) = ( 0.2020202 0.3499093 -0.0000000), wk = 0.0025063 k( 120) = ( 0.1969697 0.3411615 -0.0000000), wk = 0.0025063 k( 121) = ( 0.1919192 0.3324138 -0.0000000), wk = 0.0025063 k( 122) = ( 0.1868687 0.3236661 -0.0000000), wk = 0.0025063 k( 123) = ( 0.1818182 0.3149183 -0.0000000), wk = 0.0025063 k( 124) = ( 0.1767677 0.3061706 -0.0000000), wk = 0.0025063 k( 125) = ( 0.1717172 0.2974229 -0.0000000), wk = 0.0025063 k( 126) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0025063 k( 127) = ( 0.1616162 0.2799274 -0.0000000), wk = 0.0025063 k( 128) = ( 0.1565657 0.2711797 -0.0000000), wk = 0.0025063 k( 129) = ( 0.1515151 0.2624319 -0.0000000), wk = 0.0025063 k( 130) = ( 0.1464647 0.2536842 -0.0000000), wk = 0.0025063 k( 131) = ( 0.1414141 0.2449365 -0.0000000), wk = 0.0025063 k( 132) = ( 0.1363636 0.2361888 -0.0000000), wk = 0.0025063 k( 133) = ( 0.1313131 0.2274410 -0.0000000), wk = 0.0025063 k( 134) = ( 0.1262626 0.2186933 -0.0000000), wk = 0.0025063 k( 135) = ( 0.1212121 0.2099456 -0.0000000), wk = 0.0025063 k( 136) = ( 0.1161616 0.2011978 -0.0000000), wk = 0.0025063 k( 137) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0025063 k( 138) = ( 0.1060606 0.1837024 -0.0000000), wk = 0.0025063 k( 139) = ( 0.1010101 0.1749546 -0.0000000), wk = 0.0025063 k( 140) = ( 0.0959596 0.1662069 -0.0000000), wk = 0.0025063 k( 141) = ( 0.0909091 0.1574592 -0.0000000), wk = 0.0025063 k( 142) = ( 0.0858586 0.1487114 -0.0000000), wk = 0.0025063 k( 143) = ( 0.0808081 0.1399637 -0.0000000), wk = 0.0025063 k( 144) = ( 0.0757576 0.1312160 -0.0000000), wk = 0.0025063 k( 145) = ( 0.0707071 0.1224682 -0.0000000), wk = 0.0025063 k( 146) = ( 0.0656566 0.1137205 -0.0000000), wk = 0.0025063 k( 147) = ( 0.0606061 0.1049728 -0.0000000), wk = 0.0025063 k( 148) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0025063 k( 149) = ( 0.0505051 0.0874773 -0.0000000), wk = 0.0025063 k( 150) = ( 0.0454546 0.0787296 -0.0000000), wk = 0.0025063 k( 151) = ( 0.0404040 0.0699819 -0.0000000), wk = 0.0025063 k( 152) = ( 0.0353535 0.0612341 -0.0000000), wk = 0.0025063 k( 153) = ( 0.0303030 0.0524864 -0.0000000), wk = 0.0025063 k( 154) = ( 0.0252525 0.0437387 -0.0000000), wk = 0.0025063 k( 155) = ( 0.0202020 0.0349909 -0.0000000), wk = 0.0025063 k( 156) = ( 0.0151515 0.0262432 -0.0000000), wk = 0.0025063 k( 157) = ( 0.0101010 0.0174955 -0.0000000), wk = 0.0025063 k( 158) = ( 0.0050505 0.0087477 -0.0000000), wk = 0.0025063 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 161) = ( 0.0000000 0.0000000 0.0101967), wk = 0.0025063 k( 162) = ( 0.0000000 0.0000000 0.0203934), wk = 0.0025063 k( 163) = ( 0.0000000 0.0000000 0.0305901), wk = 0.0025063 k( 164) = ( 0.0000000 0.0000000 0.0407868), wk = 0.0025063 k( 165) = ( 0.0000000 0.0000000 0.0509835), wk = 0.0025063 k( 166) = ( 0.0000000 0.0000000 0.0611802), wk = 0.0025063 k( 167) = ( 0.0000000 0.0000000 0.0713768), wk = 0.0025063 k( 168) = ( 0.0000000 0.0000000 0.0815735), wk = 0.0025063 k( 169) = ( 0.0000000 0.0000000 0.0917702), wk = 0.0025063 k( 170) = ( 0.0000000 0.0000000 0.1019669), wk = 0.0025063 k( 171) = ( 0.0000000 0.0000000 0.1121636), wk = 0.0025063 k( 172) = ( 0.0000000 0.0000000 0.1223603), wk = 0.0025063 k( 173) = ( 0.0000000 0.0000000 0.1325570), wk = 0.0025063 k( 174) = ( 0.0000000 0.0000000 0.1427537), wk = 0.0025063 k( 175) = ( 0.0000000 0.0000000 0.1529504), wk = 0.0025063 k( 176) = ( 0.0000000 0.0000000 0.1631471), wk = 0.0025063 k( 177) = ( 0.0000000 0.0000000 0.1733438), wk = 0.0025063 k( 178) = ( 0.0000000 0.0000000 0.1835404), wk = 0.0025063 k( 179) = ( 0.0000000 0.0000000 0.1937371), wk = 0.0025063 k( 180) = ( 0.0000000 0.0000000 0.2039338), wk = 0.0025063 k( 181) = ( 0.0000000 0.0000000 0.2141305), wk = 0.0025063 k( 182) = ( 0.0000000 0.0000000 0.2243272), wk = 0.0025063 k( 183) = ( 0.0000000 0.0000000 0.2345239), wk = 0.0025063 k( 184) = ( 0.0000000 0.0000000 0.2447206), wk = 0.0025063 k( 185) = ( 0.0000000 0.0000000 0.2549173), wk = 0.0025063 k( 186) = ( 0.0000000 0.0000000 0.2651140), wk = 0.0025063 k( 187) = ( 0.0000000 0.0000000 0.2651140), wk = 0.0025063 k( 188) = ( 0.0087719 0.0050645 0.2651140), wk = 0.0025063 k( 189) = ( 0.0175439 0.0101290 0.2651140), wk = 0.0025063 k( 190) = ( 0.0263158 0.0151934 0.2651140), wk = 0.0025063 k( 191) = ( 0.0350877 0.0202579 0.2651140), wk = 0.0025063 k( 192) = ( 0.0438597 0.0253224 0.2651140), wk = 0.0025063 k( 193) = ( 0.0526316 0.0303869 0.2651140), wk = 0.0025063 k( 194) = ( 0.0614035 0.0354513 0.2651140), wk = 0.0025063 k( 195) = ( 0.0701754 0.0405158 0.2651140), wk = 0.0025063 k( 196) = ( 0.0789474 0.0455803 0.2651140), wk = 0.0025063 k( 197) = ( 0.0877193 0.0506448 0.2651140), wk = 0.0025063 k( 198) = ( 0.0964912 0.0557092 0.2651140), wk = 0.0025063 k( 199) = ( 0.1052632 0.0607737 0.2651140), wk = 0.0025063 k( 200) = ( 0.1140351 0.0658382 0.2651140), wk = 0.0025063 k( 201) = ( 0.1228070 0.0709027 0.2651140), wk = 0.0025063 k( 202) = ( 0.1315790 0.0759671 0.2651140), wk = 0.0025063 k( 203) = ( 0.1403509 0.0810316 0.2651140), wk = 0.0025063 k( 204) = ( 0.1491228 0.0860961 0.2651140), wk = 0.0025063 k( 205) = ( 0.1578947 0.0911606 0.2651140), wk = 0.0025063 k( 206) = ( 0.1666667 0.0962250 0.2651140), wk = 0.0025063 k( 207) = ( 0.1754386 0.1012895 0.2651140), wk = 0.0025063 k( 208) = ( 0.1842105 0.1063540 0.2651140), wk = 0.0025063 k( 209) = ( 0.1929825 0.1114185 0.2651140), wk = 0.0025063 k( 210) = ( 0.2017544 0.1164830 0.2651140), wk = 0.0025063 k( 211) = ( 0.2105263 0.1215474 0.2651140), wk = 0.0025063 k( 212) = ( 0.2192983 0.1266119 0.2651140), wk = 0.0025063 k( 213) = ( 0.2280702 0.1316764 0.2651140), wk = 0.0025063 k( 214) = ( 0.2368421 0.1367409 0.2651140), wk = 0.0025063 k( 215) = ( 0.2456140 0.1418053 0.2651140), wk = 0.0025063 k( 216) = ( 0.2543860 0.1468698 0.2651140), wk = 0.0025063 k( 217) = ( 0.2631579 0.1519343 0.2651140), wk = 0.0025063 k( 218) = ( 0.2719298 0.1569988 0.2651140), wk = 0.0025063 k( 219) = ( 0.2807018 0.1620632 0.2651140), wk = 0.0025063 k( 220) = ( 0.2894737 0.1671277 0.2651140), wk = 0.0025063 k( 221) = ( 0.2982456 0.1721922 0.2651140), wk = 0.0025063 k( 222) = ( 0.3070175 0.1772567 0.2651140), wk = 0.0025063 k( 223) = ( 0.3157895 0.1823211 0.2651140), wk = 0.0025063 k( 224) = ( 0.3245614 0.1873856 0.2651140), wk = 0.0025063 k( 225) = ( 0.3333333 0.1924501 0.2651140), wk = 0.0025063 k( 226) = ( 0.3421053 0.1975146 0.2651140), wk = 0.0025063 k( 227) = ( 0.3508772 0.2025790 0.2651140), wk = 0.0025063 k( 228) = ( 0.3596491 0.2076435 0.2651140), wk = 0.0025063 k( 229) = ( 0.3684211 0.2127080 0.2651140), wk = 0.0025063 k( 230) = ( 0.3771930 0.2177725 0.2651140), wk = 0.0025063 k( 231) = ( 0.3859649 0.2228369 0.2651140), wk = 0.0025063 k( 232) = ( 0.3947368 0.2279014 0.2651140), wk = 0.0025063 k( 233) = ( 0.4035088 0.2329659 0.2651140), wk = 0.0025063 k( 234) = ( 0.4122807 0.2380304 0.2651140), wk = 0.0025063 k( 235) = ( 0.4210526 0.2430948 0.2651140), wk = 0.0025063 k( 236) = ( 0.4298246 0.2481593 0.2651140), wk = 0.0025063 k( 237) = ( 0.4385965 0.2532238 0.2651140), wk = 0.0025063 k( 238) = ( 0.4473684 0.2582883 0.2651140), wk = 0.0025063 k( 239) = ( 0.4561404 0.2633528 0.2651140), wk = 0.0025063 k( 240) = ( 0.4649123 0.2684172 0.2651140), wk = 0.0025063 k( 241) = ( 0.4736842 0.2734817 0.2651140), wk = 0.0025063 k( 242) = ( 0.4824561 0.2785462 0.2651140), wk = 0.0025063 k( 243) = ( 0.4912281 0.2836107 0.2651140), wk = 0.0025063 k( 244) = ( 0.5000000 0.2886751 0.2651140), wk = 0.0025063 k( 245) = ( 0.5000000 0.2886751 0.2651140), wk = 0.0025063 k( 246) = ( 0.4949495 0.2974229 0.2651140), wk = 0.0025063 k( 247) = ( 0.4898990 0.3061706 0.2651140), wk = 0.0025063 k( 248) = ( 0.4848485 0.3149183 0.2651140), wk = 0.0025063 k( 249) = ( 0.4797980 0.3236661 0.2651140), wk = 0.0025063 k( 250) = ( 0.4747475 0.3324138 0.2651140), wk = 0.0025063 k( 251) = ( 0.4696970 0.3411615 0.2651140), wk = 0.0025063 k( 252) = ( 0.4646465 0.3499093 0.2651140), wk = 0.0025063 k( 253) = ( 0.4595960 0.3586570 0.2651140), wk = 0.0025063 k( 254) = ( 0.4545455 0.3674047 0.2651140), wk = 0.0025063 k( 255) = ( 0.4494950 0.3761524 0.2651140), wk = 0.0025063 k( 256) = ( 0.4444444 0.3849002 0.2651140), wk = 0.0025063 k( 257) = ( 0.4393939 0.3936479 0.2651140), wk = 0.0025063 k( 258) = ( 0.4343434 0.4023956 0.2651140), wk = 0.0025063 k( 259) = ( 0.4292929 0.4111434 0.2651140), wk = 0.0025063 k( 260) = ( 0.4242424 0.4198911 0.2651140), wk = 0.0025063 k( 261) = ( 0.4191919 0.4286388 0.2651140), wk = 0.0025063 k( 262) = ( 0.4141414 0.4373866 0.2651140), wk = 0.0025063 k( 263) = ( 0.4090909 0.4461343 0.2651140), wk = 0.0025063 k( 264) = ( 0.4040404 0.4548820 0.2651140), wk = 0.0025063 k( 265) = ( 0.3989899 0.4636298 0.2651140), wk = 0.0025063 k( 266) = ( 0.3939394 0.4723775 0.2651140), wk = 0.0025063 k( 267) = ( 0.3888889 0.4811252 0.2651140), wk = 0.0025063 k( 268) = ( 0.3838384 0.4898730 0.2651140), wk = 0.0025063 k( 269) = ( 0.3787879 0.4986207 0.2651140), wk = 0.0025063 k( 270) = ( 0.3737374 0.5073684 0.2651140), wk = 0.0025063 k( 271) = ( 0.3686869 0.5161161 0.2651140), wk = 0.0025063 k( 272) = ( 0.3636364 0.5248639 0.2651140), wk = 0.0025063 k( 273) = ( 0.3585859 0.5336116 0.2651140), wk = 0.0025063 k( 274) = ( 0.3535354 0.5423593 0.2651140), wk = 0.0025063 k( 275) = ( 0.3484849 0.5511071 0.2651140), wk = 0.0025063 k( 276) = ( 0.3434343 0.5598548 0.2651140), wk = 0.0025063 k( 277) = ( 0.3383838 0.5686025 0.2651140), wk = 0.0025063 k( 278) = ( 0.3333333 0.5773503 0.2651140), wk = 0.0025063 k( 279) = ( 0.3333333 0.5773503 0.2651140), wk = 0.0025063 k( 280) = ( 0.3282828 0.5686025 0.2651140), wk = 0.0025063 k( 281) = ( 0.3232323 0.5598548 0.2651140), wk = 0.0025063 k( 282) = ( 0.3181818 0.5511071 0.2651140), wk = 0.0025063 k( 283) = ( 0.3131313 0.5423593 0.2651140), wk = 0.0025063 k( 284) = ( 0.3080808 0.5336116 0.2651140), wk = 0.0025063 k( 285) = ( 0.3030303 0.5248639 0.2651140), wk = 0.0025063 k( 286) = ( 0.2979798 0.5161162 0.2651140), wk = 0.0025063 k( 287) = ( 0.2929293 0.5073684 0.2651140), wk = 0.0025063 k( 288) = ( 0.2878788 0.4986207 0.2651140), wk = 0.0025063 k( 289) = ( 0.2828283 0.4898730 0.2651140), wk = 0.0025063 k( 290) = ( 0.2777778 0.4811252 0.2651140), wk = 0.0025063 k( 291) = ( 0.2727273 0.4723775 0.2651140), wk = 0.0025063 k( 292) = ( 0.2676768 0.4636298 0.2651140), wk = 0.0025063 k( 293) = ( 0.2626263 0.4548820 0.2651140), wk = 0.0025063 k( 294) = ( 0.2575758 0.4461343 0.2651140), wk = 0.0025063 k( 295) = ( 0.2525252 0.4373866 0.2651140), wk = 0.0025063 k( 296) = ( 0.2474747 0.4286388 0.2651140), wk = 0.0025063 k( 297) = ( 0.2424242 0.4198911 0.2651140), wk = 0.0025063 k( 298) = ( 0.2373737 0.4111434 0.2651140), wk = 0.0025063 k( 299) = ( 0.2323232 0.4023956 0.2651140), wk = 0.0025063 k( 300) = ( 0.2272727 0.3936479 0.2651140), wk = 0.0025063 k( 301) = ( 0.2222222 0.3849002 0.2651140), wk = 0.0025063 k( 302) = ( 0.2171717 0.3761525 0.2651140), wk = 0.0025063 k( 303) = ( 0.2121212 0.3674047 0.2651140), wk = 0.0025063 k( 304) = ( 0.2070707 0.3586570 0.2651140), wk = 0.0025063 k( 305) = ( 0.2020202 0.3499093 0.2651140), wk = 0.0025063 k( 306) = ( 0.1969697 0.3411615 0.2651140), wk = 0.0025063 k( 307) = ( 0.1919192 0.3324138 0.2651140), wk = 0.0025063 k( 308) = ( 0.1868687 0.3236661 0.2651140), wk = 0.0025063 k( 309) = ( 0.1818182 0.3149183 0.2651140), wk = 0.0025063 k( 310) = ( 0.1767677 0.3061706 0.2651140), wk = 0.0025063 k( 311) = ( 0.1717172 0.2974229 0.2651140), wk = 0.0025063 k( 312) = ( 0.1666667 0.2886751 0.2651140), wk = 0.0025063 k( 313) = ( 0.1616162 0.2799274 0.2651140), wk = 0.0025063 k( 314) = ( 0.1565657 0.2711797 0.2651140), wk = 0.0025063 k( 315) = ( 0.1515151 0.2624319 0.2651140), wk = 0.0025063 k( 316) = ( 0.1464647 0.2536842 0.2651140), wk = 0.0025063 k( 317) = ( 0.1414141 0.2449365 0.2651140), wk = 0.0025063 k( 318) = ( 0.1363636 0.2361888 0.2651140), wk = 0.0025063 k( 319) = ( 0.1313131 0.2274410 0.2651140), wk = 0.0025063 k( 320) = ( 0.1262626 0.2186933 0.2651140), wk = 0.0025063 k( 321) = ( 0.1212121 0.2099456 0.2651140), wk = 0.0025063 k( 322) = ( 0.1161616 0.2011978 0.2651140), wk = 0.0025063 k( 323) = ( 0.1111111 0.1924501 0.2651140), wk = 0.0025063 k( 324) = ( 0.1060606 0.1837024 0.2651140), wk = 0.0025063 k( 325) = ( 0.1010101 0.1749546 0.2651140), wk = 0.0025063 k( 326) = ( 0.0959596 0.1662069 0.2651140), wk = 0.0025063 k( 327) = ( 0.0909091 0.1574592 0.2651140), wk = 0.0025063 k( 328) = ( 0.0858586 0.1487114 0.2651140), wk = 0.0025063 k( 329) = ( 0.0808081 0.1399637 0.2651140), wk = 0.0025063 k( 330) = ( 0.0757576 0.1312160 0.2651140), wk = 0.0025063 k( 331) = ( 0.0707071 0.1224682 0.2651140), wk = 0.0025063 k( 332) = ( 0.0656566 0.1137205 0.2651140), wk = 0.0025063 k( 333) = ( 0.0606061 0.1049728 0.2651140), wk = 0.0025063 k( 334) = ( 0.0555556 0.0962251 0.2651140), wk = 0.0025063 k( 335) = ( 0.0505051 0.0874773 0.2651140), wk = 0.0025063 k( 336) = ( 0.0454546 0.0787296 0.2651140), wk = 0.0025063 k( 337) = ( 0.0404040 0.0699819 0.2651140), wk = 0.0025063 k( 338) = ( 0.0353535 0.0612341 0.2651140), wk = 0.0025063 k( 339) = ( 0.0303030 0.0524864 0.2651140), wk = 0.0025063 k( 340) = ( 0.0252525 0.0437387 0.2651140), wk = 0.0025063 k( 341) = ( 0.0202020 0.0349909 0.2651140), wk = 0.0025063 k( 342) = ( 0.0151515 0.0262432 0.2651140), wk = 0.0025063 k( 343) = ( 0.0101010 0.0174955 0.2651140), wk = 0.0025063 k( 344) = ( 0.0050505 0.0087477 0.2651140), wk = 0.0025063 k( 345) = ( 0.0000000 0.0000000 0.2651140), wk = 0.0025063 k( 346) = ( 0.5000000 0.2886751 0.2651140), wk = 0.0025063 k( 347) = ( 0.5000000 0.2886751 0.2549173), wk = 0.0025063 k( 348) = ( 0.5000000 0.2886751 0.2447206), wk = 0.0025063 k( 349) = ( 0.5000000 0.2886751 0.2345239), wk = 0.0025063 k( 350) = ( 0.5000000 0.2886751 0.2243272), wk = 0.0025063 k( 351) = ( 0.5000000 0.2886751 0.2141305), wk = 0.0025063 k( 352) = ( 0.5000000 0.2886751 0.2039338), wk = 0.0025063 k( 353) = ( 0.5000000 0.2886751 0.1937371), wk = 0.0025063 k( 354) = ( 0.5000000 0.2886751 0.1835404), wk = 0.0025063 k( 355) = ( 0.5000000 0.2886751 0.1733438), wk = 0.0025063 k( 356) = ( 0.5000000 0.2886751 0.1631471), wk = 0.0025063 k( 357) = ( 0.5000000 0.2886751 0.1529504), wk = 0.0025063 k( 358) = ( 0.5000000 0.2886751 0.1427537), wk = 0.0025063 k( 359) = ( 0.5000000 0.2886751 0.1325570), wk = 0.0025063 k( 360) = ( 0.5000000 0.2886751 0.1223603), wk = 0.0025063 k( 361) = ( 0.5000000 0.2886751 0.1121636), wk = 0.0025063 k( 362) = ( 0.5000000 0.2886751 0.1019669), wk = 0.0025063 k( 363) = ( 0.5000000 0.2886751 0.0917702), wk = 0.0025063 k( 364) = ( 0.5000000 0.2886751 0.0815735), wk = 0.0025063 k( 365) = ( 0.5000000 0.2886751 0.0713768), wk = 0.0025063 k( 366) = ( 0.5000000 0.2886751 0.0611802), wk = 0.0025063 k( 367) = ( 0.5000000 0.2886751 0.0509835), wk = 0.0025063 k( 368) = ( 0.5000000 0.2886751 0.0407868), wk = 0.0025063 k( 369) = ( 0.5000000 0.2886751 0.0305901), wk = 0.0025063 k( 370) = ( 0.5000000 0.2886751 0.0203934), wk = 0.0025063 k( 371) = ( 0.5000000 0.2886751 0.0101967), wk = 0.0025063 k( 372) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0025063 k( 373) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0025063 k( 374) = ( 0.3333333 0.5773503 0.0101967), wk = 0.0025063 k( 375) = ( 0.3333333 0.5773503 0.0203934), wk = 0.0025063 k( 376) = ( 0.3333333 0.5773503 0.0305901), wk = 0.0025063 k( 377) = ( 0.3333333 0.5773503 0.0407868), wk = 0.0025063 k( 378) = ( 0.3333333 0.5773503 0.0509835), wk = 0.0025063 k( 379) = ( 0.3333333 0.5773503 0.0611802), wk = 0.0025063 k( 380) = ( 0.3333333 0.5773503 0.0713768), wk = 0.0025063 k( 381) = ( 0.3333333 0.5773503 0.0815735), wk = 0.0025063 k( 382) = ( 0.3333333 0.5773503 0.0917702), wk = 0.0025063 k( 383) = ( 0.3333333 0.5773503 0.1019669), wk = 0.0025063 k( 384) = ( 0.3333333 0.5773503 0.1121636), wk = 0.0025063 k( 385) = ( 0.3333333 0.5773503 0.1223603), wk = 0.0025063 k( 386) = ( 0.3333333 0.5773503 0.1325570), wk = 0.0025063 k( 387) = ( 0.3333333 0.5773503 0.1427537), wk = 0.0025063 k( 388) = ( 0.3333333 0.5773503 0.1529504), wk = 0.0025063 k( 389) = ( 0.3333333 0.5773503 0.1631471), wk = 0.0025063 k( 390) = ( 0.3333333 0.5773503 0.1733438), wk = 0.0025063 k( 391) = ( 0.3333333 0.5773503 0.1835404), wk = 0.0025063 k( 392) = ( 0.3333333 0.5773503 0.1937371), wk = 0.0025063 k( 393) = ( 0.3333333 0.5773503 0.2039338), wk = 0.0025063 k( 394) = ( 0.3333333 0.5773503 0.2141305), wk = 0.0025063 k( 395) = ( 0.3333333 0.5773503 0.2243272), wk = 0.0025063 k( 396) = ( 0.3333333 0.5773503 0.2345239), wk = 0.0025063 k( 397) = ( 0.3333333 0.5773503 0.2447206), wk = 0.0025063 k( 398) = ( 0.3333333 0.5773503 0.2549173), wk = 0.0025063 k( 399) = ( 0.3333333 0.5773503 0.2651140), wk = 0.0025063 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 2) = ( 0.0087719 0.0000000 0.0000000), wk = 0.0025063 k( 3) = ( 0.0175439 0.0000000 0.0000000), wk = 0.0025063 k( 4) = ( 0.0263158 0.0000000 0.0000000), wk = 0.0025063 k( 5) = ( 0.0350877 0.0000000 0.0000000), wk = 0.0025063 k( 6) = ( 0.0438597 0.0000000 0.0000000), wk = 0.0025063 k( 7) = ( 0.0526316 0.0000000 0.0000000), wk = 0.0025063 k( 8) = ( 0.0614035 -0.0000000 -0.0000000), wk = 0.0025063 k( 9) = ( 0.0701754 0.0000000 0.0000000), wk = 0.0025063 k( 10) = ( 0.0789474 0.0000000 0.0000000), wk = 0.0025063 k( 11) = ( 0.0877193 0.0000000 0.0000000), wk = 0.0025063 k( 12) = ( 0.0964912 0.0000000 0.0000000), wk = 0.0025063 k( 13) = ( 0.1052632 0.0000000 0.0000000), wk = 0.0025063 k( 14) = ( 0.1140351 0.0000000 -0.0000000), wk = 0.0025063 k( 15) = ( 0.1228070 -0.0000000 -0.0000000), wk = 0.0025063 k( 16) = ( 0.1315790 0.0000000 0.0000000), wk = 0.0025063 k( 17) = ( 0.1403509 0.0000000 0.0000000), wk = 0.0025063 k( 18) = ( 0.1491228 0.0000000 -0.0000000), wk = 0.0025063 k( 19) = ( 0.1578947 0.0000000 0.0000000), wk = 0.0025063 k( 20) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0025063 k( 21) = ( 0.1754386 0.0000000 0.0000000), wk = 0.0025063 k( 22) = ( 0.1842105 -0.0000000 0.0000000), wk = 0.0025063 k( 23) = ( 0.1929825 0.0000000 0.0000000), wk = 0.0025063 k( 24) = ( 0.2017544 0.0000000 -0.0000000), wk = 0.0025063 k( 25) = ( 0.2105263 0.0000000 0.0000000), wk = 0.0025063 k( 26) = ( 0.2192983 0.0000000 0.0000000), wk = 0.0025063 k( 27) = ( 0.2280702 0.0000000 -0.0000000), wk = 0.0025063 k( 28) = ( 0.2368421 0.0000000 0.0000000), wk = 0.0025063 k( 29) = ( 0.2456140 -0.0000000 -0.0000000), wk = 0.0025063 k( 30) = ( 0.2543860 0.0000000 0.0000000), wk = 0.0025063 k( 31) = ( 0.2631579 0.0000000 0.0000000), wk = 0.0025063 k( 32) = ( 0.2719298 0.0000000 0.0000000), wk = 0.0025063 k( 33) = ( 0.2807018 0.0000000 0.0000000), wk = 0.0025063 k( 34) = ( 0.2894737 0.0000000 0.0000000), wk = 0.0025063 k( 35) = ( 0.2982456 0.0000000 0.0000000), wk = 0.0025063 k( 36) = ( 0.3070175 0.0000000 -0.0000000), wk = 0.0025063 k( 37) = ( 0.3157895 0.0000000 0.0000000), wk = 0.0025063 k( 38) = ( 0.3245614 0.0000000 0.0000000), wk = 0.0025063 k( 39) = ( 0.3333333 -0.0000000 0.0000000), wk = 0.0025063 k( 40) = ( 0.3421053 -0.0000000 0.0000000), wk = 0.0025063 k( 41) = ( 0.3508772 0.0000000 -0.0000000), wk = 0.0025063 k( 42) = ( 0.3596491 0.0000000 0.0000000), wk = 0.0025063 k( 43) = ( 0.3684211 0.0000000 0.0000000), wk = 0.0025063 k( 44) = ( 0.3771930 0.0000000 0.0000000), wk = 0.0025063 k( 45) = ( 0.3859649 -0.0000000 0.0000000), wk = 0.0025063 k( 46) = ( 0.3947368 -0.0000000 -0.0000000), wk = 0.0025063 k( 47) = ( 0.4035088 -0.0000000 0.0000000), wk = 0.0025063 k( 48) = ( 0.4122807 -0.0000000 0.0000000), wk = 0.0025063 k( 49) = ( 0.4210526 0.0000000 0.0000000), wk = 0.0025063 k( 50) = ( 0.4298246 0.0000000 0.0000000), wk = 0.0025063 k( 51) = ( 0.4385965 0.0000000 0.0000000), wk = 0.0025063 k( 52) = ( 0.4473684 0.0000000 0.0000000), wk = 0.0025063 k( 53) = ( 0.4561404 0.0000000 0.0000000), wk = 0.0025063 k( 54) = ( 0.4649123 0.0000000 0.0000000), wk = 0.0025063 k( 55) = ( 0.4736842 0.0000000 0.0000000), wk = 0.0025063 k( 56) = ( 0.4824561 0.0000000 0.0000000), wk = 0.0025063 k( 57) = ( 0.4912281 0.0000000 0.0000000), wk = 0.0025063 k( 58) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0025063 k( 59) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0025063 k( 60) = ( 0.4949495 0.0101010 0.0000000), wk = 0.0025063 k( 61) = ( 0.4898990 0.0202020 0.0000000), wk = 0.0025063 k( 62) = ( 0.4848485 0.0303030 0.0000000), wk = 0.0025063 k( 63) = ( 0.4797980 0.0404040 0.0000000), wk = 0.0025063 k( 64) = ( 0.4747475 0.0505050 -0.0000000), wk = 0.0025063 k( 65) = ( 0.4696970 0.0606061 -0.0000000), wk = 0.0025063 k( 66) = ( 0.4646465 0.0707071 0.0000000), wk = 0.0025063 k( 67) = ( 0.4595960 0.0808081 0.0000000), wk = 0.0025063 k( 68) = ( 0.4545455 0.0909091 0.0000000), wk = 0.0025063 k( 69) = ( 0.4494950 0.1010101 0.0000000), wk = 0.0025063 k( 70) = ( 0.4444444 0.1111111 -0.0000000), wk = 0.0025063 k( 71) = ( 0.4393939 0.1212121 0.0000000), wk = 0.0025063 k( 72) = ( 0.4343434 0.1313131 -0.0000000), wk = 0.0025063 k( 73) = ( 0.4292929 0.1414141 0.0000000), wk = 0.0025063 k( 74) = ( 0.4242424 0.1515151 0.0000000), wk = 0.0025063 k( 75) = ( 0.4191919 0.1616162 0.0000000), wk = 0.0025063 k( 76) = ( 0.4141414 0.1717172 0.0000000), wk = 0.0025063 k( 77) = ( 0.4090909 0.1818182 0.0000000), wk = 0.0025063 k( 78) = ( 0.4040404 0.1919192 0.0000000), wk = 0.0025063 k( 79) = ( 0.3989899 0.2020202 0.0000000), wk = 0.0025063 k( 80) = ( 0.3939394 0.2121212 0.0000000), wk = 0.0025063 k( 81) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0025063 k( 82) = ( 0.3838384 0.2323232 0.0000000), wk = 0.0025063 k( 83) = ( 0.3787879 0.2424242 0.0000000), wk = 0.0025063 k( 84) = ( 0.3737374 0.2525252 0.0000000), wk = 0.0025063 k( 85) = ( 0.3686869 0.2626263 0.0000000), wk = 0.0025063 k( 86) = ( 0.3636364 0.2727273 0.0000000), wk = 0.0025063 k( 87) = ( 0.3585859 0.2828283 0.0000000), wk = 0.0025063 k( 88) = ( 0.3535354 0.2929293 0.0000000), wk = 0.0025063 k( 89) = ( 0.3484849 0.3030303 0.0000000), wk = 0.0025063 k( 90) = ( 0.3434343 0.3131313 0.0000000), wk = 0.0025063 k( 91) = ( 0.3383838 0.3232323 0.0000000), wk = 0.0025063 k( 92) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0025063 k( 93) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0025063 k( 94) = ( 0.3282828 0.3282828 0.0000000), wk = 0.0025063 k( 95) = ( 0.3232323 0.3232323 0.0000000), wk = 0.0025063 k( 96) = ( 0.3181818 0.3181818 0.0000000), wk = 0.0025063 k( 97) = ( 0.3131313 0.3131313 -0.0000000), wk = 0.0025063 k( 98) = ( 0.3080808 0.3080808 -0.0000000), wk = 0.0025063 k( 99) = ( 0.3030303 0.3030303 -0.0000000), wk = 0.0025063 k( 100) = ( 0.2979798 0.2979798 0.0000000), wk = 0.0025063 k( 101) = ( 0.2929293 0.2929293 -0.0000000), wk = 0.0025063 k( 102) = ( 0.2878788 0.2878788 0.0000000), wk = 0.0025063 k( 103) = ( 0.2828283 0.2828283 -0.0000000), wk = 0.0025063 k( 104) = ( 0.2777778 0.2777778 0.0000000), wk = 0.0025063 k( 105) = ( 0.2727273 0.2727273 0.0000000), wk = 0.0025063 k( 106) = ( 0.2676768 0.2676768 0.0000000), wk = 0.0025063 k( 107) = ( 0.2626263 0.2626263 -0.0000000), wk = 0.0025063 k( 108) = ( 0.2575758 0.2575758 -0.0000000), wk = 0.0025063 k( 109) = ( 0.2525252 0.2525253 0.0000000), wk = 0.0025063 k( 110) = ( 0.2474747 0.2474748 0.0000000), wk = 0.0025063 k( 111) = ( 0.2424242 0.2424242 0.0000000), wk = 0.0025063 k( 112) = ( 0.2373737 0.2373737 0.0000000), wk = 0.0025063 k( 113) = ( 0.2323232 0.2323232 0.0000000), wk = 0.0025063 k( 114) = ( 0.2272727 0.2272727 0.0000000), wk = 0.0025063 k( 115) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0025063 k( 116) = ( 0.2171717 0.2171717 0.0000000), wk = 0.0025063 k( 117) = ( 0.2121212 0.2121212 0.0000000), wk = 0.0025063 k( 118) = ( 0.2070707 0.2070707 0.0000000), wk = 0.0025063 k( 119) = ( 0.2020202 0.2020202 0.0000000), wk = 0.0025063 k( 120) = ( 0.1969697 0.1969697 0.0000000), wk = 0.0025063 k( 121) = ( 0.1919192 0.1919192 0.0000000), wk = 0.0025063 k( 122) = ( 0.1868687 0.1868687 0.0000000), wk = 0.0025063 k( 123) = ( 0.1818182 0.1818182 0.0000000), wk = 0.0025063 k( 124) = ( 0.1767677 0.1767677 0.0000000), wk = 0.0025063 k( 125) = ( 0.1717172 0.1717172 0.0000000), wk = 0.0025063 k( 126) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0025063 k( 127) = ( 0.1616162 0.1616162 0.0000000), wk = 0.0025063 k( 128) = ( 0.1565657 0.1565657 0.0000000), wk = 0.0025063 k( 129) = ( 0.1515151 0.1515151 -0.0000000), wk = 0.0025063 k( 130) = ( 0.1464647 0.1464647 0.0000000), wk = 0.0025063 k( 131) = ( 0.1414141 0.1414141 -0.0000000), wk = 0.0025063 k( 132) = ( 0.1363636 0.1363636 0.0000000), wk = 0.0025063 k( 133) = ( 0.1313131 0.1313131 -0.0000000), wk = 0.0025063 k( 134) = ( 0.1262626 0.1262626 0.0000000), wk = 0.0025063 k( 135) = ( 0.1212121 0.1212121 0.0000000), wk = 0.0025063 k( 136) = ( 0.1161616 0.1161616 0.0000000), wk = 0.0025063 k( 137) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0025063 k( 138) = ( 0.1060606 0.1060606 0.0000000), wk = 0.0025063 k( 139) = ( 0.1010101 0.1010101 0.0000000), wk = 0.0025063 k( 140) = ( 0.0959596 0.0959596 -0.0000000), wk = 0.0025063 k( 141) = ( 0.0909091 0.0909091 0.0000000), wk = 0.0025063 k( 142) = ( 0.0858586 0.0858586 0.0000000), wk = 0.0025063 k( 143) = ( 0.0808081 0.0808081 0.0000000), wk = 0.0025063 k( 144) = ( 0.0757576 0.0757576 0.0000000), wk = 0.0025063 k( 145) = ( 0.0707071 0.0707071 -0.0000000), wk = 0.0025063 k( 146) = ( 0.0656566 0.0656566 0.0000000), wk = 0.0025063 k( 147) = ( 0.0606061 0.0606061 0.0000000), wk = 0.0025063 k( 148) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0025063 k( 149) = ( 0.0505051 0.0505050 0.0000000), wk = 0.0025063 k( 150) = ( 0.0454546 0.0454546 0.0000000), wk = 0.0025063 k( 151) = ( 0.0404040 0.0404040 0.0000000), wk = 0.0025063 k( 152) = ( 0.0353535 0.0353535 -0.0000000), wk = 0.0025063 k( 153) = ( 0.0303030 0.0303030 0.0000000), wk = 0.0025063 k( 154) = ( 0.0252525 0.0252525 0.0000000), wk = 0.0025063 k( 155) = ( 0.0202020 0.0202020 0.0000000), wk = 0.0025063 k( 156) = ( 0.0151515 0.0151515 0.0000000), wk = 0.0025063 k( 157) = ( 0.0101010 0.0101010 0.0000000), wk = 0.0025063 k( 158) = ( 0.0050505 0.0050505 0.0000000), wk = 0.0025063 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 161) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0025063 k( 162) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0025063 k( 163) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0025063 k( 164) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0025063 k( 165) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0025063 k( 166) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0025063 k( 167) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0025063 k( 168) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0025063 k( 169) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0025063 k( 170) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0025063 k( 171) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0025063 k( 172) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0025063 k( 173) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0025063 k( 174) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0025063 k( 175) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0025063 k( 176) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0025063 k( 177) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0025063 k( 178) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0025063 k( 179) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0025063 k( 180) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0025063 k( 181) = ( 0.0000000 0.0000000 0.4038462), wk = 0.0025063 k( 182) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0025063 k( 183) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0025063 k( 184) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0025063 k( 185) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0025063 k( 186) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025063 k( 187) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025063 k( 188) = ( 0.0087719 0.0000000 0.5000000), wk = 0.0025063 k( 189) = ( 0.0175439 0.0000000 0.5000000), wk = 0.0025063 k( 190) = ( 0.0263158 0.0000000 0.5000000), wk = 0.0025063 k( 191) = ( 0.0350877 0.0000000 0.5000000), wk = 0.0025063 k( 192) = ( 0.0438597 0.0000000 0.5000000), wk = 0.0025063 k( 193) = ( 0.0526316 0.0000000 0.5000000), wk = 0.0025063 k( 194) = ( 0.0614035 -0.0000000 0.5000000), wk = 0.0025063 k( 195) = ( 0.0701754 0.0000000 0.5000000), wk = 0.0025063 k( 196) = ( 0.0789474 0.0000000 0.5000000), wk = 0.0025063 k( 197) = ( 0.0877193 0.0000000 0.5000000), wk = 0.0025063 k( 198) = ( 0.0964912 0.0000000 0.5000000), wk = 0.0025063 k( 199) = ( 0.1052632 0.0000000 0.5000000), wk = 0.0025063 k( 200) = ( 0.1140351 0.0000000 0.5000000), wk = 0.0025063 k( 201) = ( 0.1228070 -0.0000000 0.5000000), wk = 0.0025063 k( 202) = ( 0.1315790 0.0000000 0.5000000), wk = 0.0025063 k( 203) = ( 0.1403509 0.0000000 0.5000000), wk = 0.0025063 k( 204) = ( 0.1491228 0.0000000 0.5000000), wk = 0.0025063 k( 205) = ( 0.1578947 0.0000000 0.5000000), wk = 0.0025063 k( 206) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0025063 k( 207) = ( 0.1754386 0.0000000 0.5000000), wk = 0.0025063 k( 208) = ( 0.1842105 -0.0000000 0.5000000), wk = 0.0025063 k( 209) = ( 0.1929825 0.0000000 0.5000000), wk = 0.0025063 k( 210) = ( 0.2017544 0.0000000 0.5000000), wk = 0.0025063 k( 211) = ( 0.2105263 0.0000000 0.5000000), wk = 0.0025063 k( 212) = ( 0.2192983 0.0000000 0.5000000), wk = 0.0025063 k( 213) = ( 0.2280702 0.0000000 0.5000000), wk = 0.0025063 k( 214) = ( 0.2368421 0.0000000 0.5000000), wk = 0.0025063 k( 215) = ( 0.2456140 -0.0000000 0.5000000), wk = 0.0025063 k( 216) = ( 0.2543860 0.0000000 0.5000000), wk = 0.0025063 k( 217) = ( 0.2631579 0.0000000 0.5000000), wk = 0.0025063 k( 218) = ( 0.2719298 0.0000000 0.5000000), wk = 0.0025063 k( 219) = ( 0.2807018 0.0000000 0.5000000), wk = 0.0025063 k( 220) = ( 0.2894737 0.0000000 0.5000000), wk = 0.0025063 k( 221) = ( 0.2982456 0.0000000 0.5000000), wk = 0.0025063 k( 222) = ( 0.3070175 0.0000000 0.5000000), wk = 0.0025063 k( 223) = ( 0.3157895 0.0000000 0.5000000), wk = 0.0025063 k( 224) = ( 0.3245614 0.0000000 0.5000000), wk = 0.0025063 k( 225) = ( 0.3333333 -0.0000000 0.5000000), wk = 0.0025063 k( 226) = ( 0.3421053 -0.0000000 0.5000000), wk = 0.0025063 k( 227) = ( 0.3508772 0.0000000 0.5000000), wk = 0.0025063 k( 228) = ( 0.3596491 0.0000000 0.5000000), wk = 0.0025063 k( 229) = ( 0.3684211 0.0000000 0.5000000), wk = 0.0025063 k( 230) = ( 0.3771930 0.0000000 0.5000000), wk = 0.0025063 k( 231) = ( 0.3859649 -0.0000000 0.5000000), wk = 0.0025063 k( 232) = ( 0.3947368 -0.0000000 0.5000000), wk = 0.0025063 k( 233) = ( 0.4035088 -0.0000000 0.5000000), wk = 0.0025063 k( 234) = ( 0.4122807 -0.0000000 0.5000000), wk = 0.0025063 k( 235) = ( 0.4210526 0.0000000 0.5000000), wk = 0.0025063 k( 236) = ( 0.4298246 0.0000000 0.5000000), wk = 0.0025063 k( 237) = ( 0.4385965 0.0000000 0.5000000), wk = 0.0025063 k( 238) = ( 0.4473684 0.0000000 0.5000000), wk = 0.0025063 k( 239) = ( 0.4561404 0.0000000 0.5000000), wk = 0.0025063 k( 240) = ( 0.4649123 0.0000000 0.5000000), wk = 0.0025063 k( 241) = ( 0.4736842 0.0000000 0.5000000), wk = 0.0025063 k( 242) = ( 0.4824561 0.0000000 0.5000000), wk = 0.0025063 k( 243) = ( 0.4912281 0.0000000 0.5000000), wk = 0.0025063 k( 244) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025063 k( 245) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025063 k( 246) = ( 0.4949495 0.0101010 0.5000000), wk = 0.0025063 k( 247) = ( 0.4898990 0.0202020 0.5000000), wk = 0.0025063 k( 248) = ( 0.4848485 0.0303030 0.5000000), wk = 0.0025063 k( 249) = ( 0.4797980 0.0404040 0.5000000), wk = 0.0025063 k( 250) = ( 0.4747475 0.0505050 0.5000000), wk = 0.0025063 k( 251) = ( 0.4696970 0.0606061 0.5000000), wk = 0.0025063 k( 252) = ( 0.4646465 0.0707071 0.5000000), wk = 0.0025063 k( 253) = ( 0.4595960 0.0808081 0.5000000), wk = 0.0025063 k( 254) = ( 0.4545455 0.0909091 0.5000000), wk = 0.0025063 k( 255) = ( 0.4494950 0.1010101 0.5000000), wk = 0.0025063 k( 256) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0025063 k( 257) = ( 0.4393939 0.1212121 0.5000000), wk = 0.0025063 k( 258) = ( 0.4343434 0.1313131 0.5000000), wk = 0.0025063 k( 259) = ( 0.4292929 0.1414141 0.5000000), wk = 0.0025063 k( 260) = ( 0.4242424 0.1515151 0.5000000), wk = 0.0025063 k( 261) = ( 0.4191919 0.1616162 0.5000000), wk = 0.0025063 k( 262) = ( 0.4141414 0.1717172 0.5000000), wk = 0.0025063 k( 263) = ( 0.4090909 0.1818182 0.5000000), wk = 0.0025063 k( 264) = ( 0.4040404 0.1919192 0.5000000), wk = 0.0025063 k( 265) = ( 0.3989899 0.2020202 0.5000000), wk = 0.0025063 k( 266) = ( 0.3939394 0.2121212 0.5000000), wk = 0.0025063 k( 267) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0025063 k( 268) = ( 0.3838384 0.2323232 0.5000000), wk = 0.0025063 k( 269) = ( 0.3787879 0.2424242 0.5000000), wk = 0.0025063 k( 270) = ( 0.3737374 0.2525252 0.5000000), wk = 0.0025063 k( 271) = ( 0.3686869 0.2626263 0.5000000), wk = 0.0025063 k( 272) = ( 0.3636364 0.2727273 0.5000000), wk = 0.0025063 k( 273) = ( 0.3585859 0.2828283 0.5000000), wk = 0.0025063 k( 274) = ( 0.3535354 0.2929293 0.5000000), wk = 0.0025063 k( 275) = ( 0.3484849 0.3030303 0.5000000), wk = 0.0025063 k( 276) = ( 0.3434343 0.3131313 0.5000000), wk = 0.0025063 k( 277) = ( 0.3383838 0.3232323 0.5000000), wk = 0.0025063 k( 278) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0025063 k( 279) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0025063 k( 280) = ( 0.3282828 0.3282828 0.5000000), wk = 0.0025063 k( 281) = ( 0.3232323 0.3232323 0.5000000), wk = 0.0025063 k( 282) = ( 0.3181818 0.3181818 0.5000000), wk = 0.0025063 k( 283) = ( 0.3131313 0.3131313 0.5000000), wk = 0.0025063 k( 284) = ( 0.3080808 0.3080808 0.5000000), wk = 0.0025063 k( 285) = ( 0.3030303 0.3030303 0.5000000), wk = 0.0025063 k( 286) = ( 0.2979798 0.2979798 0.5000000), wk = 0.0025063 k( 287) = ( 0.2929293 0.2929293 0.5000000), wk = 0.0025063 k( 288) = ( 0.2878788 0.2878788 0.5000000), wk = 0.0025063 k( 289) = ( 0.2828283 0.2828283 0.5000000), wk = 0.0025063 k( 290) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0025063 k( 291) = ( 0.2727273 0.2727273 0.5000000), wk = 0.0025063 k( 292) = ( 0.2676768 0.2676768 0.5000000), wk = 0.0025063 k( 293) = ( 0.2626263 0.2626263 0.5000000), wk = 0.0025063 k( 294) = ( 0.2575758 0.2575758 0.5000000), wk = 0.0025063 k( 295) = ( 0.2525252 0.2525253 0.5000000), wk = 0.0025063 k( 296) = ( 0.2474747 0.2474748 0.5000000), wk = 0.0025063 k( 297) = ( 0.2424242 0.2424242 0.5000000), wk = 0.0025063 k( 298) = ( 0.2373737 0.2373737 0.5000000), wk = 0.0025063 k( 299) = ( 0.2323232 0.2323232 0.5000000), wk = 0.0025063 k( 300) = ( 0.2272727 0.2272727 0.5000000), wk = 0.0025063 k( 301) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0025063 k( 302) = ( 0.2171717 0.2171717 0.5000000), wk = 0.0025063 k( 303) = ( 0.2121212 0.2121212 0.5000000), wk = 0.0025063 k( 304) = ( 0.2070707 0.2070707 0.5000000), wk = 0.0025063 k( 305) = ( 0.2020202 0.2020202 0.5000000), wk = 0.0025063 k( 306) = ( 0.1969697 0.1969697 0.5000000), wk = 0.0025063 k( 307) = ( 0.1919192 0.1919192 0.5000000), wk = 0.0025063 k( 308) = ( 0.1868687 0.1868687 0.5000000), wk = 0.0025063 k( 309) = ( 0.1818182 0.1818182 0.5000000), wk = 0.0025063 k( 310) = ( 0.1767677 0.1767677 0.5000000), wk = 0.0025063 k( 311) = ( 0.1717172 0.1717172 0.5000000), wk = 0.0025063 k( 312) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0025063 k( 313) = ( 0.1616162 0.1616162 0.5000000), wk = 0.0025063 k( 314) = ( 0.1565657 0.1565657 0.5000000), wk = 0.0025063 k( 315) = ( 0.1515151 0.1515151 0.5000000), wk = 0.0025063 k( 316) = ( 0.1464647 0.1464647 0.5000000), wk = 0.0025063 k( 317) = ( 0.1414141 0.1414141 0.5000000), wk = 0.0025063 k( 318) = ( 0.1363636 0.1363636 0.5000000), wk = 0.0025063 k( 319) = ( 0.1313131 0.1313131 0.5000000), wk = 0.0025063 k( 320) = ( 0.1262626 0.1262626 0.5000000), wk = 0.0025063 k( 321) = ( 0.1212121 0.1212121 0.5000000), wk = 0.0025063 k( 322) = ( 0.1161616 0.1161616 0.5000000), wk = 0.0025063 k( 323) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0025063 k( 324) = ( 0.1060606 0.1060606 0.5000000), wk = 0.0025063 k( 325) = ( 0.1010101 0.1010101 0.5000000), wk = 0.0025063 k( 326) = ( 0.0959596 0.0959596 0.5000000), wk = 0.0025063 k( 327) = ( 0.0909091 0.0909091 0.5000000), wk = 0.0025063 k( 328) = ( 0.0858586 0.0858586 0.5000000), wk = 0.0025063 k( 329) = ( 0.0808081 0.0808081 0.5000000), wk = 0.0025063 k( 330) = ( 0.0757576 0.0757576 0.5000000), wk = 0.0025063 k( 331) = ( 0.0707071 0.0707071 0.5000000), wk = 0.0025063 k( 332) = ( 0.0656566 0.0656566 0.5000000), wk = 0.0025063 k( 333) = ( 0.0606061 0.0606061 0.5000000), wk = 0.0025063 k( 334) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0025063 k( 335) = ( 0.0505051 0.0505050 0.5000000), wk = 0.0025063 k( 336) = ( 0.0454546 0.0454546 0.5000000), wk = 0.0025063 k( 337) = ( 0.0404040 0.0404040 0.5000000), wk = 0.0025063 k( 338) = ( 0.0353535 0.0353535 0.5000000), wk = 0.0025063 k( 339) = ( 0.0303030 0.0303030 0.5000000), wk = 0.0025063 k( 340) = ( 0.0252525 0.0252525 0.5000000), wk = 0.0025063 k( 341) = ( 0.0202020 0.0202020 0.5000000), wk = 0.0025063 k( 342) = ( 0.0151515 0.0151515 0.5000000), wk = 0.0025063 k( 343) = ( 0.0101010 0.0101010 0.5000000), wk = 0.0025063 k( 344) = ( 0.0050505 0.0050505 0.5000000), wk = 0.0025063 k( 345) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025063 k( 346) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025063 k( 347) = ( 0.5000000 0.0000000 0.4807692), wk = 0.0025063 k( 348) = ( 0.5000000 0.0000000 0.4615385), wk = 0.0025063 k( 349) = ( 0.5000000 0.0000000 0.4423077), wk = 0.0025063 k( 350) = ( 0.5000000 0.0000000 0.4230769), wk = 0.0025063 k( 351) = ( 0.5000000 0.0000000 0.4038461), wk = 0.0025063 k( 352) = ( 0.5000000 0.0000000 0.3846154), wk = 0.0025063 k( 353) = ( 0.5000000 0.0000000 0.3653846), wk = 0.0025063 k( 354) = ( 0.5000000 0.0000000 0.3461538), wk = 0.0025063 k( 355) = ( 0.5000000 0.0000000 0.3269231), wk = 0.0025063 k( 356) = ( 0.5000000 0.0000000 0.3076923), wk = 0.0025063 k( 357) = ( 0.5000000 0.0000000 0.2884615), wk = 0.0025063 k( 358) = ( 0.5000000 0.0000000 0.2692308), wk = 0.0025063 k( 359) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0025063 k( 360) = ( 0.5000000 0.0000000 0.2307692), wk = 0.0025063 k( 361) = ( 0.5000000 0.0000000 0.2115385), wk = 0.0025063 k( 362) = ( 0.5000000 0.0000000 0.1923077), wk = 0.0025063 k( 363) = ( 0.5000000 0.0000000 0.1730769), wk = 0.0025063 k( 364) = ( 0.5000000 0.0000000 0.1538461), wk = 0.0025063 k( 365) = ( 0.5000000 0.0000000 0.1346154), wk = 0.0025063 k( 366) = ( 0.5000000 0.0000000 0.1153846), wk = 0.0025063 k( 367) = ( 0.5000000 0.0000000 0.0961538), wk = 0.0025063 k( 368) = ( 0.5000000 0.0000000 0.0769231), wk = 0.0025063 k( 369) = ( 0.5000000 0.0000000 0.0576923), wk = 0.0025063 k( 370) = ( 0.5000000 0.0000000 0.0384615), wk = 0.0025063 k( 371) = ( 0.5000000 0.0000000 0.0192308), wk = 0.0025063 k( 372) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0025063 k( 373) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0025063 k( 374) = ( 0.3333333 0.3333333 0.0192308), wk = 0.0025063 k( 375) = ( 0.3333333 0.3333333 0.0384615), wk = 0.0025063 k( 376) = ( 0.3333333 0.3333333 0.0576923), wk = 0.0025063 k( 377) = ( 0.3333333 0.3333333 0.0769231), wk = 0.0025063 k( 378) = ( 0.3333333 0.3333333 0.0961538), wk = 0.0025063 k( 379) = ( 0.3333333 0.3333333 0.1153846), wk = 0.0025063 k( 380) = ( 0.3333333 0.3333333 0.1346154), wk = 0.0025063 k( 381) = ( 0.3333333 0.3333333 0.1538461), wk = 0.0025063 k( 382) = ( 0.3333333 0.3333333 0.1730769), wk = 0.0025063 k( 383) = ( 0.3333333 0.3333333 0.1923077), wk = 0.0025063 k( 384) = ( 0.3333333 0.3333333 0.2115385), wk = 0.0025063 k( 385) = ( 0.3333333 0.3333333 0.2307692), wk = 0.0025063 k( 386) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0025063 k( 387) = ( 0.3333333 0.3333333 0.2692308), wk = 0.0025063 k( 388) = ( 0.3333333 0.3333333 0.2884615), wk = 0.0025063 k( 389) = ( 0.3333333 0.3333333 0.3076923), wk = 0.0025063 k( 390) = ( 0.3333333 0.3333333 0.3269231), wk = 0.0025063 k( 391) = ( 0.3333333 0.3333333 0.3461538), wk = 0.0025063 k( 392) = ( 0.3333333 0.3333333 0.3653846), wk = 0.0025063 k( 393) = ( 0.3333333 0.3333333 0.3846154), wk = 0.0025063 k( 394) = ( 0.3333333 0.3333333 0.4038462), wk = 0.0025063 k( 395) = ( 0.3333333 0.3333333 0.4230769), wk = 0.0025063 k( 396) = ( 0.3333333 0.3333333 0.4423077), wk = 0.0025063 k( 397) = ( 0.3333333 0.3333333 0.4615385), wk = 0.0025063 k( 398) = ( 0.3333333 0.3333333 0.4807692), wk = 0.0025063 k( 399) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0025063 Dense grid: 35405 G-vectors FFT dimensions: ( 36, 36, 72) Smooth grid: 16437 G-vectors FFT dimensions: ( 27, 27, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.07 Mb ( 108, 44) NL pseudopotentials 0.08 Mb ( 54, 96) Each V/rho on FFT grid 0.04 Mb ( 2592) Each G-vector array 0.01 Mb ( 737) G-vector shells 0.00 Mb ( 377) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.29 Mb ( 108, 176) Each subspace H/S matrix 0.47 Mb ( 176, 176) Each matrix 0.13 Mb ( 96, 2, 44) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./NbN.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.6 secs Computing kpt #: 2 total cpu time spent up to now is 42.3 secs Computing kpt #: 3 total cpu time spent up to now is 43.2 secs Computing kpt #: 4 total cpu time spent up to now is 43.9 secs Computing kpt #: 5 total cpu time spent up to now is 44.5 secs Computing kpt #: 6 total cpu time spent up to now is 45.2 secs Computing kpt #: 7 total cpu time spent up to now is 45.9 secs Computing kpt #: 8 total cpu time spent up to now is 46.6 secs Computing kpt #: 9 total cpu time spent up to now is 47.4 secs Computing kpt #: 10 total cpu time spent up to now is 48.2 secs Computing kpt #: 11 total cpu time spent up to now is 49.1 secs Computing kpt #: 12 total cpu time spent up to now is 50.2 secs Computing kpt #: 13 total cpu time spent up to now is 51.2 secs Computing kpt #: 14 total cpu time spent up to now is 52.4 secs Computing kpt #: 15 total cpu time spent up to now is 53.8 secs Computing kpt #: 16 total cpu time spent up to now is 54.8 secs Computing kpt #: 17 total cpu time spent up to now is 55.6 secs Computing kpt #: 18 total cpu time spent up to now is 56.3 secs Computing kpt #: 19 total cpu time spent up to now is 57.4 secs Computing kpt #: 20 total cpu time spent up to now is 58.2 secs Computing kpt #: 21 total cpu time spent up to now is 59.1 secs Computing kpt #: 22 total cpu time spent up to now is 60.2 secs Computing kpt #: 23 total cpu time spent up to now is 61.1 secs Computing kpt #: 24 total cpu time spent up to now is 62.2 secs Computing kpt #: 25 total cpu time spent up to now is 63.2 secs Computing kpt #: 26 total cpu time spent up to now is 64.0 secs Computing kpt #: 27 total cpu time spent up to now is 64.9 secs Computing kpt #: 28 total cpu time spent up to now is 65.7 secs Computing kpt #: 29 total cpu time spent up to now is 66.6 secs Computing kpt #: 30 total cpu time spent up to now is 67.4 secs Computing kpt #: 31 total cpu time spent up to now is 69.2 secs Computing kpt #: 32 total cpu time spent up to now is 71.1 secs Computing kpt #: 33 total cpu time spent up to now is 72.7 secs Computing kpt #: 34 total cpu time spent up to now is 74.1 secs Computing kpt #: 35 total cpu time spent up to now is 75.2 secs Computing kpt #: 36 total cpu time spent up to now is 76.1 secs Computing kpt #: 37 total cpu time spent up to now is 77.0 secs Computing kpt #: 38 total cpu time spent up to now is 77.9 secs Computing kpt #: 39 total cpu time spent up to now is 78.8 secs Computing kpt #: 40 total cpu time spent up to now is 79.7 secs Computing kpt #: 41 total cpu time spent up to now is 80.7 secs Computing kpt #: 42 total cpu time spent up to now is 81.7 secs Computing kpt #: 43 total cpu time spent up to now is 82.6 secs Computing kpt #: 44 total cpu time spent up to now is 84.0 secs Computing kpt #: 45 total cpu time spent up to now is 85.8 secs Computing kpt #: 46 total cpu time spent up to now is 87.1 secs Computing kpt #: 47 total cpu time spent up to now is 88.7 secs Computing kpt #: 48 total cpu time spent up to now is 89.5 secs Computing kpt #: 49 total cpu time spent up to now is 90.4 secs Computing kpt #: 50 total cpu time spent up to now is 91.4 secs Computing kpt #: 51 total cpu time spent up to now is 92.4 secs Computing kpt #: 52 total cpu time spent up to now is 93.9 secs Computing kpt #: 53 total cpu time spent up to now is 95.5 secs Computing kpt #: 54 total cpu time spent up to now is 97.2 secs Computing kpt #: 55 total cpu time spent up to now is 100.3 secs Computing kpt #: 56 total cpu time spent up to now is 102.0 secs Computing kpt #: 57 total cpu time spent up to now is 102.9 secs Computing kpt #: 58 total cpu time spent up to now is 104.2 secs Computing kpt #: 59 total cpu time spent up to now is 105.3 secs Computing kpt #: 60 total cpu time spent up to now is 107.3 secs Computing kpt #: 61 total cpu time spent up to now is 110.8 secs Computing kpt #: 62 total cpu time spent up to now is 112.3 secs Computing kpt #: 63 total cpu time spent up to now is 114.1 secs Computing kpt #: 64 total cpu time spent up to now is 115.6 secs Computing kpt #: 65 total cpu time spent up to now is 116.9 secs Computing kpt #: 66 total cpu time spent up to now is 117.7 secs Computing kpt #: 67 total cpu time spent up to now is 118.9 secs Computing kpt #: 68 total cpu time spent up to now is 120.0 secs Computing kpt #: 69 total cpu time spent up to now is 121.1 secs Computing kpt #: 70 total cpu time spent up to now is 122.3 secs Computing kpt #: 71 total cpu time spent up to now is 124.5 secs Computing kpt #: 72 total cpu time spent up to now is 125.5 secs Computing kpt #: 73 total cpu time spent up to now is 126.7 secs Computing kpt #: 74 total cpu time spent up to now is 127.5 secs Computing kpt #: 75 total cpu time spent up to now is 129.4 secs Computing kpt #: 76 total cpu time spent up to now is 130.3 secs Computing kpt #: 77 total cpu time spent up to now is 131.6 secs Computing kpt #: 78 total cpu time spent up to now is 132.8 secs Computing kpt #: 79 total cpu time spent up to now is 134.1 secs Computing kpt #: 80 total cpu time spent up to now is 135.3 secs Computing kpt #: 81 total cpu time spent up to now is 136.2 secs Computing kpt #: 82 total cpu time spent up to now is 137.3 secs Computing kpt #: 83 total cpu time spent up to now is 138.9 secs Computing kpt #: 84 total cpu time spent up to now is 140.0 secs Computing kpt #: 85 total cpu time spent up to now is 141.7 secs Computing kpt #: 86 total cpu time spent up to now is 143.4 secs Computing kpt #: 87 total cpu time spent up to now is 145.3 secs Computing kpt #: 88 total cpu time spent up to now is 146.6 secs Computing kpt #: 89 total cpu time spent up to now is 148.9 secs Computing kpt #: 90 total cpu time spent up to now is 150.5 secs Computing kpt #: 91 total cpu time spent up to now is 153.1 secs Computing kpt #: 92 total cpu time spent up to now is 154.3 secs Computing kpt #: 93 total cpu time spent up to now is 155.5 secs Computing kpt #: 94 total cpu time spent up to now is 156.7 secs Computing kpt #: 95 total cpu time spent up to now is 158.0 secs Computing kpt #: 96 total cpu time spent up to now is 159.3 secs Computing kpt #: 97 total cpu time spent up to now is 160.6 secs Computing kpt #: 98 total cpu time spent up to now is 161.8 secs Computing kpt #: 99 total cpu time spent up to now is 162.8 secs Computing kpt #: 100 total cpu time spent up to now is 165.7 secs Computing kpt #: 101 total cpu time spent up to now is 167.2 secs Computing kpt #: 102 total cpu time spent up to now is 168.2 secs Computing kpt #: 103 total cpu time spent up to now is 169.4 secs Computing kpt #: 104 total cpu time spent up to now is 170.5 secs Computing kpt #: 105 total cpu time spent up to now is 172.0 secs Computing kpt #: 106 total cpu time spent up to now is 173.0 secs Computing kpt #: 107 total cpu time spent up to now is 173.9 secs Computing kpt #: 108 total cpu time spent up to now is 174.8 secs Computing kpt #: 109 total cpu time spent up to now is 175.7 secs Computing kpt #: 110 total cpu time spent up to now is 176.9 secs Computing kpt #: 111 total cpu time spent up to now is 179.5 secs Computing kpt #: 112 total cpu time spent up to now is 180.7 secs Computing kpt #: 113 total cpu time spent up to now is 181.9 secs Computing kpt #: 114 total cpu time spent up to now is 183.0 secs Computing kpt #: 115 total cpu time spent up to now is 184.1 secs Computing kpt #: 116 total cpu time spent up to now is 185.2 secs Computing kpt #: 117 total cpu time spent up to now is 186.0 secs Computing kpt #: 118 total cpu time spent up to now is 186.8 secs Computing kpt #: 119 total cpu time spent up to now is 187.6 secs Computing kpt #: 120 total cpu time spent up to now is 189.9 secs Computing kpt #: 121 total cpu time spent up to now is 191.6 secs Computing kpt #: 122 total cpu time spent up to now is 193.0 secs Computing kpt #: 123 total cpu time spent up to now is 194.5 secs Computing kpt #: 124 total cpu time spent up to now is 197.4 secs Computing kpt #: 125 total cpu time spent up to now is 199.4 secs Computing kpt #: 126 total cpu time spent up to now is 201.6 secs Computing kpt #: 127 total cpu time spent up to now is 202.7 secs Computing kpt #: 128 total cpu time spent up to now is 203.5 secs Computing kpt #: 129 total cpu time spent up to now is 204.4 secs Computing kpt #: 130 total cpu time spent up to now is 205.5 secs Computing kpt #: 131 total cpu time spent up to now is 206.6 secs Computing kpt #: 132 total cpu time spent up to now is 207.9 secs Computing kpt #: 133 total cpu time spent up to now is 209.9 secs Computing kpt #: 134 total cpu time spent up to now is 211.2 secs Computing kpt #: 135 total cpu time spent up to now is 211.9 secs Computing kpt #: 136 total cpu time spent up to now is 212.7 secs Computing kpt #: 137 total cpu time spent up to now is 213.4 secs Computing kpt #: 138 total cpu time spent up to now is 214.2 secs Computing kpt #: 139 total cpu time spent up to now is 215.1 secs Computing kpt #: 140 total cpu time spent up to now is 216.1 secs Computing kpt #: 141 total cpu time spent up to now is 217.1 secs Computing kpt #: 142 total cpu time spent up to now is 218.3 secs Computing kpt #: 143 total cpu time spent up to now is 219.5 secs Computing kpt #: 144 total cpu time spent up to now is 221.4 secs Computing kpt #: 145 total cpu time spent up to now is 222.2 secs Computing kpt #: 146 total cpu time spent up to now is 223.4 secs Computing kpt #: 147 total cpu time spent up to now is 224.1 secs Computing kpt #: 148 total cpu time spent up to now is 224.8 secs Computing kpt #: 149 total cpu time spent up to now is 225.5 secs Computing kpt #: 150 total cpu time spent up to now is 226.6 secs Computing kpt #: 151 total cpu time spent up to now is 227.3 secs Computing kpt #: 152 total cpu time spent up to now is 228.1 secs Computing kpt #: 153 total cpu time spent up to now is 228.9 secs Computing kpt #: 154 total cpu time spent up to now is 229.8 secs Computing kpt #: 155 total cpu time spent up to now is 230.7 secs Computing kpt #: 156 total cpu time spent up to now is 231.6 secs Computing kpt #: 157 total cpu time spent up to now is 233.4 secs Computing kpt #: 158 total cpu time spent up to now is 234.2 secs Computing kpt #: 159 total cpu time spent up to now is 235.6 secs Computing kpt #: 160 total cpu time spent up to now is 236.3 secs Computing kpt #: 161 total cpu time spent up to now is 237.1 secs Computing kpt #: 162 total cpu time spent up to now is 237.8 secs Computing kpt #: 163 total cpu time spent up to now is 238.4 secs Computing kpt #: 164 total cpu time spent up to now is 239.1 secs Computing kpt #: 165 total cpu time spent up to now is 239.8 secs Computing kpt #: 166 total cpu time spent up to now is 240.8 secs Computing kpt #: 167 total cpu time spent up to now is 241.4 secs Computing kpt #: 168 total cpu time spent up to now is 242.1 secs Computing kpt #: 169 total cpu time spent up to now is 242.8 secs Computing kpt #: 170 total cpu time spent up to now is 245.9 secs Computing kpt #: 171 total cpu time spent up to now is 246.6 secs Computing kpt #: 172 total cpu time spent up to now is 247.7 secs Computing kpt #: 173 total cpu time spent up to now is 249.1 secs Computing kpt #: 174 total cpu time spent up to now is 250.4 secs Computing kpt #: 175 total cpu time spent up to now is 251.4 secs Computing kpt #: 176 total cpu time spent up to now is 252.2 secs Computing kpt #: 177 total cpu time spent up to now is 253.3 secs Computing kpt #: 178 total cpu time spent up to now is 254.4 secs Computing kpt #: 179 total cpu time spent up to now is 255.2 secs Computing kpt #: 180 total cpu time spent up to now is 255.9 secs Computing kpt #: 181 total cpu time spent up to now is 256.6 secs Computing kpt #: 182 total cpu time spent up to now is 257.3 secs Computing kpt #: 183 total cpu time spent up to now is 258.0 secs Computing kpt #: 184 total cpu time spent up to now is 258.7 secs Computing kpt #: 185 total cpu time spent up to now is 259.8 secs Computing kpt #: 186 total cpu time spent up to now is 260.5 secs Computing kpt #: 187 total cpu time spent up to now is 262.3 secs Computing kpt #: 188 total cpu time spent up to now is 263.7 secs Computing kpt #: 189 total cpu time spent up to now is 265.1 secs Computing kpt #: 190 total cpu time spent up to now is 266.4 secs Computing kpt #: 191 total cpu time spent up to now is 267.8 secs Computing kpt #: 192 total cpu time spent up to now is 268.5 secs Computing kpt #: 193 total cpu time spent up to now is 269.3 secs Computing kpt #: 194 total cpu time spent up to now is 270.0 secs Computing kpt #: 195 total cpu time spent up to now is 271.0 secs Computing kpt #: 196 total cpu time spent up to now is 272.1 secs Computing kpt #: 197 total cpu time spent up to now is 273.4 secs Computing kpt #: 198 total cpu time spent up to now is 274.8 secs Computing kpt #: 199 total cpu time spent up to now is 277.1 secs Computing kpt #: 200 total cpu time spent up to now is 279.3 secs Computing kpt #: 201 total cpu time spent up to now is 280.3 secs Computing kpt #: 202 total cpu time spent up to now is 281.9 secs Computing kpt #: 203 total cpu time spent up to now is 282.6 secs Computing kpt #: 204 total cpu time spent up to now is 283.3 secs Computing kpt #: 205 total cpu time spent up to now is 284.1 secs Computing kpt #: 206 total cpu time spent up to now is 284.8 secs Computing kpt #: 207 total cpu time spent up to now is 285.5 secs Computing kpt #: 208 total cpu time spent up to now is 286.9 secs Computing kpt #: 209 total cpu time spent up to now is 288.2 secs Computing kpt #: 210 total cpu time spent up to now is 289.5 secs Computing kpt #: 211 total cpu time spent up to now is 290.7 secs Computing kpt #: 212 total cpu time spent up to now is 291.9 secs Computing kpt #: 213 total cpu time spent up to now is 293.0 secs Computing kpt #: 214 total cpu time spent up to now is 295.9 secs Computing kpt #: 215 total cpu time spent up to now is 298.2 secs Computing kpt #: 216 total cpu time spent up to now is 298.9 secs Computing kpt #: 217 total cpu time spent up to now is 300.7 secs Computing kpt #: 218 total cpu time spent up to now is 301.4 secs Computing kpt #: 219 total cpu time spent up to now is 302.2 secs Computing kpt #: 220 total cpu time spent up to now is 302.9 secs Computing kpt #: 221 total cpu time spent up to now is 303.7 secs Computing kpt #: 222 total cpu time spent up to now is 304.5 secs Computing kpt #: 223 total cpu time spent up to now is 305.2 secs Computing kpt #: 224 total cpu time spent up to now is 306.1 secs Computing kpt #: 225 total cpu time spent up to now is 307.7 secs Computing kpt #: 226 total cpu time spent up to now is 308.5 secs Computing kpt #: 227 total cpu time spent up to now is 310.1 secs Computing kpt #: 228 total cpu time spent up to now is 311.1 secs Computing kpt #: 229 total cpu time spent up to now is 311.9 secs Computing kpt #: 230 total cpu time spent up to now is 312.6 secs Computing kpt #: 231 total cpu time spent up to now is 313.9 secs Computing kpt #: 232 total cpu time spent up to now is 314.8 secs Computing kpt #: 233 total cpu time spent up to now is 316.9 secs Computing kpt #: 234 total cpu time spent up to now is 318.6 secs Computing kpt #: 235 total cpu time spent up to now is 319.8 secs Computing kpt #: 236 total cpu time spent up to now is 320.6 secs Computing kpt #: 237 total cpu time spent up to now is 321.4 secs Computing kpt #: 238 total cpu time spent up to now is 322.2 secs Computing kpt #: 239 total cpu time spent up to now is 323.1 secs Computing kpt #: 240 total cpu time spent up to now is 324.6 secs Computing kpt #: 241 total cpu time spent up to now is 327.4 secs Computing kpt #: 242 total cpu time spent up to now is 329.0 secs Computing kpt #: 243 total cpu time spent up to now is 330.4 secs Computing kpt #: 244 total cpu time spent up to now is 331.5 secs Computing kpt #: 245 total cpu time spent up to now is 332.6 secs Computing kpt #: 246 total cpu time spent up to now is 333.4 secs Computing kpt #: 247 total cpu time spent up to now is 334.2 secs Computing kpt #: 248 total cpu time spent up to now is 335.0 secs Computing kpt #: 249 total cpu time spent up to now is 336.1 secs Computing kpt #: 250 total cpu time spent up to now is 336.9 secs Computing kpt #: 251 total cpu time spent up to now is 337.8 secs Computing kpt #: 252 total cpu time spent up to now is 339.2 secs Computing kpt #: 253 total cpu time spent up to now is 340.5 secs Computing kpt #: 254 total cpu time spent up to now is 341.7 secs Computing kpt #: 255 total cpu time spent up to now is 342.8 secs Computing kpt #: 256 total cpu time spent up to now is 344.0 secs Computing kpt #: 257 total cpu time spent up to now is 346.6 secs Computing kpt #: 258 total cpu time spent up to now is 347.8 secs Computing kpt #: 259 total cpu time spent up to now is 348.9 secs Computing kpt #: 260 total cpu time spent up to now is 350.6 secs Computing kpt #: 261 total cpu time spent up to now is 352.0 secs Computing kpt #: 262 total cpu time spent up to now is 354.1 secs Computing kpt #: 263 total cpu time spent up to now is 355.7 secs Computing kpt #: 264 total cpu time spent up to now is 356.6 secs Computing kpt #: 265 total cpu time spent up to now is 357.5 secs Computing kpt #: 266 total cpu time spent up to now is 358.4 secs Computing kpt #: 267 total cpu time spent up to now is 359.3 secs Computing kpt #: 268 total cpu time spent up to now is 360.2 secs Computing kpt #: 269 total cpu time spent up to now is 361.1 secs Computing kpt #: 270 total cpu time spent up to now is 361.9 secs Computing kpt #: 271 total cpu time spent up to now is 362.8 secs Computing kpt #: 272 total cpu time spent up to now is 364.0 secs Computing kpt #: 273 total cpu time spent up to now is 365.5 secs Computing kpt #: 274 total cpu time spent up to now is 367.1 secs Computing kpt #: 275 total cpu time spent up to now is 368.0 secs Computing kpt #: 276 total cpu time spent up to now is 369.4 secs Computing kpt #: 277 total cpu time spent up to now is 370.9 secs Computing kpt #: 278 total cpu time spent up to now is 372.2 secs Computing kpt #: 279 total cpu time spent up to now is 374.0 secs Computing kpt #: 280 total cpu time spent up to now is 375.3 secs Computing kpt #: 281 total cpu time spent up to now is 376.1 secs Computing kpt #: 282 total cpu time spent up to now is 377.0 secs Computing kpt #: 283 total cpu time spent up to now is 377.9 secs Computing kpt #: 284 total cpu time spent up to now is 378.8 secs Computing kpt #: 285 total cpu time spent up to now is 379.7 secs Computing kpt #: 286 total cpu time spent up to now is 380.8 secs Computing kpt #: 287 total cpu time spent up to now is 382.2 secs Computing kpt #: 288 total cpu time spent up to now is 383.5 secs Computing kpt #: 289 total cpu time spent up to now is 386.0 secs Computing kpt #: 290 total cpu time spent up to now is 387.2 secs Computing kpt #: 291 total cpu time spent up to now is 388.4 secs Computing kpt #: 292 total cpu time spent up to now is 389.6 secs Computing kpt #: 293 total cpu time spent up to now is 390.5 secs Computing kpt #: 294 total cpu time spent up to now is 391.4 secs Computing kpt #: 295 total cpu time spent up to now is 392.3 secs Computing kpt #: 296 total cpu time spent up to now is 393.2 secs Computing kpt #: 297 total cpu time spent up to now is 394.1 secs Computing kpt #: 298 total cpu time spent up to now is 395.0 secs Computing kpt #: 299 total cpu time spent up to now is 396.6 secs Computing kpt #: 300 total cpu time spent up to now is 397.9 secs Computing kpt #: 301 total cpu time spent up to now is 399.1 secs Computing kpt #: 302 total cpu time spent up to now is 399.9 secs Computing kpt #: 303 total cpu time spent up to now is 400.7 secs Computing kpt #: 304 total cpu time spent up to now is 401.4 secs Computing kpt #: 305 total cpu time spent up to now is 402.2 secs Computing kpt #: 306 total cpu time spent up to now is 402.9 secs Computing kpt #: 307 total cpu time spent up to now is 403.7 secs Computing kpt #: 308 total cpu time spent up to now is 404.8 secs Computing kpt #: 309 total cpu time spent up to now is 406.2 secs Computing kpt #: 310 total cpu time spent up to now is 407.2 secs Computing kpt #: 311 total cpu time spent up to now is 408.4 secs Computing kpt #: 312 total cpu time spent up to now is 409.5 secs Computing kpt #: 313 total cpu time spent up to now is 411.0 secs Computing kpt #: 314 total cpu time spent up to now is 412.3 secs Computing kpt #: 315 total cpu time spent up to now is 413.7 secs Computing kpt #: 316 total cpu time spent up to now is 415.0 secs Computing kpt #: 317 total cpu time spent up to now is 415.8 secs Computing kpt #: 318 total cpu time spent up to now is 416.6 secs Computing kpt #: 319 total cpu time spent up to now is 417.3 secs Computing kpt #: 320 total cpu time spent up to now is 418.0 secs Computing kpt #: 321 total cpu time spent up to now is 418.7 secs Computing kpt #: 322 total cpu time spent up to now is 419.5 secs Computing kpt #: 323 total cpu time spent up to now is 420.3 secs Computing kpt #: 324 total cpu time spent up to now is 421.0 secs Computing kpt #: 325 total cpu time spent up to now is 421.9 secs Computing kpt #: 326 total cpu time spent up to now is 423.1 secs Computing kpt #: 327 total cpu time spent up to now is 424.1 secs Computing kpt #: 328 total cpu time spent up to now is 425.1 secs Computing kpt #: 329 total cpu time spent up to now is 426.3 secs Computing kpt #: 330 total cpu time spent up to now is 427.4 secs Computing kpt #: 331 total cpu time spent up to now is 428.6 secs Computing kpt #: 332 total cpu time spent up to now is 431.4 secs Computing kpt #: 333 total cpu time spent up to now is 432.7 secs Computing kpt #: 334 total cpu time spent up to now is 433.4 secs Computing kpt #: 335 total cpu time spent up to now is 434.1 secs Computing kpt #: 336 total cpu time spent up to now is 434.8 secs Computing kpt #: 337 total cpu time spent up to now is 435.5 secs Computing kpt #: 338 total cpu time spent up to now is 436.3 secs Computing kpt #: 339 total cpu time spent up to now is 438.0 secs Computing kpt #: 340 total cpu time spent up to now is 439.1 secs Computing kpt #: 341 total cpu time spent up to now is 440.2 secs Computing kpt #: 342 total cpu time spent up to now is 441.0 secs Computing kpt #: 343 total cpu time spent up to now is 442.1 secs Computing kpt #: 344 total cpu time spent up to now is 443.5 secs Computing kpt #: 345 total cpu time spent up to now is 444.5 secs Computing kpt #: 346 total cpu time spent up to now is 445.5 secs Computing kpt #: 347 total cpu time spent up to now is 446.6 secs Computing kpt #: 348 total cpu time spent up to now is 448.0 secs Computing kpt #: 349 total cpu time spent up to now is 448.7 secs Computing kpt #: 350 total cpu time spent up to now is 449.6 secs Computing kpt #: 351 total cpu time spent up to now is 450.4 secs Computing kpt #: 352 total cpu time spent up to now is 451.1 secs Computing kpt #: 353 total cpu time spent up to now is 452.1 secs Computing kpt #: 354 total cpu time spent up to now is 453.3 secs Computing kpt #: 355 total cpu time spent up to now is 454.9 secs Computing kpt #: 356 total cpu time spent up to now is 456.2 secs Computing kpt #: 357 total cpu time spent up to now is 457.7 secs Computing kpt #: 358 total cpu time spent up to now is 459.8 secs Computing kpt #: 359 total cpu time spent up to now is 462.5 secs Computing kpt #: 360 total cpu time spent up to now is 464.4 secs Computing kpt #: 361 total cpu time spent up to now is 465.2 secs Computing kpt #: 362 total cpu time spent up to now is 466.0 secs Computing kpt #: 363 total cpu time spent up to now is 466.8 secs Computing kpt #: 364 total cpu time spent up to now is 467.7 secs Computing kpt #: 365 total cpu time spent up to now is 468.6 secs Computing kpt #: 366 total cpu time spent up to now is 470.1 secs Computing kpt #: 367 total cpu time spent up to now is 471.2 secs Computing kpt #: 368 total cpu time spent up to now is 472.6 secs Computing kpt #: 369 total cpu time spent up to now is 474.2 secs Computing kpt #: 370 total cpu time spent up to now is 475.5 secs Computing kpt #: 371 total cpu time spent up to now is 476.3 secs Computing kpt #: 372 total cpu time spent up to now is 477.1 secs Computing kpt #: 373 total cpu time spent up to now is 478.2 secs Computing kpt #: 374 total cpu time spent up to now is 479.5 secs Computing kpt #: 375 total cpu time spent up to now is 481.7 secs Computing kpt #: 376 total cpu time spent up to now is 482.9 secs Computing kpt #: 377 total cpu time spent up to now is 484.1 secs Computing kpt #: 378 total cpu time spent up to now is 485.6 secs Computing kpt #: 379 total cpu time spent up to now is 486.6 secs Computing kpt #: 380 total cpu time spent up to now is 487.8 secs Computing kpt #: 381 total cpu time spent up to now is 490.6 secs Computing kpt #: 382 total cpu time spent up to now is 492.0 secs Computing kpt #: 383 total cpu time spent up to now is 493.5 secs Computing kpt #: 384 total cpu time spent up to now is 495.2 secs Computing kpt #: 385 total cpu time spent up to now is 496.9 secs Computing kpt #: 386 total cpu time spent up to now is 498.5 secs Computing kpt #: 387 total cpu time spent up to now is 499.6 secs Computing kpt #: 388 total cpu time spent up to now is 501.0 secs Computing kpt #: 389 total cpu time spent up to now is 501.9 secs Computing kpt #: 390 total cpu time spent up to now is 502.8 secs Computing kpt #: 391 total cpu time spent up to now is 503.8 secs Computing kpt #: 392 total cpu time spent up to now is 504.8 secs Computing kpt #: 393 total cpu time spent up to now is 505.7 secs Computing kpt #: 394 total cpu time spent up to now is 508.5 secs Computing kpt #: 395 total cpu time spent up to now is 509.4 secs Computing kpt #: 396 total cpu time spent up to now is 510.3 secs Computing kpt #: 397 total cpu time spent up to now is 511.2 secs Computing kpt #: 398 total cpu time spent up to now is 512.2 secs Computing kpt #: 399 total cpu time spent up to now is 513.4 secs ethr = 2.78E-11, avg # of iterations = 20.5 total cpu time spent up to now is 513.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2077 PWs) bands (ev): -40.4820 -40.4820 -40.4540 -40.4540 -18.0189 -18.0189 -17.8693 -17.8693 -16.0624 -16.0624 -15.7931 -15.7931 -15.7213 -15.7213 -15.6847 -15.6847 -0.8674 -0.8674 0.0483 0.0483 8.7116 8.7116 8.9533 8.9533 9.5342 9.5342 9.5442 9.5442 10.0889 10.0889 10.0988 10.0988 15.2037 15.2037 15.2179 15.2179 15.3081 15.3081 16.0300 16.0300 16.6194 16.6194 16.6724 16.6724 k = 0.0088 0.0051-0.0000 ( 2077 PWs) bands (ev): -40.4819 -40.4819 -40.4540 -40.4540 -18.0208 -18.0171 -17.8702 -17.8686 -16.0650 -16.0599 -15.7943 -15.7921 -15.7216 -15.7216 -15.6850 -15.6850 -0.8672 -0.8660 0.0460 0.0514 8.7120 8.7129 8.9526 8.9561 9.5335 9.5336 9.5437 9.5439 10.0889 10.0890 10.0984 10.0996 15.1999 15.2009 15.2159 15.2159 15.3111 15.3164 16.0210 16.0321 16.6130 16.6259 16.6725 16.6725 k = 0.0175 0.0101-0.0000 ( 2077 PWs) bands (ev): -40.4818 -40.4818 -40.4538 -40.4538 -18.0229 -18.0155 -17.8714 -17.8684 -16.0678 -16.0575 -15.7957 -15.7914 -15.7225 -15.7225 -15.6860 -15.6860 -0.8655 -0.8630 0.0444 0.0551 8.7141 8.7158 8.9539 8.9608 9.5299 9.5305 9.5434 9.5441 10.0877 10.0891 10.0998 10.1011 15.1870 15.1913 15.2105 15.2145 15.3251 15.3340 16.0054 16.0270 16.6071 16.6320 16.6728 16.6730 k = 0.0263 0.0152-0.0000 ( 2077 PWs) bands (ev): -40.4815 -40.4815 -40.4536 -40.4536 -18.0251 -18.0141 -17.8730 -17.8684 -16.0706 -16.0553 -15.7974 -15.7910 -15.7240 -15.7239 -15.6876 -15.6875 -0.8622 -0.8585 0.0434 0.0596 8.7177 8.7203 8.9571 8.9675 9.5224 9.5236 9.5450 9.5463 10.0847 10.0881 10.1037 10.1042 15.1669 15.1735 15.2056 15.2137 15.3477 15.3589 15.9838 16.0148 16.6018 16.6374 16.6732 16.6738 k = 0.0351 0.0203-0.0000 ( 2073 PWs) bands (ev): -40.4810 -40.4810 -40.4533 -40.4533 -18.0275 -18.0129 -17.8749 -17.8688 -16.0736 -16.0531 -15.7994 -15.7907 -15.7261 -15.7260 -15.6899 -15.6897 -0.8574 -0.8525 0.0432 0.0647 8.7230 8.7264 8.9623 8.9760 9.5112 9.5130 9.5482 9.5501 10.0799 10.0855 10.1096 10.1099 15.1410 15.1489 15.2012 15.2127 15.3775 15.3902 15.9571 15.9957 16.5972 16.6420 16.6736 16.6748 k = 0.0439 0.0253-0.0000 ( 2069 PWs) bands (ev): -40.4805 -40.4805 -40.4529 -40.4529 -18.0300 -18.0118 -17.8770 -17.8694 -16.0766 -16.0510 -15.8017 -15.7907 -15.7288 -15.7285 -15.6929 -15.6924 -0.8511 -0.8449 0.0437 0.0705 8.7297 8.7340 8.9694 8.9863 9.4971 9.4995 9.5529 9.5553 10.0738 10.0813 10.1171 10.1182 15.1097 15.1184 15.1968 15.2114 15.4137 15.4278 15.9260 15.9705 16.5935 16.6457 16.6737 16.6756 k = 0.0526 0.0304-0.0000 ( 2069 PWs) bands (ev): -40.4799 -40.4799 -40.4524 -40.4524 -18.0326 -18.0109 -17.8795 -17.8705 -16.0799 -16.0491 -15.8043 -15.7909 -15.7321 -15.7316 -15.6965 -15.6956 -0.8432 -0.8359 0.0449 0.0768 8.7379 8.7429 8.9781 8.9982 9.4806 9.4835 9.5587 9.5616 10.0666 10.0759 10.1267 10.1283 15.0730 15.0826 15.1923 15.2098 15.4559 15.4711 15.8915 15.9398 16.5904 16.6487 16.6736 16.6759 k = 0.0614 0.0355-0.0000 ( 2063 PWs) bands (ev): -40.4791 -40.4791 -40.4518 -40.4518 -18.0354 -18.0102 -17.8823 -17.8718 -16.0832 -16.0472 -15.8072 -15.7914 -15.7360 -15.7352 -15.7006 -15.6992 -0.8339 -0.8255 0.0467 0.0838 8.7474 8.7531 8.9884 9.0115 9.4621 9.4658 9.5656 9.5690 10.0585 10.0693 10.1381 10.1403 15.0309 15.0416 15.1879 15.2080 15.5035 15.5192 15.8548 15.9047 16.5878 16.6511 16.6732 16.6755 k = 0.0702 0.0405-0.0000 ( 2059 PWs) bands (ev): -40.4782 -40.4782 -40.4512 -40.4512 -18.0383 -18.0097 -17.8853 -17.8735 -16.0866 -16.0455 -15.8104 -15.7922 -15.7404 -15.7392 -15.7054 -15.7033 -0.8231 -0.8137 0.0492 0.0913 8.7581 8.7644 9.0001 9.0259 9.4424 9.4469 9.5735 9.5774 10.0495 10.0618 10.1513 10.1540 14.9838 14.9956 15.1836 15.2062 15.5552 15.5699 15.8186 15.8670 16.5856 16.6530 16.6723 16.6741 k = 0.0789 0.0456-0.0000 ( 2063 PWs) bands (ev): -40.4773 -40.4773 -40.4507 -40.4507 -18.0414 -18.0094 -17.8886 -17.8755 -16.0902 -16.0439 -15.8141 -15.7932 -15.7454 -15.7437 -15.7107 -15.7077 -0.8110 -0.8006 0.0523 0.0993 8.7697 8.7766 9.0126 9.0408 9.4222 9.4279 9.5824 9.5867 10.0397 10.0534 10.1662 10.1694 14.9317 14.9449 15.1797 15.2047 15.6080 15.6165 15.7894 15.8298 16.5837 16.6547 16.6711 16.6715 k = 0.0877 0.0506-0.0000 ( 2063 PWs) bands (ev): -40.4764 -40.4764 -40.4500 -40.4500 -18.0445 -18.0092 -17.8922 -17.8779 -16.0939 -16.0423 -15.8182 -15.7947 -15.7509 -15.7486 -15.7164 -15.7124 -0.7975 -0.7862 0.0560 0.1077 8.7819 8.7893 9.0257 9.0556 9.4026 9.4098 9.5921 9.5969 10.0295 10.0444 10.1828 10.1864 14.8750 14.8898 15.1763 15.2035 15.6387 15.6516 15.7877 15.8034 16.5820 16.6562 16.6680 16.6696 k = 0.0965 0.0557-0.0000 ( 2057 PWs) bands (ev): -40.4753 -40.4752 -40.4490 -40.4490 -18.0478 -18.0093 -17.8961 -17.8805 -16.0978 -16.0409 -15.8228 -15.7965 -15.7568 -15.7539 -15.7226 -15.7173 -0.7827 -0.7705 0.0602 0.1166 8.7945 8.8021 9.0385 9.0694 9.3847 9.3942 9.6026 9.6078 10.0189 10.0348 10.2010 10.2051 14.8142 14.8308 15.1736 15.2030 15.6204 15.6593 15.8146 15.8291 16.5808 16.6574 16.6638 16.6678 k = 0.1053 0.0608-0.0000 ( 2057 PWs) bands (ev): -40.4741 -40.4741 -40.4481 -40.4481 -18.0512 -18.0095 -17.9002 -17.8835 -16.1017 -16.0396 -15.8278 -15.7988 -15.7633 -15.7596 -15.7290 -15.7223 -0.7667 -0.7538 0.0649 0.1258 8.8068 8.8145 9.0504 9.0811 9.3701 9.3827 9.6138 9.6195 10.0080 10.0249 10.2208 10.2253 14.7497 14.7681 15.1719 15.2033 15.5810 15.6278 15.8662 15.8940 16.5802 16.6571 16.6606 16.6659 k = 0.1140 0.0658-0.0000 ( 2065 PWs) bands (ev): -40.4731 -40.4731 -40.4473 -40.4473 -18.0547 -18.0100 -17.9046 -17.8869 -16.1058 -16.0383 -15.8334 -15.8017 -15.7701 -15.7655 -15.7357 -15.7274 -0.7496 -0.7359 0.0701 0.1354 8.8182 8.8258 9.0605 9.0895 9.3605 9.3774 9.6256 9.6318 9.9972 10.0148 10.2421 10.2469 14.6820 14.7023 15.1713 15.2046 15.5340 15.5810 15.9335 15.9681 16.5805 16.6528 16.6611 16.6640 k = 0.1228 0.0709-0.0000 ( 2069 PWs) bands (ev): -40.4719 -40.4719 -40.4463 -40.4463 -18.0583 -18.0107 -17.9092 -17.8905 -16.1100 -16.0372 -15.8394 -15.8052 -15.7774 -15.7718 -15.7423 -15.7326 -0.7313 -0.7170 0.0757 0.1452 8.8279 8.8350 9.0682 9.0943 9.3575 9.3797 9.6380 9.6446 9.9866 10.0048 10.2648 10.2700 14.6116 14.6339 15.1721 15.2072 15.4835 15.5287 16.0059 16.0461 16.5825 16.6485 16.6624 16.6625 k = 0.1316 0.0760-0.0000 ( 2065 PWs) bands (ev): -40.4705 -40.4705 -40.4451 -40.4451 -18.0620 -18.0115 -17.9140 -17.8944 -16.1143 -16.0362 -15.8461 -15.8096 -15.7850 -15.7782 -15.7488 -15.7376 -0.7120 -0.6972 0.0817 0.1552 8.8347 8.8409 9.0738 9.0958 9.3621 9.3903 9.6509 9.6579 9.9765 9.9950 10.2888 10.2945 14.5392 14.5634 15.1745 15.2112 15.4312 15.4736 16.0787 16.1251 16.5875 16.6459 16.6614 16.6642 k = 0.1404 0.0810-0.0000 ( 2061 PWs) bands (ev): -40.4690 -40.4690 -40.4439 -40.4439 -18.0657 -18.0126 -17.9190 -17.8987 -16.1187 -16.0353 -15.8533 -15.8149 -15.7929 -15.7849 -15.7550 -15.7426 -0.6918 -0.6766 0.0881 0.1653 8.8375 8.8424 9.0783 9.0958 9.3745 9.4087 9.6641 9.6716 9.9670 9.9858 10.3142 10.3202 14.4651 14.4913 15.1786 15.2166 15.3779 15.4170 16.1482 16.2018 16.5970 16.6471 16.6617 16.6662 k = 0.1491 0.0861-0.0000 ( 2053 PWs) bands (ev): -40.4675 -40.4674 -40.4425 -40.4425 -18.0696 -18.0139 -17.9242 -17.9032 -16.1233 -16.0345 -15.8610 -15.8211 -15.8012 -15.7917 -15.7607 -15.7474 -0.6707 -0.6551 0.0947 0.1756 8.8351 8.8384 9.0832 9.0965 9.3940 9.4337 9.6776 9.6855 9.9585 9.9772 10.3408 10.3472 14.3900 14.4181 15.1845 15.2230 15.3247 15.3597 16.2104 16.2721 16.6121 16.6552 16.6652 16.6690 k = 0.1579 0.0912-0.0000 ( 2049 PWs) bands (ev): -40.4659 -40.4659 -40.4411 -40.4411 -18.0735 -18.0154 -17.9297 -17.9080 -16.1279 -16.0338 -15.8693 -15.8284 -15.8099 -15.7986 -15.7659 -15.7521 -0.6488 -0.6330 0.1016 0.1858 8.8270 8.8286 9.0899 9.0995 9.4195 9.4642 9.6913 9.6997 9.9513 9.9697 10.3686 10.3753 14.3145 14.3443 15.1915 15.2264 15.2761 15.3027 16.2610 16.3301 16.6297 16.6677 16.6786 16.6801 k = 0.1667 0.0962-0.0000 ( 2051 PWs) bands (ev): -40.4643 -40.4643 -40.4399 -40.4399 -18.0775 -18.0171 -17.9352 -17.9131 -16.1327 -16.0333 -15.8781 -15.8366 -15.8189 -15.8056 -15.7705 -15.7566 -0.6262 -0.6103 0.1087 0.1961 8.8134 8.8136 9.0988 9.1055 9.4501 9.4990 9.7051 9.7138 9.9456 9.9635 10.3974 10.4044 14.2390 14.2706 15.1958 15.2000 15.2505 15.2590 16.2972 16.3706 16.6405 16.6723 16.7132 16.7164 k = 0.1754 0.1013-0.0000 ( 2051 PWs) bands (ev): -40.4626 -40.4626 -40.4385 -40.4385 -18.0815 -18.0190 -17.9410 -17.9184 -16.1375 -16.0330 -15.8873 -15.8457 -15.8282 -15.8126 -15.7745 -15.7609 -0.6030 -0.5870 0.1160 0.2063 8.7943 8.7953 9.1094 9.1143 9.4848 9.5374 9.7189 9.7280 9.9418 9.9589 10.4272 10.4346 14.1641 14.1974 15.1486 15.1697 15.2312 15.2692 16.3194 16.3926 16.6454 16.6760 16.7670 16.7711 k = 0.1842 0.1064-0.0000 ( 2053 PWs) bands (ev): -40.4609 -40.4609 -40.4372 -40.4372 -18.0856 -18.0211 -17.9469 -17.9241 -16.1425 -16.0328 -15.8970 -15.8555 -15.8376 -15.8196 -15.7782 -15.7651 -0.5793 -0.5634 0.1233 0.2164 8.7720 8.7737 9.1213 9.1251 9.5227 9.5786 9.7326 9.7422 9.9400 9.9561 10.4579 10.4655 14.0903 14.1252 15.0937 15.1159 15.2422 15.2856 16.3302 16.4000 16.6487 16.6803 16.8322 16.8383 k = 0.1930 0.1114-0.0000 ( 2049 PWs) bands (ev): -40.4591 -40.4591 -40.4357 -40.4357 -18.0897 -18.0234 -17.9529 -17.9299 -16.1475 -16.0328 -15.9070 -15.8659 -15.8472 -15.8265 -15.7815 -15.7691 -0.5551 -0.5394 0.1308 0.2263 8.7477 8.7499 9.1335 9.1370 9.5635 9.6222 9.7462 9.7561 9.9406 9.9554 10.4893 10.4973 14.0182 14.0546 15.0380 15.0583 15.2602 15.3056 16.3329 16.3976 16.6521 16.6852 16.9031 16.9121 k = 0.2018 0.1165-0.0000 ( 2045 PWs) bands (ev): -40.4572 -40.4572 -40.4342 -40.4342 -18.0939 -18.0258 -17.9591 -17.9360 -16.1526 -16.0330 -15.9173 -15.8769 -15.8567 -15.8334 -15.7845 -15.7729 -0.5305 -0.5151 0.1383 0.2360 8.7224 8.7248 9.1453 9.1490 9.6064 9.6677 9.7596 9.7699 9.9438 9.9571 10.5215 10.5297 13.9483 13.9862 14.9822 15.0001 15.2821 15.3288 16.3301 16.3893 16.6561 16.6910 16.9758 16.9879 k = 0.2105 0.1215-0.0000 ( 2046 PWs) bands (ev): -40.4553 -40.4553 -40.4328 -40.4328 -18.0981 -18.0285 -17.9653 -17.9423 -16.1577 -16.0335 -15.9279 -15.8884 -15.8661 -15.8401 -15.7874 -15.7766 -0.5057 -0.4907 0.1458 0.2455 8.6968 8.6992 9.1561 9.1606 9.6511 9.7148 9.7726 9.7834 9.9497 9.9612 10.5542 10.5627 13.8810 13.9204 14.9266 14.9420 15.3075 15.3551 16.3237 16.3772 16.6609 16.6976 17.0472 17.0626 k = 0.2193 0.1266-0.0000 ( 2048 PWs) bands (ev): -40.4535 -40.4535 -40.4314 -40.4314 -18.1023 -18.0314 -17.9717 -17.9487 -16.1629 -16.0343 -15.9388 -15.9003 -15.8753 -15.8466 -15.7901 -15.7802 -0.4806 -0.4662 0.1532 0.2546 8.6714 8.6738 9.1655 9.1710 9.6971 9.7631 9.7853 9.7968 9.9584 9.9680 10.5874 10.5962 13.8171 13.8578 14.8713 14.8843 15.3362 15.3847 16.3147 16.3628 16.6669 16.7054 17.1153 17.1338 k = 0.2281 0.1317-0.0000 ( 2048 PWs) bands (ev): -40.4516 -40.4516 -40.4299 -40.4299 -18.1064 -18.0344 -17.9781 -17.9554 -16.1681 -16.0355 -15.9497 -15.9125 -15.8841 -15.8529 -15.7927 -15.7836 -0.4555 -0.4417 0.1606 0.2634 8.6466 8.6489 9.1731 9.1799 9.7437 9.7976 9.8104 9.8123 9.9698 9.9774 10.6211 10.6300 13.7570 13.7989 14.8166 14.8272 15.3683 15.4176 16.3039 16.3468 16.6741 16.7143 17.1785 17.2001 k = 0.2368 0.1367-0.0000 ( 2044 PWs) bands (ev): -40.4496 -40.4496 -40.4284 -40.4283 -18.1106 -18.0376 -17.9845 -17.9622 -16.1734 -16.0371 -15.9608 -15.9250 -15.8926 -15.8591 -15.7952 -15.7870 -0.4304 -0.4173 0.1679 0.2719 8.6229 8.6249 9.1787 9.1870 9.7885 9.8094 9.8259 9.8620 9.9839 9.9894 10.6550 10.6641 13.7012 13.7443 14.7625 14.7710 15.4038 15.4537 16.2920 16.3298 16.6826 16.7244 17.2354 17.2603 k = 0.2456 0.1418-0.0000 ( 2036 PWs) bands (ev): -40.4476 -40.4476 -40.4267 -40.4267 -18.1147 -18.0410 -17.9910 -17.9692 -16.1786 -16.0391 -15.9719 -15.9376 -15.9006 -15.8649 -15.7977 -15.7902 -0.4053 -0.3930 0.1750 0.2799 8.6006 8.6022 9.1823 9.1921 9.8207 9.8211 9.8534 9.9119 10.0007 10.0038 10.6890 10.6984 13.6504 13.6946 14.7093 14.7157 15.4427 15.4932 16.2793 16.3123 16.6926 16.7359 17.2853 17.3136 k = 0.2544 0.1469-0.0000 ( 2040 PWs) bands (ev): -40.4457 -40.4457 -40.4252 -40.4252 -18.1188 -18.0445 -17.9975 -17.9763 -16.1837 -16.0416 -15.9830 -15.9504 -15.9080 -15.8706 -15.8002 -15.7934 -0.3804 -0.3690 0.1820 0.2876 8.5797 8.5809 9.1839 9.1952 9.8315 9.8372 9.8963 9.9612 10.0201 10.0209 10.7231 10.7326 13.6049 13.6501 14.6570 14.6614 15.4849 15.5359 16.2661 16.2945 16.7042 16.7488 17.3276 17.3594 k = 0.2632 0.1519-0.0000 ( 2040 PWs) bands (ev): -40.4438 -40.4438 -40.4238 -40.4238 -18.1229 -18.0482 -18.0040 -17.9834 -16.1889 -16.0447 -15.9940 -15.9632 -15.9149 -15.8760 -15.8026 -15.7965 -0.3557 -0.3453 0.1888 0.2947 8.5605 8.5613 9.1836 9.1962 9.8417 9.8488 9.9415 10.0072 10.0425 10.0426 10.7572 10.7668 13.5655 13.6116 14.6058 14.6084 15.5305 15.5818 16.2527 16.2767 16.7173 16.7632 17.3621 17.3975 k = 0.2719 0.1570-0.0000 ( 2040 PWs) bands (ev): -40.4418 -40.4418 -40.4223 -40.4223 -18.1268 -18.0519 -18.0104 -17.9907 -16.1939 -16.0484 -16.0050 -15.9761 -15.9210 -15.8811 -15.8050 -15.7995 -0.3313 -0.3219 0.1955 0.3014 8.5431 8.5434 9.1814 9.1954 9.8512 9.8588 9.9840 10.0416 10.0694 10.0764 10.7911 10.8008 13.5325 13.5795 14.5558 14.5566 15.5795 15.6310 16.2392 16.2590 16.7321 16.7791 17.3889 17.4281 k = 0.2807 0.1621-0.0000 ( 2042 PWs) bands (ev): -40.4400 -40.4400 -40.4208 -40.4208 -18.1307 -18.0558 -18.0169 -17.9980 -16.1989 -16.0527 -16.0158 -15.9888 -15.9263 -15.8859 -15.8074 -15.8024 -0.3073 -0.2990 0.2019 0.3077 8.5274 8.5277 9.1776 9.1928 9.8601 9.8680 10.0207 10.0644 10.1022 10.1217 10.8247 10.8344 13.5066 13.5542 14.5063 14.5071 15.6317 15.6832 16.2259 16.2418 16.7485 16.7965 17.4084 17.4513 k = 0.2895 0.1671-0.0000 ( 2042 PWs) bands (ev): -40.4380 -40.4380 -40.4194 -40.4194 -18.1345 -18.0598 -18.0232 -18.0053 -16.2038 -16.0576 -16.0264 -16.0015 -15.9310 -15.8904 -15.8098 -15.8053 -0.2838 -0.2766 0.2082 0.3134 8.5134 8.5142 9.1724 9.1886 9.8684 9.8763 10.0500 10.0835 10.1418 10.1698 10.8579 10.8677 13.4881 13.5362 14.4576 14.4600 15.6870 15.7384 16.2129 16.2251 16.7667 16.8156 17.4209 17.4675 k = 0.2982 0.1722-0.0000 ( 2042 PWs) bands (ev): -40.4361 -40.4361 -40.4180 -40.4180 -18.1382 -18.0639 -18.0295 -18.0126 -16.2085 -16.0630 -16.0368 -16.0140 -15.9349 -15.8947 -15.8121 -15.8081 -0.2607 -0.2548 0.2142 0.3186 8.5014 8.5029 9.1659 9.1830 9.8760 9.8838 10.0731 10.1007 10.1860 10.2180 10.8906 10.9004 13.4774 13.5259 14.4107 14.4144 15.7454 15.7964 16.2004 16.2093 16.7866 16.8362 17.4269 17.4771 k = 0.3070 0.1773-0.0000 ( 2042 PWs) bands (ev): -40.4343 -40.4343 -40.4166 -40.4166 -18.1417 -18.0681 -18.0357 -18.0199 -16.2130 -16.0691 -16.0470 -16.0263 -15.9381 -15.8986 -15.8145 -15.8108 -0.2383 -0.2336 0.2200 0.3233 8.4915 8.4936 9.1583 9.1761 9.8829 9.8906 10.0917 10.1161 10.2327 10.2657 10.9227 10.9324 13.4747 13.5235 14.3655 14.3706 15.8067 15.8568 16.1884 16.1945 16.8083 16.8585 17.4269 17.4807 k = 0.3158 0.1823-0.0000 ( 2046 PWs) bands (ev): -40.4325 -40.4325 -40.4153 -40.4153 -18.1452 -18.0724 -18.0418 -18.0272 -16.2174 -16.0756 -16.0569 -16.0383 -15.9406 -15.9023 -15.8168 -15.8135 -0.2165 -0.2130 0.2256 0.3275 8.4837 8.4864 9.1496 9.1681 9.8892 9.8967 10.1066 10.1293 10.2802 10.3127 10.9542 10.9637 13.4804 13.5293 14.3223 14.3286 15.8706 15.9189 16.1772 16.1815 16.8316 16.8823 17.4213 17.4785 k = 0.3246 0.1874-0.0000 ( 2042 PWs) bands (ev): -40.4305 -40.4305 -40.4140 -40.4140 -18.1484 -18.0767 -18.0477 -18.0343 -16.2215 -16.0825 -16.0665 -16.0500 -15.9426 -15.9057 -15.8191 -15.8161 -0.1954 -0.1932 0.2310 0.3312 8.4780 8.4814 9.1402 9.1591 9.8949 9.9022 10.1183 10.1400 10.3276 10.3587 10.9848 10.9942 13.4943 13.5432 14.2813 14.2887 15.9368 15.9815 16.1669 16.1713 16.8566 16.9077 17.4107 17.4709 k = 0.3333 0.1925-0.0000 ( 2046 PWs) bands (ev): -40.4289 -40.4288 -40.4128 -40.4128 -18.1515 -18.0811 -18.0534 -18.0413 -16.2254 -16.0898 -16.0757 -16.0613 -15.9441 -15.9088 -15.8213 -15.8187 -0.1750 -0.1741 0.2362 0.3344 8.4744 8.4785 9.1299 9.1493 9.9000 9.9070 10.1268 10.1479 10.3744 10.4035 11.0145 11.0238 13.5165 13.5653 14.2424 14.2510 16.0046 16.0404 16.1582 16.1681 16.8831 16.9345 17.3952 17.4583 k = 0.3421 0.1975-0.0000 ( 2042 PWs) bands (ev): -40.4270 -40.4270 -40.4116 -40.4116 -18.1544 -18.0856 -18.0590 -18.0481 -16.2290 -16.0975 -16.0846 -16.0720 -15.9451 -15.9117 -15.8235 -15.8211 -0.1558 -0.1555 0.2412 0.3371 8.4728 8.4776 9.1190 9.1387 9.9045 9.9112 10.1324 10.1530 10.4202 10.4471 11.0433 11.0523 13.5467 13.5952 14.2061 14.2157 16.0712 16.0823 16.1537 16.1850 16.9111 16.9627 17.3752 17.4409 k = 0.3509 0.2026-0.0000 ( 2040 PWs) bands (ev): -40.4254 -40.4254 -40.4103 -40.4103 -18.1571 -18.0900 -18.0644 -18.0547 -16.2323 -16.1055 -16.0931 -16.0822 -15.9457 -15.9142 -15.8257 -15.8235 -0.1383 -0.1368 0.2461 0.3392 8.4732 8.4787 9.1075 9.1273 9.9085 9.9149 10.1351 10.1552 10.4647 10.4893 11.0709 11.0796 13.5844 13.6326 14.1723 14.1830 16.0948 16.1164 16.1733 16.2340 16.9404 16.9921 17.3508 17.4186 k = 0.3596 0.2076-0.0000 ( 2042 PWs) bands (ev): -40.4238 -40.4238 -40.4092 -40.4092 -18.1595 -18.0946 -18.0696 -18.0611 -16.2353 -16.1138 -16.1012 -16.0917 -15.9460 -15.9166 -15.8278 -15.8259 -0.1216 -0.1191 0.2507 0.3409 8.4756 8.4818 9.0954 9.1153 9.9120 9.9181 10.1351 10.1546 10.5077 10.5299 11.0975 11.1058 13.6290 13.6768 14.1415 14.1533 16.0926 16.1204 16.2364 16.3003 16.9707 17.0225 17.3223 17.3917 k = 0.3684 0.2127-0.0000 ( 2046 PWs) bands (ev): -40.4223 -40.4223 -40.4083 -40.4083 -18.1618 -18.0992 -18.0745 -18.0672 -16.2380 -16.1224 -16.1088 -16.1005 -15.9461 -15.9188 -15.8299 -15.8281 -0.1058 -0.1023 0.2552 0.3421 8.4798 8.4867 9.0828 9.1028 9.9151 9.9208 10.1326 10.1515 10.5490 10.5688 11.1228 11.1308 13.6793 13.7269 14.1143 14.1272 16.0863 16.1159 16.3103 16.3728 17.0017 17.0537 17.2897 17.3602 k = 0.3772 0.2178-0.0000 ( 2048 PWs) bands (ev): -40.4208 -40.4208 -40.4073 -40.4073 -18.1638 -18.1038 -18.0792 -18.0730 -16.2403 -16.1311 -16.1160 -16.1086 -15.9459 -15.9207 -15.8318 -15.8303 -0.0908 -0.0865 0.2596 0.3428 8.4859 8.4934 9.0697 9.0896 9.9177 9.9230 10.1280 10.1461 10.5883 10.6059 11.1468 11.1544 13.7338 13.7810 14.0917 14.1057 16.0791 16.1104 16.3867 16.4479 17.0328 17.0855 17.2537 17.3240 k = 0.3860 0.2228-0.0000 ( 2060 PWs) bands (ev): -40.4197 -40.4197 -40.4065 -40.4065 -18.1655 -18.1084 -18.0837 -18.0784 -16.2423 -16.1400 -16.1228 -16.1161 -15.9456 -15.9225 -15.8338 -15.8324 -0.0768 -0.0717 0.2639 0.3431 8.4935 8.5017 9.0561 9.0759 9.9200 9.9248 10.1215 10.1387 10.6254 10.6410 11.1694 11.1765 13.7898 13.8360 14.0763 14.0907 16.0719 16.1050 16.4643 16.5244 17.0624 17.1175 17.2156 17.2833 k = 0.3947 0.2279-0.0000 ( 2056 PWs) bands (ev): -40.4183 -40.4183 -40.4056 -40.4056 -18.1670 -18.1131 -18.0879 -18.0835 -16.2439 -16.1488 -16.1291 -16.1229 -15.9451 -15.9240 -15.8356 -15.8343 -0.0637 -0.0579 0.2681 0.3430 8.5028 8.5115 9.0422 9.0617 9.9219 9.9264 10.1136 10.1297 10.6603 10.6739 11.1906 11.1973 13.8421 13.8849 14.0741 14.0867 16.0651 16.0999 16.5423 16.6014 17.0850 17.1493 17.1808 17.2384 k = 0.4035 0.2330-0.0000 ( 2056 PWs) bands (ev): -40.4170 -40.4170 -40.4048 -40.4048 -18.1682 -18.1178 -18.0918 -18.0881 -16.2451 -16.1574 -16.1349 -16.1291 -15.9445 -15.9254 -15.8373 -15.8362 -0.0515 -0.0453 0.2722 0.3424 8.5134 8.5226 9.0278 9.0471 9.9235 9.9276 10.1046 10.1196 10.6928 10.7046 11.2103 11.2165 13.8824 13.9165 14.0955 14.1008 16.0587 16.0952 16.6199 16.6781 17.0801 17.1698 17.1737 17.1961 k = 0.4123 0.2380-0.0000 ( 2060 PWs) bands (ev): -40.4159 -40.4159 -40.4041 -40.4041 -18.1691 -18.1224 -18.0953 -18.0923 -16.2459 -16.1658 -16.1402 -16.1349 -15.9437 -15.9267 -15.8389 -15.8379 -0.0402 -0.0338 0.2763 0.3415 8.5252 8.5349 9.0132 9.0321 9.9248 9.9285 10.0950 10.1087 10.7228 10.7330 11.2285 11.2342 13.9042 13.9263 14.1387 14.1438 16.0528 16.0906 16.6966 16.7537 17.0415 17.1319 17.1889 17.2155 k = 0.4211 0.2431-0.0000 ( 2064 PWs) bands (ev): -40.4150 -40.4150 -40.4035 -40.4035 -18.1696 -18.1270 -18.0986 -18.0961 -16.2462 -16.1740 -16.1450 -16.1401 -15.9430 -15.9278 -15.8405 -15.8395 -0.0299 -0.0234 0.2803 0.3402 8.5380 8.5480 8.9985 9.0168 9.9259 9.9291 10.0850 10.0974 10.7502 10.7588 11.2451 11.2503 13.9101 13.9234 14.1962 14.2086 16.0474 16.0862 16.7715 16.8276 16.9910 17.0756 17.2170 17.2449 k = 0.4298 0.2482-0.0000 ( 2064 PWs) bands (ev): -40.4140 -40.4140 -40.4029 -40.4029 -18.1699 -18.1315 -18.1016 -18.0995 -16.2461 -16.1817 -16.1492 -16.1448 -15.9421 -15.9288 -15.8418 -15.8410 -0.0206 -0.0142 0.2843 0.3385 8.5516 8.5618 8.9837 9.0013 9.9269 9.9296 10.0752 10.0862 10.7749 10.7822 11.2601 11.2648 13.9078 13.9158 14.2645 14.2804 16.0423 16.0816 16.8427 16.8989 16.9381 17.0165 17.2465 17.2732 k = 0.4386 0.2532-0.0000 ( 2056 PWs) bands (ev): -40.4129 -40.4129 -40.4024 -40.4024 -18.1699 -18.1359 -18.1041 -18.1025 -16.2456 -16.1891 -16.1529 -16.1490 -15.9413 -15.9298 -15.8431 -15.8423 -0.0122 -0.0061 0.2883 0.3365 8.5656 8.5758 8.9691 8.9858 9.9276 9.9300 10.0657 10.0754 10.7968 10.8028 11.2735 11.2776 13.9021 13.9070 14.3370 14.3540 16.0376 16.0766 16.8710 16.9240 16.9543 16.9684 17.2753 17.2995 k = 0.4474 0.2583-0.0000 ( 2062 PWs) bands (ev): -40.4122 -40.4122 -40.4021 -40.4021 -18.1695 -18.1401 -18.1064 -18.1051 -16.2446 -16.1961 -16.1562 -16.1527 -15.9404 -15.9307 -15.8442 -15.8435 -0.0049 0.0008 0.2923 0.3342 8.5797 8.5897 8.9550 8.9706 9.9282 9.9302 10.0570 10.0652 10.8159 10.8208 11.2851 11.2887 13.8955 13.8985 14.4093 14.4260 16.0333 16.0710 16.8220 16.8958 16.9847 17.0298 17.3022 17.3233 k = 0.4561 0.2634-0.0000 ( 2062 PWs) bands (ev): -40.4115 -40.4115 -40.4018 -40.4018 -18.1688 -18.1441 -18.1083 -18.1072 -16.2431 -16.2027 -16.1588 -16.1559 -15.9395 -15.9315 -15.8451 -15.8446 0.0015 0.0065 0.2963 0.3316 8.5936 8.6030 8.9418 8.9559 9.9287 9.9303 10.0493 10.0561 10.8321 10.8361 11.2951 11.2981 13.8891 13.8910 14.4782 14.4936 16.0295 16.0647 16.7725 16.8382 17.0446 17.0863 17.3266 17.3439 k = 0.4649 0.2684-0.0000 ( 2062 PWs) bands (ev): -40.4109 -40.4109 -40.4015 -40.4015 -18.1678 -18.1479 -18.1099 -18.1090 -16.2412 -16.2089 -16.1610 -16.1586 -15.9387 -15.9323 -15.8458 -15.8454 0.0068 0.0111 0.3002 0.3288 8.6066 8.6151 8.9300 8.9423 9.9291 9.9303 10.0427 10.0481 10.8455 10.8485 11.3033 11.3057 13.8836 13.8847 14.5407 14.5541 16.0263 16.0576 16.7288 16.7850 17.0985 17.1351 17.3477 17.3611 k = 0.4737 0.2735-0.0000 ( 2062 PWs) bands (ev): -40.4105 -40.4105 -40.4012 -40.4012 -18.1664 -18.1514 -18.1111 -18.1105 -16.2388 -16.2145 -16.1625 -16.1607 -15.9378 -15.9331 -15.8464 -15.8461 0.0112 0.0144 0.3041 0.3257 8.6182 8.6252 8.9203 8.9301 9.9294 9.9302 10.0376 10.0416 10.8559 10.8582 11.3098 11.3116 13.8791 13.8797 14.5939 14.6046 16.0242 16.0498 16.6937 16.7385 17.1444 17.1743 17.3649 17.3744 k = 0.4825 0.2785-0.0000 ( 2068 PWs) bands (ev): -40.4103 -40.4103 -40.4011 -40.4011 -18.1647 -18.1547 -18.1119 -18.1115 -16.2360 -16.2198 -16.1636 -16.1624 -15.9370 -15.9338 -15.8469 -15.8467 0.0144 0.0167 0.3079 0.3224 8.6277 8.6328 8.9132 8.9202 9.9296 9.9302 10.0340 10.0367 10.8635 10.8650 11.3146 11.3158 13.8758 13.8761 14.6350 14.6424 16.0236 16.0418 16.6696 16.7009 17.1808 17.2021 17.3778 17.3838 k = 0.4912 0.2836-0.0000 ( 2064 PWs) bands (ev): -40.4101 -40.4101 -40.4009 -40.4009 -18.1627 -18.1577 -18.1124 -18.1122 -16.2326 -16.2245 -16.1641 -16.1635 -15.9362 -15.9346 -15.8471 -15.8470 0.0166 0.0178 0.3117 0.3190 8.6344 8.6371 8.9094 8.9131 9.9298 9.9301 10.0321 10.0334 10.8682 10.8689 11.3175 11.3181 13.8738 13.8740 14.6616 14.6655 16.0251 16.0346 16.6579 16.6740 17.2059 17.2171 17.3861 17.3889 k = 0.5000 0.2887-0.0000 ( 2062 PWs) bands (ev): -40.4099 -40.4099 -40.4009 -40.4009 -18.1603 -18.1603 -18.1124 -18.1124 -16.2288 -16.2288 -16.1641 -16.1641 -15.9354 -15.9354 -15.8471 -15.8471 0.0178 0.0178 0.3154 0.3154 8.6376 8.6376 8.9094 8.9094 9.9299 9.9299 10.0319 10.0319 10.8700 10.8700 11.3187 11.3187 13.8732 13.8732 14.6720 14.6720 16.0288 16.0288 16.6594 16.6594 17.2183 17.2183 17.3898 17.3898 k = 0.5000 0.2887-0.0000 ( 2062 PWs) bands (ev): -40.4099 -40.4099 -40.4009 -40.4009 -18.1603 -18.1603 -18.1124 -18.1124 -16.2288 -16.2288 -16.1641 -16.1641 -15.9354 -15.9354 -15.8471 -15.8471 0.0178 0.0178 0.3154 0.3154 8.6376 8.6376 8.9094 8.9094 9.9299 9.9299 10.0319 10.0319 10.8700 10.8700 11.3187 11.3187 13.8732 13.8732 14.6720 14.6720 16.0288 16.0288 16.6594 16.6594 17.2183 17.2183 17.3898 17.3898 k = 0.4949 0.2974-0.0000 ( 2066 PWs) bands (ev): -40.4100 -40.4100 -40.4009 -40.4009 -18.1624 -18.1583 -18.1137 -18.1112 -16.2310 -16.2265 -16.1660 -16.1620 -15.9370 -15.9341 -15.8474 -15.8473 0.0172 0.0191 0.3145 0.3165 8.6367 8.6397 8.9112 8.9113 9.9289 9.9294 10.0322 10.0336 10.8691 10.8697 11.3164 11.3197 13.8711 13.8754 14.6690 14.6731 16.0208 16.0245 16.6537 16.6574 17.2175 17.2229 17.3882 17.3907 k = 0.4899 0.3062-0.0000 ( 2066 PWs) bands (ev): -40.4100 -40.4100 -40.4008 -40.4008 -18.1645 -18.1562 -18.1151 -18.1100 -16.2330 -16.2240 -16.1680 -16.1600 -15.9391 -15.9333 -15.8482 -15.8481 0.0173 0.0211 0.3137 0.3176 8.6369 8.6430 8.9167 8.9169 9.9264 9.9274 10.0346 10.0373 10.8668 10.8680 11.3127 11.3193 13.8692 13.8778 14.6641 14.6723 16.0009 16.0080 16.6407 16.6478 17.2206 17.2312 17.3859 17.3910 k = 0.4848 0.3149-0.0000 ( 2070 PWs) bands (ev): -40.4099 -40.4099 -40.4009 -40.4009 -18.1666 -18.1543 -18.1164 -18.1088 -16.2349 -16.2213 -16.1699 -16.1579 -15.9416 -15.9329 -15.8494 -15.8492 0.0181 0.0239 0.3131 0.3189 8.6383 8.6474 8.9260 8.9263 9.9229 9.9242 10.0388 10.0425 10.8632 10.8650 11.3077 11.3176 13.8673 13.8803 14.6572 14.6694 15.9694 15.9801 16.6206 16.6309 17.2275 17.2427 17.3830 17.3907 k = 0.4798 0.3237-0.0000 ( 2060 PWs) bands (ev): -40.4096 -40.4096 -40.4007 -40.4007 -18.1687 -18.1523 -18.1176 -18.1076 -16.2366 -16.2184 -16.1718 -16.1556 -15.9444 -15.9329 -15.8512 -15.8508 0.0196 0.0273 0.3126 0.3204 8.6408 8.6528 8.9389 8.9393 9.9188 9.9202 10.0446 10.0490 10.8584 10.8607 11.3014 11.3146 13.8654 13.8828 14.6485 14.6646 15.9275 15.9416 16.5941 16.6072 17.2378 17.2572 17.3795 17.3897 k = 0.4747 0.3324-0.0000 ( 2056 PWs) bands (ev): -40.4093 -40.4093 -40.4005 -40.4005 -18.1708 -18.1505 -18.1189 -18.1065 -16.2381 -16.2154 -16.1736 -16.1534 -15.9476 -15.9333 -15.8534 -15.8529 0.0217 0.0315 0.3123 0.3218 8.6443 8.6590 8.9554 8.9560 9.9146 9.9160 10.0515 10.0565 10.8523 10.8550 11.2938 11.3103 13.8636 13.8854 14.6378 14.6577 15.8761 15.8936 16.5617 16.5772 17.2515 17.2741 17.3758 17.3882 k = 0.4697 0.3412-0.0000 ( 2060 PWs) bands (ev): -40.4092 -40.4092 -40.4004 -40.4004 -18.1728 -18.1487 -18.1201 -18.1055 -16.2396 -16.2122 -16.1755 -16.1511 -15.9511 -15.9342 -15.8561 -15.8555 0.0245 0.0363 0.3121 0.3234 8.6486 8.6658 8.9756 8.9763 9.9106 9.9121 10.0594 10.0647 10.8449 10.8482 11.2849 11.3047 13.8616 13.8879 14.6253 14.6489 15.8166 15.8373 16.5238 16.5413 17.2682 17.2929 17.3721 17.3860 k = 0.4646 0.3499-0.0000 ( 2048 PWs) bands (ev): -40.4088 -40.4088 -40.4001 -40.4001 -18.1749 -18.1471 -18.1213 -18.1045 -16.2408 -16.2089 -16.1774 -16.1487 -15.9549 -15.9354 -15.8592 -15.8584 0.0279 0.0418 0.3120 0.3250 8.6535 8.6731 8.9992 9.0000 9.9073 9.9088 10.0681 10.0736 10.8364 10.8400 11.2748 11.2978 13.8595 13.8903 14.6110 14.6380 15.7504 15.7742 16.4809 16.5000 17.2880 17.3125 17.3700 17.3834 k = 0.4596 0.3587-0.0000 ( 2044 PWs) bands (ev): -40.4085 -40.4085 -40.3998 -40.3998 -18.1769 -18.1456 -18.1223 -18.1036 -16.2420 -16.2053 -16.1793 -16.1462 -15.9590 -15.9370 -15.8629 -15.8617 0.0319 0.0479 0.3120 0.3266 8.6589 8.6807 9.0262 9.0272 9.9049 9.9067 10.0774 10.0830 10.8267 10.8307 11.2633 11.2896 13.8571 13.8925 14.5950 14.6252 15.6788 15.7055 16.4333 16.4537 17.3107 17.3288 17.3733 17.3804 k = 0.4545 0.3674-0.0000 ( 2044 PWs) bands (ev): -40.4082 -40.4082 -40.3997 -40.3997 -18.1789 -18.1444 -18.1231 -18.1028 -16.2431 -16.2016 -16.1812 -16.1437 -15.9634 -15.9389 -15.8669 -15.8654 0.0364 0.0546 0.3121 0.3282 8.6646 8.6882 9.0566 9.0577 9.9039 9.9060 10.0872 10.0928 10.8159 10.8201 11.2507 11.2802 13.8544 13.8943 14.5773 14.6106 15.6030 15.6326 16.3812 16.4026 17.3348 17.3356 17.3780 17.3894 k = 0.4495 0.3762-0.0000 ( 2046 PWs) bands (ev): -40.4079 -40.4079 -40.3995 -40.3995 -18.1809 -18.1434 -18.1238 -18.1021 -16.2440 -16.1977 -16.1831 -16.1411 -15.9679 -15.9411 -15.8713 -15.8694 0.0414 0.0619 0.3123 0.3298 8.6703 8.6954 9.0901 9.0915 9.9045 9.9074 10.0975 10.1029 10.8040 10.8084 11.2368 11.2695 13.8511 13.8957 14.5582 14.5944 15.5243 15.5566 16.3248 16.3471 17.3326 17.3567 17.3822 17.4165 k = 0.4444 0.3849-0.0000 ( 2042 PWs) bands (ev): -40.4076 -40.4076 -40.3990 -40.3990 -18.1829 -18.1428 -18.1242 -18.1014 -16.2448 -16.1937 -16.1851 -16.1384 -15.9725 -15.9436 -15.8761 -15.8738 0.0469 0.0697 0.3126 0.3313 8.6758 8.7020 9.1267 9.1283 9.9071 9.9109 10.1082 10.1135 10.7911 10.7956 11.2217 11.2576 13.8472 13.8965 14.5379 14.5767 15.4439 15.4788 16.2645 16.2873 17.3272 17.3596 17.4078 17.4498 k = 0.4394 0.3936-0.0000 ( 2038 PWs) bands (ev): -40.4072 -40.4072 -40.3987 -40.3987 -18.1848 -18.1425 -18.1242 -18.1009 -16.2456 -16.1895 -16.1871 -16.1357 -15.9773 -15.9464 -15.8812 -15.8784 0.0527 0.0780 0.3129 0.3327 8.6809 8.7079 9.1663 9.1680 9.9119 9.9172 10.1193 10.1244 10.7771 10.7817 11.2054 11.2444 13.8426 13.8965 14.5166 14.5577 15.3627 15.4001 16.2004 16.2237 17.3206 17.3553 17.4439 17.4876 k = 0.4343 0.4024-0.0000 ( 2038 PWs) bands (ev): -40.4067 -40.4067 -40.3985 -40.3985 -18.1867 -18.1425 -18.1240 -18.1004 -16.2462 -16.1894 -16.1851 -16.1329 -15.9822 -15.9494 -15.8867 -15.8832 0.0589 0.0867 0.3133 0.3340 8.6853 8.7127 9.2085 9.2105 9.9192 9.9263 10.1307 10.1356 10.7622 10.7668 11.1879 11.2300 13.8373 13.8957 14.4946 14.5379 15.2818 15.3215 16.1327 16.1564 17.3133 17.3492 17.4850 17.5295 k = 0.4293 0.4111-0.0000 ( 2034 PWs) bands (ev): -40.4062 -40.4062 -40.3983 -40.3983 -18.1885 -18.1430 -18.1234 -18.1000 -16.2468 -16.1915 -16.1806 -16.1300 -15.9871 -15.9526 -15.8924 -15.8883 0.0653 0.0958 0.3136 0.3351 8.6889 8.7164 9.2534 9.2555 9.9291 9.9385 10.1424 10.1472 10.7464 10.7509 11.1692 11.2142 13.8310 13.8939 14.4723 14.5174 15.2021 15.2440 16.0619 16.0858 17.3056 17.3424 17.5302 17.5752 k = 0.4242 0.4199-0.0000 ( 2038 PWs) bands (ev): -40.4058 -40.4058 -40.3981 -40.3981 -18.1903 -18.1436 -18.1227 -18.0997 -16.2473 -16.1938 -16.1759 -16.1271 -15.9921 -15.9559 -15.8984 -15.8936 0.0720 0.1053 0.3140 0.3360 8.6915 8.7187 9.3006 9.3030 9.9417 9.9539 10.1544 10.1592 10.7298 10.7340 11.1491 11.1970 13.8238 13.8910 14.4499 14.4968 15.1245 15.1682 15.9881 16.0121 17.2978 17.3351 17.5794 17.6244 k = 0.4192 0.4286-0.0000 ( 2034 PWs) bands (ev): -40.4052 -40.4052 -40.3978 -40.3978 -18.1920 -18.1445 -18.1218 -18.0995 -16.2477 -16.1962 -16.1712 -16.1241 -15.9969 -15.9594 -15.9045 -15.8990 0.0789 0.1150 0.3143 0.3367 8.6931 8.7195 9.3499 9.3525 9.9571 9.9727 10.1667 10.1716 10.7124 10.7163 11.1278 11.1784 13.8158 13.8868 14.4280 14.4763 15.0498 15.0949 15.9118 15.9359 17.2899 17.3273 17.6321 17.6771 k = 0.4141 0.4374-0.0000 ( 2034 PWs) bands (ev): -40.4047 -40.4047 -40.3976 -40.3976 -18.1937 -18.1455 -18.1208 -18.0994 -16.2480 -16.1987 -16.1663 -16.1212 -16.0018 -15.9628 -15.9108 -15.9045 0.0859 0.1250 0.3146 0.3372 8.6936 8.7190 9.4012 9.4040 9.9752 9.9946 10.1793 10.1845 10.6942 10.6977 11.1051 11.1583 13.8069 13.8814 14.4069 14.4563 14.9787 15.0248 15.8332 15.8573 17.2821 17.3193 17.6882 17.7329 k = 0.4091 0.4461-0.0000 ( 2038 PWs) bands (ev): -40.4042 -40.4042 -40.3975 -40.3975 -18.1953 -18.1467 -18.1197 -18.0994 -16.2483 -16.2013 -16.1612 -16.1182 -16.0065 -15.9664 -15.9171 -15.9101 0.0930 0.1352 0.3148 0.3374 8.6930 8.7171 9.4540 9.4572 9.9958 10.0196 10.1922 10.1979 10.6753 10.6784 11.0810 11.1365 13.7972 13.8746 14.3869 14.4373 14.9118 14.9583 15.7527 15.7768 17.2744 17.3111 17.7471 17.7914 k = 0.4040 0.4549-0.0000 ( 2046 PWs) bands (ev): -40.4038 -40.4038 -40.3975 -40.3975 -18.1969 -18.1478 -18.1187 -18.0996 -16.2485 -16.2040 -16.1561 -16.1152 -16.0112 -15.9698 -15.9235 -15.9158 0.1000 0.1455 0.3150 0.3373 8.6913 8.7139 9.5083 9.5118 10.0186 10.0472 10.2055 10.2120 10.6557 10.6582 11.0553 11.1131 13.7871 13.8666 14.3685 14.4197 14.8498 14.8958 15.6707 15.6948 17.2670 17.3029 17.8087 17.8522 k = 0.3990 0.4636-0.0000 ( 2046 PWs) bands (ev): -40.4032 -40.4032 -40.3973 -40.3973 -18.1984 -18.1490 -18.1176 -18.0998 -16.2486 -16.2067 -16.1509 -16.1123 -16.0157 -15.9732 -15.9299 -15.9214 0.1070 0.1560 0.3150 0.3368 8.6887 8.7097 9.5635 9.5674 10.0431 10.0772 10.2194 10.2270 10.6355 10.6373 11.0281 11.0879 13.7768 13.8575 14.3521 14.4038 14.7932 14.8378 15.5875 15.6116 17.2599 17.2946 17.8723 17.9150 k = 0.3939 0.4724-0.0000 ( 2044 PWs) bands (ev): -40.4026 -40.4026 -40.3971 -40.3971 -18.1998 -18.1502 -18.1166 -18.1000 -16.2487 -16.2096 -16.1456 -16.1094 -16.0201 -15.9765 -15.9361 -15.9270 0.1138 0.1664 0.3150 0.3360 8.6853 8.7044 9.6195 9.6239 10.0687 10.1087 10.2342 10.2432 10.6146 10.6158 10.9993 11.0607 13.7667 13.8475 14.3381 14.3901 14.7422 14.7845 15.5036 15.5277 17.2532 17.2866 17.9376 17.9792 k = 0.3889 0.4811-0.0000 ( 2044 PWs) bands (ev): -40.4021 -40.4021 -40.3969 -40.3969 -18.2011 -18.1514 -18.1156 -18.1004 -16.2487 -16.2125 -16.1403 -16.1066 -16.0245 -15.9796 -15.9422 -15.9325 0.1204 0.1768 0.3149 0.3348 8.6813 8.6985 9.6759 9.6808 10.0947 10.1408 10.2505 10.2610 10.5932 10.5935 10.9689 11.0315 13.7572 13.8370 14.3268 14.3789 14.6972 14.7359 15.4192 15.4433 17.2471 17.2787 18.0038 18.0441 k = 0.3838 0.4899-0.0000 ( 2044 PWs) bands (ev): -40.4016 -40.4016 -40.3968 -40.3968 -18.2023 -18.1525 -18.1147 -18.1009 -16.2486 -16.2154 -16.1349 -16.1039 -16.0287 -15.9824 -15.9480 -15.9379 0.1268 0.1872 0.3146 0.3333 8.6767 8.6921 9.7323 9.7378 10.1202 10.1719 10.2693 10.2809 10.5707 10.5713 10.9367 11.0003 13.7488 13.8264 14.3186 14.3705 14.6582 14.6922 15.3348 15.3589 17.2415 17.2712 18.0703 18.1091 k = 0.3788 0.4986-0.0000 ( 2044 PWs) bands (ev): -40.4011 -40.4011 -40.3966 -40.3966 -18.2035 -18.1536 -18.1138 -18.1014 -16.2484 -16.2184 -16.1295 -16.1013 -16.0330 -15.9850 -15.9534 -15.9431 0.1329 0.1974 0.3143 0.3314 8.6719 8.6854 9.7885 9.7947 10.1442 10.2003 10.2919 10.3031 10.5472 10.5488 10.9029 10.9670 13.7419 13.8159 14.3138 14.3652 14.6254 14.6534 15.2506 15.2748 17.2365 17.2641 18.1364 18.1735 k = 0.3737 0.5074-0.0000 ( 2048 PWs) bands (ev): -40.4006 -40.4006 -40.3967 -40.3967 -18.2045 -18.1546 -18.1129 -18.1020 -16.2482 -16.2213 -16.1241 -16.0990 -16.0372 -15.9873 -15.9584 -15.9481 0.1385 0.2075 0.3138 0.3290 8.6670 8.6786 9.8439 9.8510 10.1660 10.2243 10.3194 10.3279 10.5232 10.5259 10.8676 10.9316 13.7369 13.8062 14.3127 14.3632 14.5988 14.6196 15.1671 15.1914 17.2323 17.2574 18.2013 18.2362 k = 0.3687 0.5161-0.0000 ( 2044 PWs) bands (ev): -40.4000 -40.4000 -40.3966 -40.3966 -18.2055 -18.1556 -18.1121 -18.1026 -16.2478 -16.2242 -16.1187 -16.0969 -16.0414 -15.9892 -15.9629 -15.9529 0.1437 0.2172 0.3132 0.3263 8.6622 8.6720 9.8982 9.9063 10.1853 10.2437 10.3511 10.3550 10.4990 10.5028 10.8309 10.8943 13.7343 13.7975 14.3156 14.3648 14.5786 14.5908 15.0847 15.1092 17.2288 17.2513 18.2640 18.2964 k = 0.3636 0.5249-0.0000 ( 2044 PWs) bands (ev): -40.3995 -40.3995 -40.3966 -40.3966 -18.2063 -18.1564 -18.1113 -18.1033 -16.2473 -16.2271 -16.1134 -16.0950 -16.0456 -15.9907 -15.9667 -15.9574 0.1484 0.2267 0.3126 0.3233 8.6577 8.6657 9.9510 9.9602 10.2018 10.2594 10.3827 10.3846 10.4756 10.4805 10.7932 10.8552 13.7340 13.7901 14.3227 14.3701 14.5647 14.5672 15.0037 15.0285 17.2260 17.2458 18.3235 18.3530 k = 0.3586 0.5336-0.0000 ( 2042 PWs) bands (ev): -40.3990 -40.3990 -40.3966 -40.3966 -18.2070 -18.1572 -18.1106 -18.1040 -16.2466 -16.2298 -16.1082 -16.0934 -16.0498 -15.9918 -15.9699 -15.9616 0.1526 0.2356 0.3118 0.3199 8.6535 8.6600 10.0018 10.0123 10.2157 10.2727 10.4054 10.4115 10.4596 10.4638 10.7550 10.8147 13.7361 13.7839 14.3341 14.3789 14.5489 14.5575 14.9246 14.9500 17.2241 17.2409 18.3785 18.4045 k = 0.3535 0.5424-0.0000 ( 2038 PWs) bands (ev): -40.3985 -40.3985 -40.3966 -40.3966 -18.2076 -18.1578 -18.1100 -18.1047 -16.2459 -16.2324 -16.1032 -16.0922 -16.0540 -15.9924 -15.9724 -15.9655 0.1561 0.2440 0.3111 0.3164 8.6500 8.6549 10.0500 10.0619 10.2271 10.2841 10.4049 10.4063 10.4701 10.4756 10.7170 10.7731 13.7402 13.7790 14.3498 14.3912 14.5363 14.5571 14.8480 14.8744 17.2229 17.2366 18.4276 18.4496 k = 0.3485 0.5511-0.0000 ( 2038 PWs) bands (ev): -40.3981 -40.3981 -40.3967 -40.3967 -18.2081 -18.1583 -18.1093 -18.1055 -16.2449 -16.2348 -16.0986 -16.0913 -16.0580 -15.9927 -15.9742 -15.9689 0.1589 0.2515 0.3102 0.3129 8.6472 8.6507 10.0949 10.1078 10.2361 10.2941 10.3833 10.3839 10.4959 10.5089 10.6803 10.7311 13.7459 13.7750 14.3698 14.4061 14.5294 14.5639 14.7750 14.8028 17.2225 17.2329 18.4693 18.4866 k = 0.3434 0.5599-0.0000 ( 2049 PWs) bands (ev): -40.3979 -40.3979 -40.3970 -40.3970 -18.2085 -18.1587 -18.1087 -18.1062 -16.2438 -16.2371 -16.0946 -16.0907 -16.0616 -15.9926 -15.9752 -15.9718 0.1609 0.2577 0.3094 0.3099 8.6452 8.6474 10.1352 10.1479 10.2419 10.3026 10.3582 10.3591 10.5253 10.5439 10.6464 10.6892 13.7524 13.7715 14.3934 14.4220 14.5279 14.5780 14.7075 14.7375 17.2228 17.2298 18.5019 18.5139 k = 0.3384 0.5686-0.0000 ( 2041 PWs) bands (ev): -40.3975 -40.3975 -40.3971 -40.3971 -18.2086 -18.1590 -18.1081 -18.1069 -16.2424 -16.2391 -16.0917 -16.0905 -16.0642 -15.9924 -15.9756 -15.9739 0.1622 0.2619 0.3079 0.3085 8.6441 8.6452 10.1682 10.1772 10.2433 10.3097 10.3340 10.3402 10.5524 10.5781 10.6185 10.6485 13.7587 13.7680 14.4186 14.4351 14.5297 14.5991 14.6510 14.6835 17.2238 17.2273 18.5239 18.5300 k = 0.3333 0.5774-0.0000 ( 2043 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2087 -18.1590 -18.1075 -18.1075 -16.2409 -16.2409 -16.0905 -16.0905 -16.0652 -15.9922 -15.9752 -15.9752 0.1626 0.2635 0.3076 0.3076 8.6441 8.6441 10.1860 10.1860 10.2414 10.3176 10.3176 10.3337 10.5662 10.6081 10.6081 10.6122 13.7640 13.7640 14.4369 14.4369 14.5296 14.6199 14.6199 14.6570 17.2253 17.2253 18.5335 18.5335 k = 0.3333 0.5774-0.0000 ( 2043 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2087 -18.1590 -18.1075 -18.1075 -16.2409 -16.2409 -16.0905 -16.0905 -16.0652 -15.9922 -15.9752 -15.9752 0.1626 0.2635 0.3076 0.3076 8.6441 8.6441 10.1860 10.1860 10.2414 10.3176 10.3176 10.3337 10.5662 10.6081 10.6081 10.6122 13.7640 13.7640 14.4369 14.4369 14.5296 14.6199 14.6199 14.6570 17.2253 17.2253 18.5335 18.5335 k = 0.3283 0.5686-0.0000 ( 2039 PWs) bands (ev): -40.3975 -40.3975 -40.3970 -40.3970 -18.2086 -18.1590 -18.1081 -18.1069 -16.2424 -16.2391 -16.0914 -16.0908 -16.0642 -15.9924 -15.9753 -15.9742 0.1622 0.2620 0.3068 0.3096 8.6442 8.6451 10.1694 10.1736 10.2466 10.3125 10.3303 10.3393 10.5582 10.5753 10.6246 10.6403 13.7590 13.7674 14.4176 14.4249 14.5401 14.6260 14.6267 14.6820 17.2237 17.2274 18.5236 18.5298 k = 0.3232 0.5599-0.0000 ( 2043 PWs) bands (ev): -40.3978 -40.3978 -40.3969 -40.3969 -18.2084 -18.1587 -18.1085 -18.1063 -16.2437 -16.2371 -16.0939 -16.0912 -16.0616 -15.9931 -15.9742 -15.9725 0.1608 0.2577 0.3060 0.3132 8.6456 8.6473 10.1354 10.1378 10.2548 10.3146 10.3381 10.3568 10.5468 10.5503 10.6474 10.6672 13.7527 13.7682 14.3796 14.3831 14.5736 14.6468 14.6566 14.7288 17.2224 17.2298 18.4999 18.5119 k = 0.3182 0.5511-0.0000 ( 2039 PWs) bands (ev): -40.3983 -40.3983 -40.3966 -40.3966 -18.2081 -18.1582 -18.1089 -18.1056 -16.2446 -16.2348 -16.0972 -16.0918 -16.0581 -15.9940 -15.9721 -15.9703 0.1586 0.2515 0.3051 0.3178 8.6483 8.6507 10.0914 10.0918 10.2585 10.3186 10.3436 10.3720 10.5286 10.5499 10.6691 10.6911 13.7450 13.7662 14.3326 14.3329 14.6186 14.6815 14.7023 14.7860 17.2213 17.2325 18.4627 18.4801 k = 0.3131 0.5424-0.0000 ( 2039 PWs) bands (ev): -40.3986 -40.3986 -40.3967 -40.3967 -18.2075 -18.1576 -18.1091 -18.1049 -16.2453 -16.2322 -16.1009 -16.0924 -16.0541 -15.9952 -15.9692 -15.9676 0.1555 0.2439 0.3043 0.3229 8.6523 8.6552 10.0391 10.0422 10.2566 10.3217 10.3480 10.3759 10.5252 10.5576 10.6883 10.7115 13.7357 13.7612 14.2814 14.2841 14.6698 14.7253 14.7597 14.8519 17.2203 17.2354 18.4128 18.4350 k = 0.3081 0.5336-0.0000 ( 2041 PWs) bands (ev): -40.3992 -40.3992 -40.3966 -40.3966 -18.2069 -18.1568 -18.1092 -18.1042 -16.2456 -16.2294 -16.1047 -16.0930 -16.0499 -15.9963 -15.9658 -15.9644 0.1514 0.2351 0.3035 0.3281 8.6576 8.6609 9.9832 9.9885 10.2499 10.3236 10.3492 10.3695 10.5360 10.5716 10.7045 10.7284 13.7251 13.7536 14.2323 14.2363 14.7253 14.7753 14.8271 14.9255 17.2193 17.2382 18.3513 18.3778 k = 0.3030 0.5249-0.0000 ( 2041 PWs) bands (ev): -40.3998 -40.3998 -40.3966 -40.3966 -18.2060 -18.1557 -18.1091 -18.1034 -16.2457 -16.2262 -16.1083 -16.0935 -16.0455 -15.9974 -15.9619 -15.9608 0.1465 0.2255 0.3026 0.3331 8.6643 8.6678 9.9248 9.9319 10.2390 10.3249 10.3395 10.3656 10.5555 10.5896 10.7174 10.7416 13.7131 13.7436 14.1861 14.1909 14.7844 14.8301 14.9032 15.0064 17.2182 17.2410 18.2797 18.3100 k = 0.2980 0.5161-0.0000 ( 2043 PWs) bands (ev): -40.4005 -40.4005 -40.3967 -40.3967 -18.2051 -18.1544 -18.1088 -18.1025 -16.2455 -16.2227 -16.1117 -16.0940 -16.0412 -15.9984 -15.9576 -15.9569 0.1407 0.2150 0.3017 0.3379 8.6722 8.6760 9.8647 9.8731 10.2251 10.3199 10.3263 10.3677 10.5784 10.6096 10.7268 10.7509 13.7002 13.7317 14.1435 14.1487 14.8466 14.8885 14.9868 15.0934 17.2169 17.2436 18.1993 18.2330 k = 0.2929 0.5074-0.0000 ( 2041 PWs) bands (ev): -40.4011 -40.4011 -40.3968 -40.3968 -18.2040 -18.1529 -18.1083 -18.1015 -16.2450 -16.2189 -16.1147 -16.0943 -16.0368 -15.9992 -15.9531 -15.9526 0.1341 0.2038 0.3006 0.3425 8.6814 8.6852 9.8036 9.8128 10.2090 10.2974 10.3277 10.3711 10.6022 10.6304 10.7328 10.7565 13.6865 13.7184 14.1047 14.1100 14.9113 14.9499 15.0768 15.1859 17.2154 17.2458 18.1118 18.1485 k = 0.2879 0.4986-0.0000 ( 2041 PWs) bands (ev): -40.4019 -40.4019 -40.3970 -40.3970 -18.2027 -18.1512 -18.1075 -18.1004 -16.2442 -16.2148 -16.1173 -16.0944 -16.0324 -15.9999 -15.9484 -15.9480 0.1266 0.1919 0.2995 0.3466 8.6919 8.6956 9.7420 9.7518 10.1914 10.2741 10.3292 10.3745 10.6255 10.6508 10.7355 10.7584 13.6723 13.7040 14.0697 14.0750 14.9779 15.0134 15.1718 15.2827 17.2135 17.2477 18.0183 18.0578 k = 0.2828 0.4899-0.0000 ( 2049 PWs) bands (ev): -40.4029 -40.4029 -40.3973 -40.3973 -18.2013 -18.1492 -18.1065 -18.0992 -16.2432 -16.2103 -16.1194 -16.0943 -16.0280 -16.0004 -15.9434 -15.9432 0.1183 0.1794 0.2983 0.3504 8.7036 8.7071 9.6805 9.6904 10.1727 10.2506 10.3307 10.3779 10.6477 10.6698 10.7353 10.7567 13.6579 13.6891 14.0387 14.0439 15.0460 15.0786 15.2709 15.3831 17.2114 17.2491 17.9202 17.9622 k = 0.2778 0.4811-0.0000 ( 2041 PWs) bands (ev): -40.4037 -40.4037 -40.3975 -40.3975 -18.1997 -18.1470 -18.1052 -18.0979 -16.2420 -16.2055 -16.1210 -16.0940 -16.0235 -16.0008 -15.9384 -15.9382 0.1091 0.1661 0.2969 0.3539 8.7164 8.7196 9.6193 9.6291 10.1533 10.2271 10.3321 10.3810 10.6682 10.6859 10.7338 10.7519 13.6436 13.6740 14.0117 14.0168 15.1150 15.1449 15.3729 15.4859 17.2090 17.2502 17.8187 17.8630 k = 0.2727 0.4724-0.0000 ( 2041 PWs) bands (ev): -40.4047 -40.4047 -40.3978 -40.3978 -18.1980 -18.1446 -18.1036 -18.0964 -16.2406 -16.2003 -16.1220 -16.0934 -16.0190 -16.0010 -15.9332 -15.9331 0.0992 0.1523 0.2953 0.3569 8.7303 8.7331 9.5588 9.5684 10.1332 10.2036 10.3334 10.3838 10.6861 10.6947 10.7349 10.7447 13.6297 13.6591 13.9885 13.9935 15.1843 15.2115 15.4766 15.5900 17.2066 17.2509 17.7146 17.7612 k = 0.2677 0.4636-0.0000 ( 2047 PWs) bands (ev): -40.4058 -40.4058 -40.3984 -40.3984 -18.1962 -18.1420 -18.1017 -18.0948 -16.2391 -16.1948 -16.1223 -16.0925 -16.0145 -16.0010 -15.9279 -15.9278 0.0886 0.1378 0.2936 0.3595 8.7452 8.7475 9.4994 9.5085 10.1126 10.1801 10.3344 10.3863 10.6917 10.6984 10.7383 10.7432 13.6163 13.6446 13.9691 13.9741 15.2533 15.2779 15.5811 15.6943 17.2042 17.2515 17.6090 17.6578 k = 0.2626 0.4549-0.0000 ( 2047 PWs) bands (ev): -40.4069 -40.4069 -40.3989 -40.3989 -18.1943 -18.1391 -18.0995 -18.0930 -16.2375 -16.1890 -16.1219 -16.0913 -16.0100 -16.0010 -15.9226 -15.9224 0.0772 0.1227 0.2917 0.3617 8.7611 8.7627 9.4413 9.4498 10.0916 10.1566 10.3352 10.3884 10.6801 10.6979 10.7401 10.7557 13.6037 13.6309 13.9534 13.9584 15.3214 15.3436 15.6850 15.7975 17.2023 17.2522 17.5028 17.5539 k = 0.2576 0.4461-0.0000 ( 2047 PWs) bands (ev): -40.4081 -40.4081 -40.3994 -40.3994 -18.1922 -18.1359 -18.0969 -18.0911 -16.2359 -16.1828 -16.1208 -16.0898 -16.0054 -16.0008 -15.9172 -15.9170 0.0650 0.1069 0.2895 0.3634 8.7779 8.7788 9.3847 9.3925 10.0700 10.1329 10.3357 10.3899 10.6634 10.6848 10.7502 10.7690 13.5921 13.6182 13.9412 13.9463 15.3880 15.4078 15.7872 15.8982 17.2010 17.2534 17.3967 17.4507 k = 0.2525 0.4374-0.0000 ( 2047 PWs) bands (ev): -40.4093 -40.4093 -40.4001 -40.4001 -18.1900 -18.1326 -18.0940 -18.0890 -16.2341 -16.1762 -16.1190 -16.0880 -16.0007 -16.0004 -15.9118 -15.9115 0.0521 0.0906 0.2872 0.3648 8.7955 8.7956 9.3298 9.3369 10.0480 10.1089 10.3357 10.3909 10.6433 10.6657 10.7621 10.7816 13.5818 13.6067 13.9323 13.9377 15.4526 15.4701 15.8864 15.9950 17.1997 17.2552 17.2919 17.3502 k = 0.2475 0.4286-0.0000 ( 2049 PWs) bands (ev): -40.4106 -40.4106 -40.4008 -40.4008 -18.1877 -18.1290 -18.0908 -18.0867 -16.2324 -16.1693 -16.1163 -16.0859 -15.9999 -15.9959 -15.9063 -15.9060 0.0385 0.0736 0.2846 0.3657 8.8130 8.8139 9.2769 9.2832 10.0255 10.0847 10.3352 10.3911 10.6205 10.6434 10.7734 10.7930 13.5728 13.5966 13.9266 13.9324 15.5145 15.5299 15.9812 16.0861 17.1874 17.1899 17.2598 17.2625 k = 0.2424 0.4199-0.0000 ( 2049 PWs) bands (ev): -40.4119 -40.4119 -40.4016 -40.4016 -18.1852 -18.1253 -18.0872 -18.0842 -16.2306 -16.1621 -16.1129 -16.0835 -15.9992 -15.9911 -15.9009 -15.9005 0.0242 0.0560 0.2818 0.3662 8.8309 8.8329 9.2261 9.2315 10.0024 10.0602 10.3340 10.3903 10.5954 10.6190 10.7835 10.8031 13.5653 13.5881 13.9239 13.9303 15.5733 15.5866 16.0703 16.1700 17.0865 17.1281 17.2330 17.2658 k = 0.2374 0.4111-0.0000 ( 2049 PWs) bands (ev): -40.4134 -40.4134 -40.4024 -40.4024 -18.1827 -18.1213 -18.0833 -18.0815 -16.2287 -16.1546 -16.1087 -16.0809 -15.9984 -15.9862 -15.8954 -15.8950 0.0091 0.0378 0.2787 0.3662 8.8494 8.8525 9.1776 9.1821 9.9788 10.0352 10.3320 10.3882 10.5685 10.5930 10.7921 10.8118 13.5595 13.5813 13.9239 13.9312 15.6283 15.6397 16.1521 16.2450 16.9885 17.0376 17.2399 17.2749 k = 0.2323 0.4024-0.0000 ( 2049 PWs) bands (ev): -40.4148 -40.4148 -40.4033 -40.4033 -18.1800 -18.1172 -18.0790 -18.0787 -16.2269 -16.1468 -16.1037 -16.0779 -15.9973 -15.9812 -15.8900 -15.8896 -0.0066 0.0190 0.2755 0.3658 8.8683 8.8726 9.1316 9.1352 9.9547 10.0097 10.3289 10.3846 10.5401 10.5661 10.7992 10.8188 13.5556 13.5764 13.9266 13.9349 15.6791 15.6886 16.2253 16.3095 16.8945 16.9465 17.2568 17.2879 k = 0.2273 0.3936-0.0000 ( 2045 PWs) bands (ev): -40.4163 -40.4163 -40.4042 -40.4042 -18.1772 -18.1130 -18.0756 -18.0745 -16.2250 -16.1387 -16.0980 -16.0747 -15.9961 -15.9761 -15.8846 -15.8842 -0.0230 -0.0004 0.2719 0.3650 8.8876 8.8930 9.0880 9.0908 9.9299 9.9836 10.3246 10.3788 10.5107 10.5389 10.8046 10.8242 13.5536 13.5735 13.9317 13.9413 15.7249 15.7329 16.2890 16.3626 16.8054 16.8591 17.2807 17.3052 k = 0.2222 0.3849-0.0000 ( 2045 PWs) bands (ev): -40.4179 -40.4179 -40.4052 -40.4052 -18.1743 -18.1085 -18.0723 -18.0696 -16.2230 -16.1303 -16.0916 -16.0713 -15.9946 -15.9709 -15.8792 -15.8788 -0.0401 -0.0203 0.2682 0.3637 8.9071 8.9138 9.0471 9.0491 9.9044 9.9571 10.3187 10.3704 10.4807 10.5122 10.8083 10.8279 13.5536 13.5727 13.9392 13.9502 15.7651 15.7718 16.3423 16.4040 16.7220 16.7768 17.3106 17.3269 k = 0.2172 0.3762-0.0000 ( 2043 PWs) bands (ev): -40.4195 -40.4195 -40.4062 -40.4062 -18.1713 -18.1040 -18.0688 -18.0645 -16.2210 -16.1216 -16.0846 -16.0676 -15.9929 -15.9657 -15.8738 -15.8736 -0.0579 -0.0409 0.2642 0.3620 8.9267 8.9345 9.0090 9.0105 9.8784 9.9299 10.3108 10.3586 10.4506 10.4868 10.8103 10.8298 13.5559 13.5741 13.9489 13.9616 15.7990 15.8047 16.3852 16.4338 16.6454 16.7011 17.3453 17.3528 k = 0.2121 0.3674-0.0000 ( 2043 PWs) bands (ev): -40.4212 -40.4212 -40.4073 -40.4073 -18.1682 -18.0994 -18.0650 -18.0590 -16.2188 -16.1127 -16.0769 -16.0638 -15.9909 -15.9603 -15.8685 -15.8684 -0.0764 -0.0620 0.2599 0.3598 8.9463 8.9530 8.9740 8.9771 9.8517 9.9021 10.3004 10.3428 10.4211 10.4635 10.8104 10.8299 13.5604 13.5779 13.9606 13.9754 15.8256 15.8309 16.4181 16.4530 16.5769 16.6333 17.3819 17.3832 k = 0.2071 0.3587-0.0000 ( 2043 PWs) bands (ev): -40.4230 -40.4230 -40.4084 -40.4084 -18.1649 -18.0948 -18.0610 -18.0533 -16.2166 -16.1036 -16.0686 -16.0599 -15.9885 -15.9548 -15.8633 -15.8633 -0.0954 -0.0836 0.2554 0.3572 8.9379 8.9409 8.9669 8.9803 9.8244 9.8736 10.2870 10.3227 10.3929 10.4425 10.8088 10.8282 13.5672 13.5840 13.9745 13.9914 15.8440 15.8497 16.4418 16.4618 16.5178 16.5759 17.4130 17.4222 k = 0.2020 0.3499-0.0000 ( 2043 PWs) bands (ev): -40.4248 -40.4248 -40.4096 -40.4096 -18.1616 -18.0901 -18.0568 -18.0474 -16.2142 -16.0944 -16.0598 -16.0560 -15.9857 -15.9492 -15.8583 -15.8581 -0.1151 -0.1058 0.2507 0.3541 8.9087 8.9116 8.9865 9.0007 9.7964 9.8446 10.2699 10.2989 10.3667 10.4235 10.8053 10.8246 13.5766 13.5927 13.9903 14.0097 15.8533 15.8604 16.4569 16.4591 16.4700 16.5326 17.4443 17.4603 k = 0.1970 0.3412-0.0000 ( 2043 PWs) bands (ev): -40.4266 -40.4266 -40.4108 -40.4108 -18.1582 -18.0855 -18.0523 -18.0413 -16.2116 -16.0850 -16.0519 -16.0504 -15.9824 -15.9435 -15.8534 -15.8530 -0.1355 -0.1285 0.2457 0.3506 8.8816 8.8852 9.0061 9.0217 9.7679 9.8150 10.2490 10.2721 10.3427 10.4056 10.7999 10.8191 13.5885 13.6039 14.0082 14.0302 15.8532 15.8625 16.4310 16.4434 16.4680 16.5073 17.4741 17.4955 k = 0.1919 0.3324-0.0000 ( 2047 PWs) bands (ev): -40.4285 -40.4285 -40.4122 -40.4122 -18.1546 -18.0808 -18.0476 -18.0350 -16.2089 -16.0757 -16.0478 -16.0407 -15.9786 -15.9377 -15.8486 -15.8479 -0.1564 -0.1516 0.2404 0.3467 8.8575 8.8618 9.0256 9.0428 9.7388 9.7848 10.2247 10.2435 10.3206 10.3880 10.7927 10.8116 13.6030 13.6177 14.0282 14.0530 15.8439 15.8561 16.4050 16.4219 16.4724 16.4944 17.5008 17.5261 k = 0.1869 0.3237-0.0000 ( 2039 PWs) bands (ev): -40.4302 -40.4302 -40.4135 -40.4135 -18.1510 -18.0763 -18.0427 -18.0285 -16.2060 -16.0666 -16.0435 -16.0305 -15.9742 -15.9317 -15.8439 -15.8428 -0.1778 -0.1752 0.2350 0.3422 8.8364 8.8415 9.0447 9.0636 9.7092 9.7541 10.1979 10.2139 10.2998 10.3699 10.7836 10.8023 13.6202 13.6343 14.0502 14.0780 15.8267 15.8421 16.3890 16.4039 16.4731 16.4852 17.5231 17.5509 k = 0.1818 0.3149-0.0000 ( 2043 PWs) bands (ev): -40.4322 -40.4322 -40.4149 -40.4149 -18.1472 -18.0718 -18.0375 -18.0219 -16.2029 -16.0582 -16.0386 -16.0199 -15.9692 -15.9257 -15.8393 -15.8379 -0.1998 -0.1993 0.2293 0.3374 8.8184 8.8241 9.0634 9.0840 9.6791 9.7229 10.1696 10.1839 10.2791 10.3508 10.7726 10.7910 13.6401 13.6536 14.0743 14.1054 15.8036 15.8220 16.3814 16.3920 16.4710 16.4768 17.5395 17.5688 k = 0.1768 0.3062-0.0000 ( 2039 PWs) bands (ev): -40.4340 -40.4340 -40.4163 -40.4163 -18.1434 -18.0674 -18.0320 -18.0152 -16.1997 -16.0511 -16.0325 -16.0090 -15.9636 -15.9195 -15.8348 -15.8330 -0.2237 -0.2224 0.2233 0.3320 8.8034 8.8098 9.0815 9.1039 9.6487 9.6913 10.1407 10.1541 10.2581 10.3304 10.7598 10.7778 13.6628 13.6757 14.1007 14.1350 15.7767 15.7975 16.3804 16.3857 16.4671 16.4685 17.5492 17.5789 k = 0.1717 0.2974-0.0000 ( 2041 PWs) bands (ev): -40.4359 -40.4359 -40.4178 -40.4178 -18.1395 -18.0631 -18.0264 -18.0084 -16.1963 -16.0458 -16.0249 -15.9978 -15.9574 -15.9132 -15.8305 -15.8281 -0.2485 -0.2453 0.2171 0.3263 8.7915 8.7984 9.0990 9.1231 9.6180 9.6595 10.1119 10.1248 10.2363 10.3084 10.7451 10.7628 13.6883 13.7006 14.1293 14.1671 15.7480 15.7705 16.3840 16.3840 16.4607 16.4619 17.5512 17.5807 k = 0.1667 0.2887-0.0000 ( 2039 PWs) bands (ev): -40.4379 -40.4378 -40.4192 -40.4192 -18.1355 -18.0589 -18.0206 -18.0015 -16.1927 -16.0420 -16.0159 -15.9864 -15.9505 -15.9068 -15.8262 -15.8234 -0.2736 -0.2687 0.2108 0.3201 8.7825 8.7900 9.1156 9.1415 9.5871 9.6274 10.0834 10.0963 10.2136 10.2848 10.7287 10.7460 13.7166 13.7283 14.1603 14.2015 15.7191 15.7425 16.3853 16.3908 16.4537 16.4560 17.5452 17.5738 k = 0.1616 0.2799-0.0000 ( 2045 PWs) bands (ev): -40.4399 -40.4399 -40.4208 -40.4208 -18.1315 -18.0549 -18.0147 -17.9946 -16.1889 -16.0392 -16.0062 -15.9747 -15.9431 -15.9003 -15.8221 -15.8186 -0.2990 -0.2925 0.2042 0.3134 8.7764 8.7844 9.1313 9.1589 9.5562 9.5953 10.0558 10.0688 10.1898 10.2597 10.7107 10.7274 13.7477 13.7589 14.1937 14.2384 15.6909 15.7146 16.3884 16.3997 16.4477 16.4498 17.5308 17.5579 k = 0.1566 0.2712-0.0000 ( 2049 PWs) bands (ev): -40.4419 -40.4419 -40.4223 -40.4223 -18.1274 -18.0510 -18.0086 -17.9877 -16.1850 -16.0372 -15.9960 -15.9630 -15.9352 -15.8937 -15.8181 -15.8140 -0.3246 -0.3167 0.1974 0.3064 8.7731 8.7816 9.1458 9.1751 9.5253 9.5631 10.0291 10.0426 10.1651 10.2331 10.6910 10.7073 13.7817 13.7923 14.2295 14.2778 15.6642 15.6878 16.3922 16.4098 16.4436 16.4439 17.5080 17.5332 k = 0.1515 0.2624-0.0000 ( 2049 PWs) bands (ev): -40.4439 -40.4439 -40.4238 -40.4238 -18.1233 -18.0473 -18.0024 -17.9808 -16.1810 -16.0356 -15.9856 -15.9511 -15.9269 -15.8870 -15.8141 -15.8093 -0.3503 -0.3411 0.1904 0.2989 8.7726 8.7814 9.1590 9.1899 9.4946 9.5312 10.0036 10.0177 10.1397 10.2054 10.6699 10.6856 13.8184 13.8286 14.2677 14.3195 15.6395 15.6625 16.3952 16.4197 16.4392 16.4421 17.4767 17.4998 k = 0.1465 0.2537-0.0000 ( 2045 PWs) bands (ev): -40.4459 -40.4459 -40.4252 -40.4252 -18.1191 -18.0437 -17.9962 -17.9740 -16.1768 -16.0343 -15.9750 -15.9391 -15.9181 -15.8801 -15.8103 -15.8047 -0.3762 -0.3658 0.1833 0.2910 8.7745 8.7836 9.1706 9.2032 9.4643 9.4996 9.9792 9.9943 10.1140 10.1767 10.6475 10.6626 13.8579 13.8676 14.3084 14.3636 15.6171 15.6391 16.3966 16.4239 16.4409 16.4437 17.4373 17.4581 k = 0.1414 0.2449-0.0000 ( 2045 PWs) bands (ev): -40.4478 -40.4478 -40.4268 -40.4268 -18.1149 -18.0402 -17.9899 -17.9672 -16.1725 -16.0334 -15.9645 -15.9272 -15.9090 -15.8732 -15.8066 -15.8001 -0.4021 -0.3906 0.1760 0.2828 8.7789 8.7880 9.1804 9.2146 9.4346 9.4685 9.9560 9.9723 10.0883 10.1476 10.6238 10.6384 13.8999 13.9092 14.3514 14.4100 15.5970 15.6179 16.3960 16.4199 16.4483 16.4511 17.3905 17.4086 k = 0.1364 0.2362-0.0000 ( 2049 PWs) bands (ev): -40.4497 -40.4497 -40.4285 -40.4284 -18.1107 -18.0369 -17.9836 -17.9605 -16.1681 -16.0327 -15.9539 -15.9153 -15.8996 -15.8661 -15.8029 -15.7956 -0.4281 -0.4156 0.1687 0.2742 8.7853 8.7945 9.1884 9.2240 9.4058 9.4382 9.9338 9.9517 10.0633 10.1186 10.5991 10.6131 13.9445 13.9534 14.3966 14.4584 15.5795 15.5990 16.3936 16.4135 16.4553 16.4638 17.3369 17.3521 k = 0.1313 0.2274-0.0000 ( 2049 PWs) bands (ev): -40.4517 -40.4517 -40.4300 -40.4300 -18.1065 -18.0338 -17.9773 -17.9539 -16.1637 -16.0322 -15.9434 -15.9035 -15.8901 -15.8590 -15.7992 -15.7911 -0.4539 -0.4406 0.1612 0.2652 8.7935 8.8026 9.1941 9.2311 9.3781 9.4090 9.9123 9.9322 10.0396 10.0903 10.5736 10.5870 13.9916 14.0001 14.4439 14.5088 15.5643 15.5826 16.3900 16.4060 16.4638 16.4771 17.2776 17.2896 k = 0.1263 0.2187-0.0000 ( 2053 PWs) bands (ev): -40.4537 -40.4537 -40.4315 -40.4315 -18.1022 -18.0309 -17.9710 -17.9475 -16.1591 -16.0319 -15.9331 -15.8920 -15.8803 -15.8518 -15.7956 -15.7865 -0.4796 -0.4656 0.1536 0.2560 8.8032 8.8120 9.1976 9.2359 9.3519 9.3811 9.8911 9.9133 10.0180 10.0636 10.5473 10.5601 14.0409 14.0491 14.4930 14.5608 15.5517 15.5686 16.3850 16.3970 16.4732 16.4909 17.2138 17.2223 k = 0.1212 0.2099-0.0000 ( 2049 PWs) bands (ev): -40.4555 -40.4555 -40.4329 -40.4329 -18.0980 -18.0281 -17.9647 -17.9412 -16.1545 -16.0317 -15.9228 -15.8806 -15.8705 -15.8445 -15.7919 -15.7819 -0.5051 -0.4905 0.1460 0.2465 8.8139 8.8222 9.1987 9.2381 9.3277 9.3551 9.8698 9.8944 9.9994 10.0396 10.5205 10.5326 14.0925 14.1003 14.5438 14.6142 15.5416 15.5571 16.3784 16.3861 16.4832 16.5048 17.1470 17.1516 k = 0.1162 0.2012-0.0000 ( 2049 PWs) bands (ev): -40.4572 -40.4572 -40.4345 -40.4345 -18.0938 -18.0255 -17.9585 -17.9350 -16.1499 -16.0317 -15.9128 -15.8697 -15.8606 -15.8371 -15.7882 -15.7773 -0.5303 -0.5152 0.1384 0.2367 8.8251 8.8327 9.1972 9.2376 9.3059 9.3313 9.8479 9.8747 9.9843 10.0193 10.4933 10.5048 14.1459 14.1535 14.5958 14.6686 15.5339 15.5483 16.3693 16.3723 16.4933 16.5188 17.0788 17.0792 k = 0.1111 0.1925-0.0000 ( 2057 PWs) bands (ev): -40.4592 -40.4591 -40.4360 -40.4360 -18.0896 -18.0230 -17.9525 -17.9291 -16.1453 -16.0319 -15.9031 -15.8593 -15.8507 -15.8296 -15.7844 -15.7727 -0.5552 -0.5397 0.1308 0.2268 8.8361 8.8426 9.1932 9.2345 9.2873 9.3104 9.8255 9.8536 9.9731 10.0035 10.4660 10.4769 14.2011 14.2085 14.6487 14.7235 15.5288 15.5422 16.3545 16.3569 16.5035 16.5328 17.0070 17.0113 k = 0.1061 0.1837-0.0000 ( 2053 PWs) bands (ev): -40.4609 -40.4609 -40.4373 -40.4373 -18.0855 -18.0208 -17.9465 -17.9234 -16.1407 -16.0322 -15.8936 -15.8494 -15.8409 -15.8221 -15.7804 -15.7680 -0.5796 -0.5639 0.1233 0.2166 8.8462 8.8513 9.1868 9.2287 9.2725 9.2930 9.8025 9.8310 9.9658 9.9925 10.4386 10.4489 14.2579 14.2651 14.7020 14.7784 15.5264 15.5392 16.3314 16.3395 16.5137 16.5468 16.9375 16.9467 k = 0.1010 0.1750-0.0000 ( 2053 PWs) bands (ev): -40.4626 -40.4626 -40.4387 -40.4387 -18.0814 -18.0187 -17.9406 -17.9179 -16.1361 -16.0326 -15.8845 -15.8403 -15.8312 -15.8145 -15.7762 -15.7632 -0.6035 -0.5877 0.1158 0.2064 8.8545 8.8580 9.1781 9.2204 9.2622 9.2799 9.7793 9.8072 9.9621 9.9862 10.4115 10.4211 14.3160 14.3230 14.7552 14.8326 15.5267 15.5393 16.3013 16.3155 16.5234 16.5606 16.8732 16.8873 k = 0.0960 0.1662-0.0000 ( 2053 PWs) bands (ev): -40.4643 -40.4643 -40.4400 -40.4400 -18.0773 -18.0169 -17.9349 -17.9126 -16.1315 -16.0331 -15.8757 -15.8321 -15.8217 -15.8068 -15.7716 -15.7584 -0.6268 -0.6110 0.1085 0.1961 8.8603 8.8618 9.1673 9.2099 9.2570 9.2716 9.7564 9.7827 9.9616 9.9838 10.3846 10.3937 14.3751 14.3820 14.8077 14.8854 15.5301 15.5432 16.2631 16.2829 16.5327 16.5742 16.8167 16.8350 k = 0.0909 0.1575-0.0000 ( 2057 PWs) bands (ev): -40.4660 -40.4660 -40.4414 -40.4414 -18.0733 -18.0152 -17.9294 -17.9076 -16.1270 -16.0337 -15.8674 -15.8247 -15.8124 -15.7993 -15.7665 -15.7534 -0.6495 -0.6338 0.1014 0.1857 8.8623 8.8629 9.1547 9.1973 9.2572 9.2687 9.7339 9.7583 9.9637 9.9847 10.3583 10.3667 14.4350 14.4417 14.8587 14.9358 15.5369 15.5511 16.2161 16.2405 16.5414 16.5874 16.7702 16.7911 k = 0.0859 0.1487-0.0000 ( 2057 PWs) bands (ev): -40.4675 -40.4675 -40.4427 -40.4427 -18.0694 -18.0138 -17.9240 -17.9029 -16.1225 -16.0344 -15.8595 -15.8183 -15.8034 -15.7919 -15.7610 -15.7484 -0.6714 -0.6559 0.0945 0.1753 8.8594 8.8619 9.1407 9.1829 9.2628 9.2713 9.7124 9.7344 9.9682 9.9883 10.3326 10.3405 14.4953 14.5019 14.9075 14.9830 15.5473 15.5636 16.1608 16.1882 16.5493 16.6002 16.7344 16.7559 k = 0.0808 0.1400-0.0000 ( 2057 PWs) bands (ev): -40.4690 -40.4690 -40.4439 -40.4439 -18.0656 -18.0125 -17.9188 -17.8984 -16.1182 -16.0353 -15.8521 -15.8129 -15.7946 -15.7847 -15.7551 -15.7432 -0.6925 -0.6773 0.0879 0.1651 8.8532 8.8575 9.1255 9.1671 9.2735 9.2792 9.6918 9.7115 9.9745 9.9938 10.3077 10.3150 14.5557 14.5623 14.9534 15.0260 15.5617 15.5812 16.0986 16.1273 16.5563 16.6123 16.7087 16.7287 k = 0.0758 0.1312-0.0000 ( 2053 PWs) bands (ev): -40.4703 -40.4703 -40.4450 -40.4450 -18.0618 -18.0115 -17.9138 -17.8942 -16.1139 -16.0362 -15.8452 -15.8082 -15.7863 -15.7778 -15.7487 -15.7380 -0.7127 -0.6979 0.0815 0.1549 8.8444 8.8501 9.1095 9.1502 9.2884 9.2918 9.6725 9.6898 9.9822 10.0008 10.2837 10.2904 14.6159 14.6225 14.9956 15.0642 15.5805 15.6041 16.0313 16.0601 16.5622 16.6238 16.6915 16.7082 k = 0.0707 0.1225-0.0000 ( 2057 PWs) bands (ev): -40.4718 -40.4718 -40.4461 -40.4461 -18.0581 -18.0106 -17.9090 -17.8903 -16.1096 -16.0372 -15.8388 -15.8043 -15.7783 -15.7713 -15.7421 -15.7328 -0.7320 -0.7177 0.0755 0.1449 8.8336 8.8402 9.0930 9.1324 9.3067 9.3083 9.6545 9.6695 9.9910 10.0090 10.2607 10.2669 14.6754 14.6820 15.0334 15.0969 15.6037 15.6322 15.9609 15.9889 16.5673 16.6343 16.6807 16.6929 k = 0.0657 0.1137-0.0000 ( 2063 PWs) bands (ev): -40.4731 -40.4731 -40.4473 -40.4473 -18.0546 -18.0100 -17.9044 -17.8867 -16.1055 -16.0384 -15.8329 -15.8011 -15.7708 -15.7650 -15.7354 -15.7276 -0.7502 -0.7365 0.0699 0.1351 8.8214 8.8286 9.0763 9.1142 9.3276 9.3278 9.6378 9.6507 10.0005 10.0178 10.2389 10.2446 14.7338 14.7405 15.0666 15.1242 15.6313 15.6652 15.8894 15.9160 16.5714 16.6439 16.6746 16.6816 k = 0.0606 0.1050-0.0000 ( 2063 PWs) bands (ev): -40.4742 -40.4742 -40.4484 -40.4484 -18.0511 -18.0095 -17.9001 -17.8834 -16.1015 -16.0396 -15.8274 -15.7985 -15.7637 -15.7591 -15.7288 -15.7224 -0.7673 -0.7543 0.0647 0.1255 8.8084 8.8158 9.0597 9.0958 9.3493 9.3501 9.6226 9.6335 10.0105 10.0270 10.2184 10.2235 14.7909 14.7976 15.0951 15.1465 15.6627 15.7021 15.8185 15.8433 16.5748 16.6523 16.6716 16.6733 k = 0.0556 0.0962-0.0000 ( 2061 PWs) bands (ev): -40.4753 -40.4753 -40.4492 -40.4492 -18.0477 -18.0093 -17.8960 -17.8804 -16.0976 -16.0410 -15.8225 -15.7963 -15.7571 -15.7536 -15.7224 -15.7173 -0.7832 -0.7710 0.0600 0.1163 8.7952 8.8026 9.0436 9.0775 9.3721 9.3736 9.6087 9.6179 10.0206 10.0362 10.1992 10.2037 14.8460 14.8528 15.1190 15.1641 15.6956 15.7406 15.7510 15.7734 16.5777 16.6595 16.6671 16.6707 k = 0.0505 0.0875-0.0000 ( 2057 PWs) bands (ev): -40.4763 -40.4763 -40.4499 -40.4499 -18.0444 -18.0092 -17.8921 -17.8778 -16.0938 -16.0424 -15.8180 -15.7945 -15.7510 -15.7483 -15.7162 -15.7123 -0.7979 -0.7866 0.0559 0.1075 8.7822 8.7894 9.0282 9.0598 9.3953 9.3972 9.5961 9.6039 10.0308 10.0453 10.1815 10.1855 14.8988 14.9057 15.1388 15.1779 15.6777 15.7021 15.7397 15.7848 16.5803 16.6618 16.6659 16.6709 k = 0.0455 0.0787-0.0000 ( 2057 PWs) bands (ev): -40.4773 -40.4773 -40.4506 -40.4506 -18.0413 -18.0094 -17.8885 -17.8755 -16.0901 -16.0439 -15.8140 -15.7932 -15.7454 -15.7435 -15.7105 -15.7076 -0.8113 -0.8009 0.0522 0.0991 8.7697 8.7765 9.0138 9.0427 9.4183 9.4204 9.5849 9.5914 10.0407 10.0541 10.1653 10.1687 14.9488 14.9558 15.1550 15.1885 15.6163 15.6375 15.7770 15.8262 16.5827 16.6582 16.6703 16.6715 k = 0.0404 0.0700-0.0000 ( 2057 PWs) bands (ev): -40.4782 -40.4782 -40.4512 -40.4512 -18.0382 -18.0097 -17.8852 -17.8735 -16.0866 -16.0455 -15.8103 -15.7921 -15.7404 -15.7390 -15.7053 -15.7032 -0.8234 -0.8140 0.0491 0.0911 8.7580 8.7643 9.0005 9.0266 9.4405 9.4427 9.5750 9.5803 10.0501 10.0622 10.1506 10.1535 14.9956 15.0027 15.1681 15.1966 15.5577 15.5770 15.8161 15.8669 16.5851 16.6550 16.6724 16.6734 k = 0.0354 0.0612-0.0000 ( 2067 PWs) bands (ev): -40.4792 -40.4792 -40.4519 -40.4519 -18.0353 -18.0102 -17.8822 -17.8718 -16.0831 -16.0473 -15.8071 -15.7914 -15.7360 -15.7351 -15.7005 -15.6992 -0.8341 -0.8257 0.0467 0.0836 8.7473 8.7530 8.9885 9.0117 9.4613 9.4635 9.5664 9.5707 10.0589 10.0695 10.1376 10.1399 15.0386 15.0458 15.1787 15.2027 15.5040 15.5216 15.8548 15.9053 16.5875 16.6521 16.6730 16.6752 k = 0.0303 0.0525-0.0000 ( 2069 PWs) bands (ev): -40.4799 -40.4799 -40.4524 -40.4524 -18.0326 -18.0109 -17.8795 -17.8705 -16.0798 -16.0491 -15.8042 -15.7909 -15.7321 -15.7315 -15.6964 -15.6955 -0.8433 -0.8361 0.0449 0.0767 8.7378 8.7428 8.9781 8.9982 9.4804 9.4824 9.5591 9.5625 10.0669 10.0760 10.1264 10.1281 15.0777 15.0849 15.1874 15.2071 15.4557 15.4717 15.8920 15.9403 16.5903 16.6491 16.6735 16.6758 k = 0.0253 0.0437-0.0000 ( 2069 PWs) bands (ev): -40.4805 -40.4805 -40.4529 -40.4529 -18.0299 -18.0118 -17.8770 -17.8694 -16.0766 -16.0511 -15.8017 -15.7907 -15.7288 -15.7285 -15.6928 -15.6923 -0.8512 -0.8450 0.0437 0.0704 8.7297 8.7339 8.9693 8.9862 9.4972 9.4990 9.5530 9.5557 10.0740 10.0814 10.1169 10.1180 15.1123 15.1196 15.1944 15.2102 15.4133 15.4278 15.9265 15.9709 16.5934 16.6459 16.6736 16.6756 k = 0.0202 0.0350-0.0000 ( 2073 PWs) bands (ev): -40.4810 -40.4810 -40.4533 -40.4533 -18.0274 -18.0129 -17.8748 -17.8687 -16.0735 -16.0531 -15.7994 -15.7907 -15.7261 -15.7259 -15.6899 -15.6896 -0.8575 -0.8525 0.0432 0.0646 8.7229 8.7263 8.9623 8.9759 9.5113 9.5128 9.5483 9.5503 10.0800 10.0855 10.1095 10.1098 15.1423 15.1493 15.2002 15.2123 15.3771 15.3901 15.9575 15.9960 16.5973 16.6420 16.6735 16.6748 k = 0.0152 0.0262-0.0000 ( 2077 PWs) bands (ev): -40.4815 -40.4815 -40.4536 -40.4536 -18.0251 -18.0141 -17.8730 -17.8684 -16.0706 -16.0553 -15.7974 -15.7910 -15.7240 -15.7239 -15.6876 -15.6875 -0.8623 -0.8585 0.0434 0.0596 8.7177 8.7203 8.9571 8.9674 9.5225 9.5236 9.5450 9.5463 10.0847 10.0881 10.1036 10.1041 15.1675 15.1737 15.2053 15.2136 15.3475 15.3587 15.9841 16.0149 16.6018 16.6374 16.6732 16.6738 k = 0.0101 0.0175-0.0000 ( 2077 PWs) bands (ev): -40.4818 -40.4818 -40.4538 -40.4538 -18.0229 -18.0156 -17.8714 -17.8684 -16.0677 -16.0575 -15.7957 -15.7914 -15.7225 -15.7225 -15.6860 -15.6860 -0.8655 -0.8630 0.0444 0.0551 8.7141 8.7158 8.9539 8.9608 9.5300 9.5305 9.5434 9.5441 10.0878 10.0891 10.0997 10.1010 15.1872 15.1913 15.2105 15.2145 15.3250 15.3339 16.0055 16.0271 16.6071 16.6319 16.6728 16.6730 k = 0.0051 0.0087-0.0000 ( 2077 PWs) bands (ev): -40.4819 -40.4819 -40.4540 -40.4540 -18.0208 -18.0171 -17.8702 -17.8686 -16.0650 -16.0599 -15.7943 -15.7921 -15.7216 -15.7216 -15.6850 -15.6850 -0.8672 -0.8660 0.0460 0.0514 8.7120 8.7129 8.9526 8.9561 9.5335 9.5336 9.5437 9.5439 10.0889 10.0890 10.0984 10.0996 15.1999 15.2009 15.2159 15.2159 15.3111 15.3164 16.0210 16.0321 16.6131 16.6258 16.6725 16.6725 k = 0.0000 0.0000 0.0000 ( 2077 PWs) bands (ev): -40.4820 -40.4820 -40.4540 -40.4540 -18.0189 -18.0189 -17.8693 -17.8693 -16.0624 -16.0624 -15.7931 -15.7931 -15.7213 -15.7213 -15.6847 -15.6847 -0.8674 -0.8674 0.0483 0.0483 8.7116 8.7116 8.9533 8.9533 9.5342 9.5342 9.5442 9.5442 10.0889 10.0889 10.0988 10.0988 15.2037 15.2037 15.2179 15.2179 15.3081 15.3081 16.0300 16.0300 16.6194 16.6194 16.6724 16.6724 k = 0.0000 0.0000 0.0000 ( 2077 PWs) bands (ev): -40.4820 -40.4820 -40.4540 -40.4540 -18.0189 -18.0189 -17.8693 -17.8693 -16.0624 -16.0624 -15.7931 -15.7931 -15.7213 -15.7213 -15.6847 -15.6847 -0.8674 -0.8674 0.0483 0.0483 8.7116 8.7116 8.9533 8.9533 9.5342 9.5342 9.5442 9.5442 10.0889 10.0889 10.0988 10.0988 15.2037 15.2037 15.2179 15.2179 15.3081 15.3081 16.0300 16.0300 16.6194 16.6194 16.6724 16.6724 k = 0.0000 0.0000 0.0102 ( 2077 PWs) bands (ev): -40.4819 -40.4819 -40.4540 -40.4540 -18.0187 -18.0187 -17.8694 -17.8694 -16.0622 -16.0622 -15.7934 -15.7934 -15.7213 -15.7213 -15.6847 -15.6847 -0.8665 -0.8665 0.0476 0.0476 8.7110 8.7110 8.9521 8.9521 9.5347 9.5347 9.5446 9.5446 10.0883 10.0883 10.0981 10.0981 15.2050 15.2050 15.2191 15.2191 15.3110 15.3110 16.0333 16.0333 16.6184 16.6184 16.6711 16.6711 k = 0.0000 0.0000 0.0204 ( 2071 PWs) bands (ev): -40.4817 -40.4817 -40.4541 -40.4541 -18.0183 -18.0183 -17.8697 -17.8697 -16.0615 -16.0615 -15.7941 -15.7941 -15.7212 -15.7212 -15.6848 -15.6848 -0.8637 -0.8637 0.0454 0.0454 8.7091 8.7091 8.9482 8.9482 9.5359 9.5359 9.5459 9.5459 10.0865 10.0865 10.0963 10.0963 15.2087 15.2087 15.2228 15.2228 15.3197 15.3197 16.0433 16.0433 16.6152 16.6152 16.6671 16.6671 k = 0.0000 0.0000 0.0306 ( 2071 PWs) bands (ev): -40.4815 -40.4815 -40.4542 -40.4542 -18.0176 -18.0176 -17.8704 -17.8704 -16.0604 -16.0604 -15.7955 -15.7955 -15.7210 -15.7210 -15.6850 -15.6850 -0.8592 -0.8592 0.0417 0.0417 8.7060 8.7060 8.9419 8.9419 9.5380 9.5380 9.5480 9.5480 10.0834 10.0834 10.0933 10.0933 15.2149 15.2149 15.2289 15.2289 15.3341 15.3341 16.0596 16.0596 16.6099 16.6099 16.6606 16.6606 k = 0.0000 0.0000 0.0408 ( 2071 PWs) bands (ev): -40.4814 -40.4814 -40.4544 -40.4544 -18.0166 -18.0166 -17.8713 -17.8713 -16.0589 -16.0589 -15.7974 -15.7974 -15.7208 -15.7208 -15.6852 -15.6852 -0.8529 -0.8529 0.0365 0.0365 8.7016 8.7016 8.9332 8.9332 9.5409 9.5409 9.5509 9.5509 10.0792 10.0792 10.0890 10.0890 15.2235 15.2235 15.2374 15.2374 15.3542 15.3542 16.0821 16.0821 16.6026 16.6026 16.6514 16.6514 k = 0.0000 0.0000 0.0510 ( 2071 PWs) bands (ev): -40.4811 -40.4811 -40.4546 -40.4546 -18.0153 -18.0153 -17.8724 -17.8724 -16.0569 -16.0569 -15.7997 -15.7997 -15.7205 -15.7205 -15.6855 -15.6855 -0.8448 -0.8448 0.0299 0.0299 8.6962 8.6962 8.9223 8.9223 9.5447 9.5447 9.5547 9.5547 10.0738 10.0738 10.0836 10.0836 15.2346 15.2346 15.2482 15.2482 15.3798 15.3798 16.1102 16.1102 16.5932 16.5932 16.6396 16.6396 k = 0.0000 0.0000 0.0612 ( 2065 PWs) bands (ev): -40.4807 -40.4807 -40.4549 -40.4549 -18.0137 -18.0137 -17.8738 -17.8738 -16.0544 -16.0544 -15.8026 -15.8026 -15.7201 -15.7201 -15.6859 -15.6859 -0.8350 -0.8350 0.0219 0.0219 8.6898 8.6898 8.9094 8.9094 9.5493 9.5493 9.5592 9.5592 10.0673 10.0673 10.0770 10.0770 15.2481 15.2481 15.2615 15.2615 15.4108 15.4108 16.1436 16.1436 16.5818 16.5818 16.6252 16.6252 k = 0.0000 0.0000 0.0714 ( 2059 PWs) bands (ev): -40.4800 -40.4800 -40.4554 -40.4554 -18.0119 -18.0119 -17.8754 -17.8754 -16.0516 -16.0516 -15.8060 -15.8060 -15.7197 -15.7197 -15.6863 -15.6863 -0.8236 -0.8236 0.0124 0.0124 8.6825 8.6825 8.8946 8.8946 9.5547 9.5547 9.5646 9.5646 10.0597 10.0597 10.0694 10.0694 15.2640 15.2640 15.2770 15.2770 15.4470 15.4470 16.1814 16.1814 16.5686 16.5686 16.6081 16.6081 k = 0.0000 0.0000 0.0816 ( 2059 PWs) bands (ev): -40.4797 -40.4797 -40.4557 -40.4557 -18.0098 -18.0098 -17.8773 -17.8773 -16.0484 -16.0484 -15.8099 -15.8099 -15.7192 -15.7192 -15.6867 -15.6867 -0.8105 -0.8105 0.0015 0.0015 8.6744 8.6744 8.8782 8.8782 9.5609 9.5609 9.5708 9.5708 10.0510 10.0510 10.0607 10.0607 15.2821 15.2821 15.2948 15.2948 15.4882 15.4882 16.2226 16.2226 16.5540 16.5540 16.5886 16.5886 k = 0.0000 0.0000 0.0918 ( 2065 PWs) bands (ev): -40.4793 -40.4793 -40.4563 -40.4563 -18.0075 -18.0075 -17.8794 -17.8794 -16.0447 -16.0447 -15.8142 -15.8142 -15.7187 -15.7187 -15.6873 -15.6873 -0.7958 -0.7958 -0.0108 -0.0108 8.6657 8.6657 8.8605 8.8605 9.5679 9.5679 9.5778 9.5778 10.0413 10.0413 10.0510 10.0510 15.3026 15.3026 15.3147 15.3147 15.5340 15.5340 16.2658 16.2658 16.5385 16.5385 16.5665 16.5665 k = 0.0000 0.0000 0.1020 ( 2065 PWs) bands (ev): -40.4789 -40.4789 -40.4567 -40.4567 -18.0049 -18.0049 -17.8817 -17.8817 -16.0406 -16.0406 -15.8190 -15.8190 -15.7181 -15.7181 -15.6879 -15.6879 -0.7796 -0.7796 -0.0244 -0.0244 8.6566 8.6566 8.8416 8.8416 9.5757 9.5757 9.5855 9.5855 10.0307 10.0307 10.0403 10.0403 15.3252 15.3252 15.3369 15.3369 15.5843 15.5843 16.3088 16.3088 16.5237 16.5237 16.5419 16.5419 k = 0.0000 0.0000 0.1122 ( 2071 PWs) bands (ev): -40.4784 -40.4784 -40.4574 -40.4574 -18.0022 -18.0022 -17.8842 -17.8842 -16.0362 -16.0362 -15.8242 -15.8242 -15.7174 -15.7174 -15.6886 -15.6886 -0.7620 -0.7620 -0.0393 -0.0393 8.6473 8.6473 8.8219 8.8219 9.5842 9.5842 9.5940 9.5940 10.0192 10.0192 10.0288 10.0288 15.3500 15.3500 15.3610 15.3610 15.6386 15.6386 16.3470 16.3470 16.5131 16.5131 16.5150 16.5150 k = 0.0000 0.0000 0.1224 ( 2059 PWs) bands (ev): -40.4776 -40.4776 -40.4578 -40.4578 -17.9991 -17.9991 -17.8870 -17.8870 -16.0313 -16.0313 -15.8297 -15.8297 -15.7167 -15.7167 -15.6893 -15.6893 -0.7430 -0.7430 -0.0556 -0.0556 8.6378 8.6378 8.8017 8.8017 9.5935 9.5935 9.6033 9.6033 10.0068 10.0068 10.0164 10.0164 15.3770 15.3770 15.3873 15.3873 15.6967 15.6967 16.3716 16.3716 16.4857 16.4857 16.5145 16.5145 k = 0.0000 0.0000 0.1326 ( 2059 PWs) bands (ev): -40.4770 -40.4770 -40.4584 -40.4584 -17.9959 -17.9959 -17.8899 -17.8899 -16.0261 -16.0261 -15.8357 -15.8357 -15.7160 -15.7160 -15.6900 -15.6900 -0.7227 -0.7227 -0.0731 -0.0731 8.6284 8.6284 8.7812 8.7812 9.6035 9.6035 9.6132 9.6132 9.9937 9.9937 10.0033 10.0033 15.4059 15.4059 15.4155 15.4155 15.7581 15.7581 16.3744 16.3744 16.4543 16.4543 16.5352 16.5352 k = 0.0000 0.0000 0.1428 ( 2059 PWs) bands (ev): -40.4764 -40.4764 -40.4590 -40.4590 -17.9924 -17.9924 -17.8931 -17.8931 -16.0206 -16.0206 -15.8420 -15.8420 -15.7152 -15.7152 -15.6908 -15.6908 -0.7012 -0.7012 -0.0917 -0.0917 8.6193 8.6193 8.7607 8.7607 9.6141 9.6141 9.6239 9.6239 9.9799 9.9799 9.9894 9.9894 15.4367 15.4367 15.4455 15.4455 15.8224 15.8224 16.3594 16.3594 16.4208 16.4208 16.5698 16.5698 k = 0.0000 0.0000 0.1530 ( 2071 PWs) bands (ev): -40.4761 -40.4761 -40.4596 -40.4596 -17.9888 -17.9888 -17.8965 -17.8965 -16.0147 -16.0147 -15.8487 -15.8487 -15.7143 -15.7143 -15.6917 -15.6917 -0.6786 -0.6786 -0.1116 -0.1116 8.6106 8.6106 8.7403 8.7403 9.6255 9.6255 9.6352 9.6352 9.9655 9.9655 9.9750 9.9750 15.4693 15.4693 15.4771 15.4771 15.8892 15.8892 16.3349 16.3349 16.3854 16.3854 16.6089 16.6089 k = 0.0000 0.0000 0.1631 ( 2071 PWs) bands (ev): -40.4755 -40.4755 -40.4603 -40.4603 -17.9851 -17.9851 -17.9000 -17.9000 -16.0085 -16.0085 -15.8556 -15.8556 -15.7134 -15.7134 -15.6926 -15.6926 -0.6550 -0.6550 -0.1325 -0.1325 8.6025 8.6025 8.7205 8.7205 9.6375 9.6375 9.6472 9.6472 9.9505 9.9505 9.9600 9.9600 15.5037 15.5037 15.5106 15.5106 15.9581 15.9581 16.3051 16.3051 16.3482 16.3482 16.6470 16.6470 k = 0.0000 0.0000 0.1733 ( 2059 PWs) bands (ev): -40.4747 -40.4747 -40.4607 -40.4607 -17.9811 -17.9811 -17.9036 -17.9036 -16.0020 -16.0020 -15.8628 -15.8628 -15.7125 -15.7125 -15.6935 -15.6935 -0.6305 -0.6305 -0.1545 -0.1545 8.5952 8.5952 8.7013 8.7013 9.6502 9.6502 9.6598 9.6598 9.9350 9.9350 9.9445 9.9445 15.5398 15.5398 15.5456 15.5456 16.0283 16.0283 16.2721 16.2721 16.3094 16.3094 16.6810 16.6810 k = 0.0000 0.0000 0.1835 ( 2059 PWs) bands (ev): -40.4740 -40.4740 -40.4614 -40.4614 -17.9770 -17.9770 -17.9074 -17.9074 -15.9953 -15.9953 -15.8702 -15.8702 -15.7115 -15.7115 -15.6945 -15.6945 -0.6052 -0.6052 -0.1774 -0.1774 8.5888 8.5888 8.6830 8.6830 9.6634 9.6634 9.6730 9.6730 9.9192 9.9192 9.9286 9.9286 15.5773 15.5773 15.5820 15.5820 16.0995 16.0995 16.2366 16.2366 16.2692 16.2692 16.7089 16.7089 k = 0.0000 0.0000 0.1937 ( 2059 PWs) bands (ev): -40.4732 -40.4732 -40.4622 -40.4622 -17.9729 -17.9729 -17.9114 -17.9114 -15.9883 -15.9883 -15.8778 -15.8778 -15.7105 -15.7105 -15.6955 -15.6955 -0.5791 -0.5791 -0.2012 -0.2012 8.5834 8.5834 8.6658 8.6658 9.6772 9.6772 9.6868 9.6868 9.9030 9.9030 9.9124 9.9124 15.6163 15.6163 15.6197 15.6197 16.1709 16.1709 16.1991 16.1991 16.2276 16.2276 16.7292 16.7292 k = 0.0000 0.0000 0.2039 ( 2053 PWs) bands (ev): -40.4724 -40.4724 -40.4628 -40.4628 -17.9686 -17.9686 -17.9155 -17.9155 -15.9810 -15.9810 -15.8856 -15.8856 -15.7095 -15.7095 -15.6965 -15.6965 -0.5525 -0.5525 -0.2259 -0.2259 8.5792 8.5792 8.6497 8.6497 9.6915 9.6915 9.7011 9.7011 9.8865 9.8865 9.8959 9.8959 15.6566 15.6566 15.6586 15.6586 16.1602 16.1602 16.1850 16.1850 16.2419 16.2419 16.7408 16.7408 k = 0.0000 0.0000 0.2141 ( 2054 PWs) bands (ev): -40.4716 -40.4716 -40.4636 -40.4636 -17.9642 -17.9642 -17.9197 -17.9197 -15.9736 -15.9736 -15.8935 -15.8935 -15.7084 -15.7084 -15.6975 -15.6975 -0.5254 -0.5254 -0.2513 -0.2513 8.5764 8.5764 8.6350 8.6350 9.7063 9.7063 9.7158 9.7158 9.8698 9.8698 9.8792 9.8792 15.6980 15.6980 15.6986 15.6986 16.1200 16.1200 16.1415 16.1415 16.3117 16.3117 16.7429 16.7429 k = 0.0000 0.0000 0.2243 ( 2054 PWs) bands (ev): -40.4708 -40.4708 -40.4644 -40.4644 -17.9598 -17.9598 -17.9239 -17.9239 -15.9660 -15.9660 -15.9015 -15.9015 -15.7074 -15.7074 -15.6986 -15.6986 -0.4979 -0.4979 -0.2774 -0.2774 8.5749 8.5749 8.6218 8.6218 9.7215 9.7215 9.7310 9.7310 9.8530 9.8530 9.8624 9.8624 15.7395 15.7395 15.7404 15.7404 16.0788 16.0788 16.0973 16.0973 16.3796 16.3796 16.7353 16.7353 k = 0.0000 0.0000 0.2345 ( 2054 PWs) bands (ev): -40.4702 -40.4702 -40.4651 -40.4651 -17.9553 -17.9553 -17.9283 -17.9283 -15.9581 -15.9581 -15.9096 -15.9096 -15.7063 -15.7063 -15.6997 -15.6997 -0.4701 -0.4701 -0.3040 -0.3040 8.5750 8.5750 8.6101 8.6101 9.7371 9.7371 9.7466 9.7466 9.8361 9.8361 9.8455 9.8455 15.7810 15.7810 15.7837 15.7837 16.0369 16.0369 16.0526 16.0526 16.4445 16.4445 16.7180 16.7180 k = 0.0000 0.0000 0.2447 ( 2054 PWs) bands (ev): -40.4694 -40.4694 -40.4659 -40.4659 -17.9508 -17.9508 -17.9328 -17.9328 -15.9502 -15.9502 -15.9178 -15.9178 -15.7052 -15.7052 -15.7008 -15.7008 -0.4422 -0.4422 -0.3311 -0.3311 8.5767 8.5767 8.6001 8.6001 9.7530 9.7530 9.7625 9.7625 9.8192 9.8192 9.8287 9.8287 15.8232 15.8232 15.8277 15.8277 15.9944 15.9944 16.0075 16.0075 16.5056 16.5056 16.6912 16.6912 k = 0.0000 0.0000 0.2549 ( 2042 PWs) bands (ev): -40.4683 -40.4683 -40.4666 -40.4666 -17.9462 -17.9462 -17.9372 -17.9372 -15.9422 -15.9422 -15.9259 -15.9259 -15.7041 -15.7041 -15.7019 -15.7019 -0.4142 -0.4142 -0.3585 -0.3585 8.5800 8.5800 8.5917 8.5917 9.7693 9.7693 9.7788 9.7788 9.8025 9.8025 9.8119 9.8119 15.8659 15.8659 15.8723 15.8723 15.9517 15.9517 15.9624 15.9624 16.5618 16.5618 16.6556 16.6556 k = 0.0000 0.0000 0.2651 ( 2042 PWs) bands (ev): -40.4674 -40.4674 -40.4674 -40.4674 -17.9417 -17.9417 -17.9417 -17.9417 -15.9341 -15.9341 -15.9341 -15.9341 -15.7030 -15.7030 -15.7030 -15.7030 -0.3863 -0.3863 -0.3863 -0.3863 8.5850 8.5850 8.5850 8.5850 9.7858 9.7858 9.7858 9.7858 9.7952 9.7952 9.7952 9.7952 15.9087 15.9087 15.9087 15.9087 15.9172 15.9172 15.9172 15.9172 16.6122 16.6122 16.6122 16.6122 k = 0.0000 0.0000 0.2651 ( 2042 PWs) bands (ev): -40.4674 -40.4674 -40.4674 -40.4674 -17.9417 -17.9417 -17.9417 -17.9417 -15.9341 -15.9341 -15.9341 -15.9341 -15.7030 -15.7030 -15.7030 -15.7030 -0.3863 -0.3863 -0.3863 -0.3863 8.5850 8.5850 8.5850 8.5850 9.7858 9.7858 9.7858 9.7858 9.7952 9.7952 9.7952 9.7952 15.9087 15.9087 15.9087 15.9087 15.9172 15.9172 15.9172 15.9172 16.6122 16.6122 16.6122 16.6122 k = 0.0088 0.0051 0.2651 ( 2054 PWs) bands (ev): -40.4676 -40.4676 -40.4676 -40.4676 -17.9432 -17.9432 -17.9405 -17.9405 -15.9360 -15.9360 -15.9324 -15.9324 -15.7033 -15.7033 -15.7033 -15.7033 -0.3874 -0.3874 -0.3841 -0.3841 8.5851 8.5851 8.5858 8.5858 9.7857 9.7857 9.7858 9.7858 9.7949 9.7949 9.7960 9.7960 15.9064 15.9064 15.9076 15.9076 15.9161 15.9161 15.9166 15.9166 16.6128 16.6128 16.6145 16.6145 k = 0.0175 0.0101 0.2651 ( 2054 PWs) bands (ev): -40.4674 -40.4674 -40.4674 -40.4674 -17.9448 -17.9448 -17.9396 -17.9396 -15.9381 -15.9381 -15.9308 -15.9308 -15.7042 -15.7042 -15.7042 -15.7042 -0.3873 -0.3873 -0.3808 -0.3808 8.5860 8.5860 8.5874 8.5874 9.7847 9.7847 9.7858 9.7858 9.7961 9.7961 9.7973 9.7973 15.9007 15.9007 15.9015 15.9015 15.9133 15.9133 15.9158 15.9158 16.6163 16.6163 16.6197 16.6197 k = 0.0263 0.0152 0.2651 ( 2050 PWs) bands (ev): -40.4671 -40.4671 -40.4671 -40.4671 -17.9468 -17.9468 -17.9389 -17.9389 -15.9404 -15.9404 -15.9294 -15.9294 -15.7057 -15.7057 -15.7056 -15.7056 -0.3861 -0.3861 -0.3764 -0.3764 8.5878 8.5878 8.5898 8.5898 9.7821 9.7821 9.7851 9.7851 9.7992 9.7992 9.7999 9.7999 15.8903 15.8903 15.8909 15.8909 15.9097 15.9097 15.9150 15.9150 16.6226 16.6226 16.6278 16.6278 k = 0.0351 0.0203 0.2651 ( 2050 PWs) bands (ev): -40.4668 -40.4668 -40.4668 -40.4668 -17.9489 -17.9489 -17.9385 -17.9385 -15.9430 -15.9430 -15.9283 -15.9283 -15.7078 -15.7078 -15.7076 -15.7076 -0.3839 -0.3839 -0.3709 -0.3709 8.5903 8.5903 8.5930 8.5930 9.7783 9.7783 9.7832 9.7832 9.8041 9.8041 9.8043 9.8043 15.8744 15.8744 15.8763 15.8763 15.9057 15.9057 15.9140 15.9140 16.6317 16.6317 16.6387 16.6387 k = 0.0439 0.0253 0.2651 ( 2052 PWs) bands (ev): -40.4664 -40.4664 -40.4664 -40.4664 -17.9513 -17.9513 -17.9384 -17.9384 -15.9457 -15.9457 -15.9273 -15.9273 -15.7105 -15.7105 -15.7102 -15.7102 -0.3805 -0.3805 -0.3643 -0.3643 8.5935 8.5935 8.5969 8.5969 9.7735 9.7735 9.7803 9.7803 9.8101 9.8101 9.8110 9.8110 15.8540 15.8540 15.8570 15.8570 15.9016 15.9016 15.9125 15.9125 16.6434 16.6434 16.6522 16.6522 k = 0.0526 0.0304 0.2651 ( 2052 PWs) bands (ev): -40.4659 -40.4659 -40.4659 -40.4659 -17.9539 -17.9539 -17.9385 -17.9385 -15.9486 -15.9486 -15.9264 -15.9264 -15.7138 -15.7138 -15.7132 -15.7132 -0.3761 -0.3761 -0.3568 -0.3568 8.5974 8.5974 8.6015 8.6015 9.7681 9.7681 9.7766 9.7766 9.8177 9.8177 9.8193 9.8193 15.8293 15.8293 15.8333 15.8333 15.8971 15.8971 15.9106 15.9106 16.6576 16.6576 16.6682 16.6682 k = 0.0614 0.0355 0.2651 ( 2052 PWs) bands (ev): -40.4653 -40.4653 -40.4653 -40.4653 -17.9567 -17.9567 -17.9388 -17.9388 -15.9517 -15.9517 -15.9258 -15.9258 -15.7177 -15.7177 -15.7168 -15.7168 -0.3706 -0.3706 -0.3482 -0.3482 8.6018 8.6018 8.6066 8.6066 9.7623 9.7623 9.7723 9.7723 9.8268 9.8268 9.8290 9.8290 15.8004 15.8004 15.8054 15.8054 15.8925 15.8925 15.9084 15.9084 16.6739 16.6739 16.6863 16.6863 k = 0.0702 0.0405 0.2651 ( 2052 PWs) bands (ev): -40.4646 -40.4646 -40.4646 -40.4646 -17.9598 -17.9598 -17.9395 -17.9395 -15.9551 -15.9551 -15.9254 -15.9254 -15.7221 -15.7221 -15.7207 -15.7207 -0.3641 -0.3641 -0.3388 -0.3388 8.6067 8.6067 8.6122 8.6122 9.7563 9.7563 9.7677 9.7677 9.8373 9.8373 9.8400 9.8400 15.7675 15.7675 15.7733 15.7733 15.8878 15.8878 15.9060 15.9060 16.6920 16.6920 16.7063 16.7063 k = 0.0789 0.0456 0.2651 ( 2052 PWs) bands (ev): -40.4639 -40.4639 -40.4639 -40.4639 -17.9630 -17.9630 -17.9404 -17.9404 -15.9587 -15.9587 -15.9252 -15.9252 -15.7271 -15.7271 -15.7251 -15.7251 -0.3566 -0.3566 -0.3284 -0.3284 8.6119 8.6119 8.6181 8.6181 9.7504 9.7504 9.7631 9.7631 9.8492 9.8492 9.8524 9.8524 15.7309 15.7309 15.7375 15.7375 15.8831 15.8831 15.9035 15.9035 16.7116 16.7116 16.7278 16.7278 k = 0.0877 0.0506 0.2651 ( 2060 PWs) bands (ev): -40.4631 -40.4631 -40.4631 -40.4631 -17.9665 -17.9665 -17.9415 -17.9415 -15.9625 -15.9625 -15.9251 -15.9251 -15.7325 -15.7325 -15.7299 -15.7299 -0.3482 -0.3482 -0.3171 -0.3171 8.6172 8.6172 8.6242 8.6242 9.7448 9.7448 9.7587 9.7587 9.8623 9.8623 9.8660 9.8660 15.6907 15.6907 15.6980 15.6980 15.8785 15.8785 15.9010 15.9010 16.7322 16.7322 16.7502 16.7502 k = 0.0965 0.0557 0.2651 ( 2060 PWs) bands (ev): -40.4622 -40.4622 -40.4622 -40.4622 -17.9701 -17.9701 -17.9430 -17.9430 -15.9666 -15.9666 -15.9253 -15.9253 -15.7384 -15.7384 -15.7349 -15.7349 -0.3389 -0.3389 -0.3051 -0.3051 8.6226 8.6226 8.6304 8.6304 9.7400 9.7400 9.7549 9.7549 9.8767 9.8767 9.8808 9.8808 15.6472 15.6472 15.6552 15.6552 15.8742 15.8742 15.8988 15.8988 16.7533 16.7533 16.7731 16.7731 k = 0.1053 0.0608 0.2651 ( 2068 PWs) bands (ev): -40.4613 -40.4613 -40.4613 -40.4613 -17.9739 -17.9739 -17.9447 -17.9447 -15.9709 -15.9709 -15.9258 -15.9258 -15.7448 -15.7448 -15.7403 -15.7403 -0.3287 -0.3287 -0.2923 -0.2923 8.6279 8.6279 8.6364 8.6364 9.7360 9.7360 9.7519 9.7519 9.8921 9.8921 9.8967 9.8967 15.6008 15.6008 15.6094 15.6094 15.8704 15.8704 15.8970 15.8970 16.7745 16.7745 16.7960 16.7960 k = 0.1140 0.0658 0.2651 ( 2060 PWs) bands (ev): -40.4601 -40.4601 -40.4601 -40.4601 -17.9779 -17.9779 -17.9466 -17.9466 -15.9755 -15.9755 -15.9264 -15.9264 -15.7514 -15.7514 -15.7459 -15.7459 -0.3178 -0.3178 -0.2789 -0.2789 8.6329 8.6329 8.6422 8.6422 9.7334 9.7334 9.7500 9.7500 9.9087 9.9087 9.9137 9.9137 15.5519 15.5519 15.5610 15.5610 15.8673 15.8673 15.8957 15.8957 16.7951 16.7951 16.8183 16.8183 k = 0.1228 0.0709 0.2651 ( 2060 PWs) bands (ev): -40.4589 -40.4589 -40.4589 -40.4589 -17.9821 -17.9821 -17.9489 -17.9489 -15.9804 -15.9804 -15.9274 -15.9274 -15.7585 -15.7585 -15.7516 -15.7516 -0.3061 -0.3061 -0.2649 -0.2649 8.6375 8.6375 8.6475 8.6475 9.7322 9.7322 9.7495 9.7495 9.9262 9.9262 9.9317 9.9317 15.5007 15.5007 15.5103 15.5103 15.8649 15.8649 15.8952 15.8952 16.8148 16.8148 16.8395 16.8395 k = 0.1316 0.0760 0.2651 ( 2056 PWs) bands (ev): -40.4577 -40.4577 -40.4577 -40.4577 -17.9864 -17.9864 -17.9514 -17.9514 -15.9855 -15.9855 -15.9286 -15.9286 -15.7658 -15.7658 -15.7576 -15.7576 -0.2938 -0.2938 -0.2503 -0.2503 8.6414 8.6414 8.6523 8.6523 9.7328 9.7328 9.7507 9.7507 9.9447 9.9447 9.9505 9.9505 15.4476 15.4476 15.4576 15.4576 15.8635 15.8635 15.8955 15.8955 16.8330 16.8330 16.8592 16.8592 k = 0.1404 0.0810 0.2651 ( 2056 PWs) bands (ev): -40.4564 -40.4564 -40.4564 -40.4564 -17.9909 -17.9909 -17.9541 -17.9541 -15.9909 -15.9909 -15.9301 -15.9301 -15.7732 -15.7732 -15.7636 -15.7636 -0.2808 -0.2808 -0.2352 -0.2352 8.6447 8.6447 8.6563 8.6563 9.7355 9.7355 9.7538 9.7538 9.9639 9.9639 9.9702 9.9702 15.3930 15.3930 15.4034 15.4034 15.8633 15.8633 15.8969 15.8969 16.8494 16.8494 16.8768 16.8768 k = 0.1491 0.0861 0.2651 ( 2056 PWs) bands (ev): -40.4550 -40.4550 -40.4550 -40.4550 -17.9956 -17.9956 -17.9571 -17.9571 -15.9966 -15.9966 -15.9320 -15.9320 -15.7809 -15.7809 -15.7697 -15.7697 -0.2673 -0.2673 -0.2197 -0.2197 8.6471 8.6471 8.6595 8.6595 9.7404 9.7404 9.7590 9.7590 9.9839 9.9839 9.9906 9.9906 15.3372 15.3372 15.3479 15.3479 15.8643 15.8643 15.8995 15.8995 16.8636 16.8636 16.8921 16.8921 k = 0.1579 0.0912 0.2651 ( 2052 PWs) bands (ev): -40.4536 -40.4536 -40.4535 -40.4535 -18.0003 -18.0003 -17.9604 -17.9604 -16.0025 -16.0025 -15.9343 -15.9343 -15.7886 -15.7886 -15.7757 -15.7757 -0.2533 -0.2533 -0.2039 -0.2039 8.6486 8.6486 8.6618 8.6618 9.7477 9.7477 9.7665 9.7665 10.0046 10.0046 10.0116 10.0116 15.2806 15.2806 15.2916 15.2916 15.8669 15.8669 15.9035 15.9035 16.8754 16.8754 16.9048 16.9048 k = 0.1667 0.0962 0.2651 ( 2056 PWs) bands (ev): -40.4522 -40.4522 -40.4522 -40.4522 -18.0052 -18.0052 -17.9639 -17.9639 -16.0087 -16.0087 -15.9371 -15.9371 -15.7962 -15.7962 -15.7818 -15.7818 -0.2388 -0.2388 -0.1878 -0.1878 8.6491 8.6491 8.6631 8.6631 9.7575 9.7575 9.7764 9.7764 10.0258 10.0258 10.0331 10.0331 15.2236 15.2236 15.2348 15.2348 15.8710 15.8710 15.9091 15.9091 16.8845 16.8845 16.9147 16.9147 k = 0.1754 0.1013 0.2651 ( 2052 PWs) bands (ev): -40.4506 -40.4506 -40.4506 -40.4506 -18.0102 -18.0102 -17.9676 -17.9676 -16.0152 -16.0152 -15.9403 -15.9403 -15.8037 -15.8037 -15.7878 -15.7878 -0.2241 -0.2241 -0.1715 -0.1715 8.6487 8.6487 8.6634 8.6634 9.7699 9.7700 9.7888 9.7888 10.0474 10.0474 10.0551 10.0551 15.1665 15.1665 15.1779 15.1779 15.8770 15.8770 15.9164 15.9164 16.8909 16.8909 16.9216 16.9216 k = 0.1842 0.1064 0.2651 ( 2052 PWs) bands (ev): -40.4490 -40.4490 -40.4490 -40.4490 -18.0153 -18.0153 -17.9716 -17.9716 -16.0220 -16.0220 -15.9441 -15.9441 -15.8111 -15.8111 -15.7936 -15.7936 -0.2090 -0.2090 -0.1551 -0.1551 8.6473 8.6473 8.6626 8.6626 9.7850 9.7850 9.8036 9.8036 10.0694 10.0694 10.0774 10.0774 15.1096 15.1096 15.1211 15.1211 15.8849 15.8849 15.9255 15.9255 16.8946 16.8946 16.9257 16.9257 k = 0.1930 0.1114 0.2651 ( 2050 PWs) bands (ev): -40.4474 -40.4474 -40.4474 -40.4474 -18.0205 -18.0205 -17.9758 -17.9758 -16.0290 -16.0290 -15.9485 -15.9485 -15.8181 -15.8181 -15.7994 -15.7994 -0.1937 -0.1937 -0.1387 -0.1387 8.6449 8.6449 8.6609 8.6609 9.8025 9.8025 9.8210 9.8210 10.0917 10.0917 10.0999 10.0999 15.0534 15.0534 15.0650 15.0650 15.8949 15.8949 15.9367 15.9367 16.8956 16.8956 16.9269 16.9269 k = 0.2018 0.1165 0.2651 ( 2050 PWs) bands (ev): -40.4458 -40.4458 -40.4458 -40.4458 -18.0258 -18.0258 -17.9802 -17.9802 -16.0362 -16.0362 -15.9534 -15.9534 -15.8248 -15.8248 -15.8049 -15.8049 -0.1782 -0.1782 -0.1222 -0.1222 8.6417 8.6417 8.6583 8.6583 9.8225 9.8225 9.8407 9.8407 10.1141 10.1141 10.1227 10.1227 14.9982 14.9982 15.0098 15.0098 15.9071 15.9071 15.9500 15.9500 16.8940 16.8940 16.9254 16.9254 k = 0.2105 0.1215 0.2651 ( 2050 PWs) bands (ev): -40.4442 -40.4442 -40.4442 -40.4442 -18.0311 -18.0311 -17.9848 -17.9848 -16.0436 -16.0436 -15.9591 -15.9591 -15.8311 -15.8311 -15.8103 -15.8103 -0.1626 -0.1626 -0.1058 -0.1058 8.6378 8.6378 8.6549 8.6549 9.8448 9.8448 9.8627 9.8627 10.1367 10.1367 10.1454 10.1454 14.9442 14.9442 14.9559 14.9559 15.9216 15.9216 15.9656 15.9656 16.8901 16.8901 16.9215 16.9215 k = 0.2193 0.1266 0.2651 ( 2040 PWs) bands (ev): -40.4423 -40.4423 -40.4423 -40.4423 -18.0365 -18.0365 -17.9896 -17.9896 -16.0512 -16.0512 -15.9653 -15.9653 -15.8368 -15.8368 -15.8155 -15.8155 -0.1470 -0.1470 -0.0896 -0.0896 8.6333 8.6333 8.6507 8.6507 9.8692 9.8692 9.8867 9.8867 10.1592 10.1592 10.1681 10.1681 14.8919 14.8919 14.9035 14.9035 15.9387 15.9387 15.9836 15.9836 16.8841 16.8841 16.9152 16.9152 k = 0.2281 0.1317 0.2651 ( 2038 PWs) bands (ev): -40.4406 -40.4406 -40.4406 -40.4406 -18.0419 -18.0419 -17.9946 -17.9946 -16.0589 -16.0589 -15.9722 -15.9722 -15.8421 -15.8421 -15.8205 -15.8205 -0.1314 -0.1314 -0.0735 -0.0735 8.6283 8.6283 8.6460 8.6460 9.8954 9.8954 9.9126 9.9126 10.1816 10.1816 10.1907 10.1907 14.8416 14.8416 14.8532 14.8532 15.9582 15.9582 16.0040 16.0040 16.8761 16.8761 16.9070 16.9070 k = 0.2368 0.1367 0.2651 ( 2038 PWs) bands (ev): -40.4389 -40.4389 -40.4389 -40.4389 -18.0473 -18.0473 -17.9997 -17.9997 -16.0668 -16.0668 -15.9798 -15.9798 -15.8468 -15.8468 -15.8252 -15.8252 -0.1158 -0.1158 -0.0577 -0.0577 8.6229 8.6229 8.6409 8.6409 9.9233 9.9233 9.9400 9.9400 10.2038 10.2038 10.2131 10.2131 14.7935 14.7935 14.8050 14.8050 15.9803 15.9803 16.0269 16.0269 16.8664 16.8664 16.8969 16.8969 k = 0.2456 0.1418 0.2651 ( 2038 PWs) bands (ev): -40.4372 -40.4372 -40.4372 -40.4372 -18.0527 -18.0527 -18.0050 -18.0050 -16.0747 -16.0747 -15.9878 -15.9878 -15.8511 -15.8511 -15.8297 -15.8297 -0.1004 -0.1004 -0.0422 -0.0422 8.6173 8.6173 8.6355 8.6355 9.9526 9.9526 9.9688 9.9688 10.2257 10.2257 10.2352 10.2352 14.7481 14.7481 14.7595 14.7595 16.0051 16.0051 16.0525 16.0525 16.8553 16.8553 16.8854 16.8854 k = 0.2544 0.1469 0.2651 ( 2040 PWs) bands (ev): -40.4355 -40.4355 -40.4355 -40.4355 -18.0581 -18.0581 -18.0104 -18.0104 -16.0827 -16.0827 -15.9964 -15.9964 -15.8549 -15.8549 -15.8340 -15.8340 -0.0852 -0.0852 -0.0271 -0.0271 8.6116 8.6116 8.6298 8.6299 9.9830 9.9830 9.9987 9.9987 10.2472 10.2472 10.2569 10.2569 14.7055 14.7055 14.7168 14.7168 16.0327 16.0327 16.0807 16.0807 16.8430 16.8430 16.8725 16.8725 k = 0.2632 0.1519 0.2651 ( 2040 PWs) bands (ev): -40.4338 -40.4338 -40.4338 -40.4338 -18.0635 -18.0635 -18.0160 -18.0160 -16.0907 -16.0907 -16.0053 -16.0053 -15.8583 -15.8583 -15.8381 -15.8381 -0.0702 -0.0702 -0.0123 -0.0123 8.6060 8.6060 8.6242 8.6242 10.0141 10.0141 10.0293 10.0293 10.2684 10.2684 10.2781 10.2781 14.6662 14.6662 14.6773 14.6773 16.0630 16.0630 16.1115 16.1115 16.8297 16.8297 16.8587 16.8587 k = 0.2719 0.1570 0.2651 ( 2044 PWs) bands (ev): -40.4321 -40.4321 -40.4321 -40.4321 -18.0688 -18.0688 -18.0216 -18.0216 -16.0987 -16.0987 -16.0146 -16.0146 -15.8613 -15.8613 -15.8419 -15.8419 -0.0554 -0.0554 0.0020 0.0020 8.6004 8.6004 8.6186 8.6186 10.0457 10.0457 10.0604 10.0604 10.2891 10.2891 10.2989 10.2989 14.6303 14.6303 14.6413 14.6413 16.0960 16.0960 16.1450 16.1450 16.8157 16.8157 16.8441 16.8441 k = 0.2807 0.1621 0.2651 ( 2042 PWs) bands (ev): -40.4304 -40.4304 -40.4304 -40.4304 -18.0741 -18.0741 -18.0274 -18.0274 -16.1066 -16.1066 -16.0242 -16.0242 -15.8639 -15.8639 -15.8455 -15.8455 -0.0410 -0.0410 0.0158 0.0158 8.5952 8.5952 8.6131 8.6131 10.0775 10.0775 10.0916 10.0916 10.3092 10.3092 10.3190 10.3190 14.5981 14.5981 14.6090 14.6090 16.1318 16.1318 16.1812 16.1812 16.8011 16.8011 16.8290 16.8290 k = 0.2895 0.1671 0.2651 ( 2030 PWs) bands (ev): -40.4285 -40.4285 -40.4285 -40.4285 -18.0792 -18.0792 -18.0331 -18.0331 -16.1144 -16.1144 -16.0338 -16.0338 -15.8662 -15.8662 -15.8489 -15.8489 -0.0268 -0.0268 0.0291 0.0291 8.5902 8.5902 8.6080 8.6080 10.1091 10.1091 10.1227 10.1227 10.3287 10.3287 10.3386 10.3386 14.5700 14.5700 14.5807 14.5807 16.1704 16.1704 16.2200 16.2200 16.7863 16.7863 16.8135 16.8135 k = 0.2982 0.1722 0.2651 ( 2034 PWs) bands (ev): -40.4269 -40.4269 -40.4269 -40.4269 -18.0843 -18.0843 -18.0390 -18.0390 -16.1221 -16.1221 -16.0437 -16.0437 -15.8683 -15.8683 -15.8520 -15.8520 -0.0131 -0.0131 0.0418 0.0418 8.5857 8.5857 8.6031 8.6031 10.1403 10.1403 10.1534 10.1534 10.3476 10.3476 10.3575 10.3575 14.5459 14.5459 14.5565 14.5565 16.2116 16.2116 16.2613 16.2613 16.7712 16.7712 16.7978 16.7978 k = 0.3070 0.1773 0.2651 ( 2034 PWs) bands (ev): -40.4253 -40.4253 -40.4253 -40.4253 -18.0893 -18.0893 -18.0448 -18.0448 -16.1296 -16.1296 -16.0535 -16.0535 -15.8701 -15.8701 -15.8550 -15.8550 0.0002 0.0002 0.0540 0.0540 8.5816 8.5816 8.5986 8.5986 10.1708 10.1708 10.1833 10.1833 10.3658 10.3658 10.3756 10.3756 14.5262 14.5262 14.5367 14.5367 16.2553 16.2553 16.3051 16.3051 16.7561 16.7561 16.7821 16.7821 k = 0.3158 0.1823 0.2651 ( 2038 PWs) bands (ev): -40.4238 -40.4238 -40.4238 -40.4238 -18.0941 -18.0941 -18.0507 -18.0507 -16.1369 -16.1369 -16.0634 -16.0634 -15.8718 -15.8718 -15.8577 -15.8577 0.0131 0.0131 0.0656 0.0656 8.5780 8.5780 8.5945 8.5945 10.2004 10.2004 10.2123 10.2123 10.3833 10.3833 10.3930 10.3930 14.5110 14.5110 14.5213 14.5213 16.3015 16.3015 16.3511 16.3511 16.7412 16.7412 16.7667 16.7667 k = 0.3246 0.1874 0.2651 ( 2036 PWs) bands (ev): -40.4222 -40.4222 -40.4222 -40.4222 -18.0988 -18.0988 -18.0565 -18.0565 -16.1440 -16.1440 -16.0731 -16.0731 -15.8732 -15.8732 -15.8603 -15.8603 0.0256 0.0256 0.0766 0.0766 8.5749 8.5749 8.5909 8.5909 10.2287 10.2287 10.2401 10.2401 10.4001 10.4001 10.4097 10.4097 14.5004 14.5004 14.5105 14.5105 16.3499 16.3499 16.3991 16.3991 16.7265 16.7265 16.7516 16.7516 k = 0.3333 0.1925 0.2651 ( 2040 PWs) bands (ev): -40.4207 -40.4207 -40.4207 -40.4207 -18.1033 -18.1033 -18.0623 -18.0623 -16.1508 -16.1508 -16.0827 -16.0827 -15.8745 -15.8745 -15.8627 -15.8627 0.0375 0.0375 0.0870 0.0870 8.5723 8.5723 8.5878 8.5878 10.2556 10.2556 10.2664 10.2664 10.4160 10.4160 10.4255 10.4255 14.4944 14.4944 14.5044 14.5044 16.4004 16.4004 16.4489 16.4489 16.7123 16.7123 16.7371 16.7371 k = 0.3421 0.1975 0.2651 ( 2036 PWs) bands (ev): -40.4192 -40.4192 -40.4192 -40.4192 -18.1077 -18.1077 -18.0680 -18.0680 -16.1573 -16.1573 -16.0922 -16.0922 -15.8757 -15.8757 -15.8649 -15.8649 0.0490 0.0490 0.0967 0.0967 8.5702 8.5702 8.5851 8.5851 10.2810 10.2810 10.2912 10.2912 10.4313 10.4313 10.4405 10.4405 14.4930 14.4930 14.5028 14.5028 16.4527 16.4527 16.4999 16.4999 16.6988 16.6988 16.7237 16.7237 k = 0.3509 0.2026 0.2651 ( 2042 PWs) bands (ev): -40.4179 -40.4179 -40.4179 -40.4179 -18.1118 -18.1118 -18.0737 -18.0737 -16.1634 -16.1634 -16.1015 -16.1015 -15.8768 -15.8768 -15.8669 -15.8669 0.0600 0.0600 0.1058 0.1058 8.5687 8.5687 8.5829 8.5829 10.3046 10.3046 10.3143 10.3143 10.4457 10.4457 10.4547 10.4547 14.4960 14.4960 14.5057 14.5057 16.5062 16.5062 16.5511 16.5511 16.6863 16.6863 16.7123 16.7123 k = 0.3596 0.2076 0.2651 ( 2042 PWs) bands (ev): -40.4165 -40.4165 -40.4165 -40.4165 -18.1157 -18.1157 -18.0792 -18.0792 -16.1693 -16.1693 -16.1105 -16.1105 -15.8777 -15.8777 -15.8688 -15.8688 0.0704 0.0704 0.1143 0.1143 8.5676 8.5676 8.5812 8.5812 10.3264 10.3264 10.3355 10.3355 10.4593 10.4593 10.4681 10.4681 14.5034 14.5034 14.5130 14.5130 16.5597 16.5597 16.5993 16.5993 16.6759 16.6759 16.7057 16.7057 k = 0.3684 0.2127 0.2651 ( 2046 PWs) bands (ev): -40.4153 -40.4153 -40.4153 -40.4153 -18.1194 -18.1194 -18.0846 -18.0846 -16.1747 -16.1747 -16.1192 -16.1192 -15.8785 -15.8785 -15.8705 -15.8705 0.0804 0.0804 0.1221 0.1221 8.5671 8.5671 8.5799 8.5799 10.3463 10.3463 10.3548 10.3548 10.4721 10.4721 10.4806 10.4806 14.5149 14.5149 14.5243 14.5243 16.6079 16.6079 16.6341 16.6341 16.6726 16.6726 16.7142 16.7142 k = 0.3772 0.2178 0.2651 ( 2050 PWs) bands (ev): -40.4141 -40.4141 -40.4141 -40.4141 -18.1228 -18.1228 -18.0899 -18.0899 -16.1798 -16.1798 -16.1276 -16.1276 -15.8793 -15.8793 -15.8721 -15.8721 0.0898 0.0898 0.1292 0.1292 8.5669 8.5669 8.5790 8.5790 10.3643 10.3643 10.3722 10.3722 10.4841 10.4841 10.4922 10.4922 14.5303 14.5303 14.5395 14.5395 16.6292 16.6292 16.6431 16.6431 16.6977 16.6977 16.7499 16.7499 k = 0.3860 0.2228 0.2651 ( 2048 PWs) bands (ev): -40.4129 -40.4129 -40.4129 -40.4129 -18.1260 -18.1260 -18.0950 -18.0950 -16.1844 -16.1844 -16.1357 -16.1357 -15.8800 -15.8800 -15.8735 -15.8735 0.0986 0.0986 0.1357 0.1357 8.5671 8.5671 8.5784 8.5784 10.3805 10.3805 10.3878 10.3878 10.4953 10.4953 10.5030 10.5030 14.5490 14.5490 14.5581 14.5581 16.6260 16.6260 16.6384 16.6384 16.7487 16.7487 16.8003 16.8003 k = 0.3947 0.2279 0.2651 ( 2040 PWs) bands (ev): -40.4117 -40.4117 -40.4117 -40.4117 -18.1289 -18.1289 -18.0999 -18.0999 -16.1886 -16.1886 -16.1434 -16.1434 -15.8806 -15.8806 -15.8749 -15.8749 0.1070 0.1070 0.1416 0.1416 8.5677 8.5677 8.5782 8.5782 10.3948 10.3948 10.4016 10.4016 10.5056 10.5056 10.5129 10.5129 14.5707 14.5707 14.5796 14.5796 16.6181 16.6181 16.6301 16.6301 16.8051 16.8051 16.8548 16.8548 k = 0.4035 0.2330 0.2651 ( 2032 PWs) bands (ev): -40.4105 -40.4105 -40.4105 -40.4105 -18.1314 -18.1314 -18.1046 -18.1046 -16.1924 -16.1924 -16.1507 -16.1507 -15.8811 -15.8811 -15.8760 -15.8760 0.1147 0.1147 0.1468 0.1468 8.5686 8.5686 8.5782 8.5782 10.4074 10.4074 10.4135 10.4135 10.5150 10.5150 10.5219 10.5219 14.5948 14.5948 14.6034 14.6034 16.6096 16.6096 16.6211 16.6211 16.8625 16.8625 16.9100 16.9100 k = 0.4123 0.2380 0.2651 ( 2038 PWs) bands (ev): -40.4097 -40.4097 -40.4097 -40.4097 -18.1337 -18.1337 -18.1091 -18.1091 -16.1957 -16.1957 -16.1577 -16.1577 -15.8816 -15.8816 -15.8771 -15.8771 0.1220 0.1220 0.1514 0.1514 8.5696 8.5696 8.5784 8.5784 10.4183 10.4183 10.4239 10.4239 10.5236 10.5236 10.5299 10.5299 14.6207 14.6207 14.6290 14.6290 16.6014 16.6014 16.6123 16.6123 16.9194 16.9194 16.9646 16.9646 k = 0.4211 0.2431 0.2651 ( 2034 PWs) bands (ev): -40.4087 -40.4087 -40.4087 -40.4087 -18.1357 -18.1357 -18.1133 -18.1133 -16.1986 -16.1986 -16.1642 -16.1642 -15.8819 -15.8819 -15.8781 -15.8781 0.1287 0.1287 0.1554 0.1554 8.5709 8.5709 8.5788 8.5788 10.4277 10.4277 10.4327 10.4327 10.5313 10.5313 10.5371 10.5371 14.6477 14.6477 14.6556 14.6556 16.5938 16.5938 16.6038 16.6038 16.9749 16.9749 17.0176 17.0176 k = 0.4298 0.2482 0.2651 ( 2030 PWs) bands (ev): -40.4079 -40.4079 -40.4079 -40.4079 -18.1374 -18.1374 -18.1173 -18.1173 -16.2009 -16.2009 -16.1703 -16.1703 -15.8823 -15.8823 -15.8790 -15.8790 0.1348 0.1348 0.1588 0.1588 8.5722 8.5722 8.5793 8.5793 10.4357 10.4357 10.4402 10.4402 10.5382 10.5382 10.5434 10.5434 14.6750 14.6750 14.6824 14.6824 16.5869 16.5869 16.5960 16.5960 17.0283 17.0283 17.0681 17.0681 k = 0.4386 0.2532 0.2651 ( 2032 PWs) bands (ev): -40.4072 -40.4072 -40.4072 -40.4072 -18.1387 -18.1387 -18.1210 -18.1210 -16.2028 -16.2028 -16.1759 -16.1759 -15.8825 -15.8825 -15.8797 -15.8797 0.1405 0.1405 0.1615 0.1615 8.5736 8.5736 8.5798 8.5798 10.4425 10.4425 10.4463 10.4463 10.5443 10.5443 10.5489 10.5489 14.7019 14.7019 14.7086 14.7086 16.5808 16.5808 16.5889 16.5889 17.0788 17.0788 17.1152 17.1152 k = 0.4474 0.2583 0.2651 ( 2036 PWs) bands (ev): -40.4067 -40.4067 -40.4067 -40.4067 -18.1397 -18.1397 -18.1244 -18.1244 -16.2042 -16.2042 -16.1811 -16.1811 -15.8828 -15.8828 -15.8804 -15.8804 0.1455 0.1455 0.1637 0.1637 8.5750 8.5750 8.5803 8.5803 10.4480 10.4480 10.4513 10.4513 10.5495 10.5495 10.5535 10.5535 14.7274 14.7274 14.7335 14.7335 16.5755 16.5755 16.5826 16.5826 17.1254 17.1254 17.1581 17.1581 k = 0.4561 0.2634 0.2651 ( 2044 PWs) bands (ev): -40.4063 -40.4063 -40.4063 -40.4063 -18.1403 -18.1403 -18.1276 -18.1276 -16.2051 -16.2051 -16.1858 -16.1858 -15.8829 -15.8829 -15.8810 -15.8810 0.1501 0.1501 0.1653 0.1653 8.5763 8.5763 8.5808 8.5808 10.4526 10.4526 10.4553 10.4553 10.5540 10.5540 10.5573 10.5573 14.7509 14.7509 14.7562 14.7562 16.5711 16.5711 16.5771 16.5771 17.1674 17.1674 17.1958 17.1958 k = 0.4649 0.2684 0.2651 ( 2044 PWs) bands (ev): -40.4059 -40.4059 -40.4059 -40.4059 -18.1406 -18.1406 -18.1304 -18.1304 -16.2054 -16.2054 -16.1900 -16.1900 -15.8830 -15.8830 -15.8815 -15.8815 0.1540 0.1540 0.1663 0.1663 8.5776 8.5776 8.5811 8.5811 10.4562 10.4562 10.4584 10.4584 10.5576 10.5576 10.5603 10.5603 14.7715 14.7715 14.7759 14.7759 16.5675 16.5675 16.5724 16.5724 17.2040 17.2040 17.2275 17.2275 k = 0.4737 0.2735 0.2651 ( 2040 PWs) bands (ev): -40.4055 -40.4055 -40.4055 -40.4055 -18.1406 -18.1406 -18.1328 -18.1328 -16.2053 -16.2053 -16.1937 -16.1937 -15.8831 -15.8831 -15.8820 -15.8820 0.1575 0.1575 0.1667 0.1667 8.5787 8.5787 8.5814 8.5814 10.4589 10.4589 10.4606 10.4606 10.5605 10.5605 10.5626 10.5626 14.7886 14.7886 14.7920 14.7920 16.5649 16.5649 16.5686 16.5686 17.2343 17.2343 17.2525 17.2525 k = 0.4825 0.2785 0.2651 ( 2044 PWs) bands (ev): -40.4053 -40.4053 -40.4053 -40.4053 -18.1402 -18.1402 -18.1350 -18.1350 -16.2046 -16.2046 -16.1969 -16.1969 -15.8830 -15.8830 -15.8823 -15.8823 0.1604 0.1604 0.1665 0.1665 8.5796 8.5796 8.5814 8.5814 10.4609 10.4609 10.4620 10.4620 10.5627 10.5627 10.5641 10.5641 14.8014 14.8014 14.8037 14.8037 16.5632 16.5632 16.5657 16.5657 17.2575 17.2575 17.2699 17.2699 k = 0.4912 0.2836 0.2651 ( 2048 PWs) bands (ev): -40.4052 -40.4052 -40.4052 -40.4052 -18.1394 -18.1394 -18.1368 -18.1368 -16.2035 -16.2035 -16.1996 -16.1996 -15.8830 -15.8830 -15.8826 -15.8826 0.1628 0.1628 0.1658 0.1658 8.5804 8.5804 8.5813 8.5813 10.4622 10.4622 10.4628 10.4628 10.5641 10.5641 10.5648 10.5648 14.8095 14.8095 14.8107 14.8107 16.5624 16.5624 16.5637 16.5637 17.2729 17.2729 17.2792 17.2792 k = 0.5000 0.2887 0.2651 ( 2044 PWs) bands (ev): -40.4051 -40.4051 -40.4051 -40.4051 -18.1383 -18.1383 -18.1383 -18.1383 -16.2018 -16.2018 -16.2018 -16.2018 -15.8828 -15.8828 -15.8828 -15.8828 0.1646 0.1646 0.1646 0.1646 8.5809 8.5809 8.5809 8.5809 10.4628 10.4628 10.4628 10.4628 10.5648 10.5648 10.5648 10.5648 14.8126 14.8126 14.8126 14.8126 16.5626 16.5626 16.5626 16.5626 17.2803 17.2803 17.2803 17.2803 k = 0.5000 0.2887 0.2651 ( 2044 PWs) bands (ev): -40.4051 -40.4051 -40.4051 -40.4051 -18.1383 -18.1383 -18.1383 -18.1383 -16.2018 -16.2018 -16.2018 -16.2018 -15.8828 -15.8828 -15.8828 -15.8828 0.1646 0.1646 0.1646 0.1646 8.5809 8.5809 8.5809 8.5809 10.4628 10.4628 10.4628 10.4628 10.5648 10.5648 10.5648 10.5648 14.8126 14.8126 14.8126 14.8126 16.5626 16.5626 16.5626 16.5626 17.2803 17.2803 17.2803 17.2803 k = 0.4949 0.2974 0.2651 ( 2048 PWs) bands (ev): -40.4052 -40.4052 -40.4052 -40.4052 -18.1402 -18.1402 -18.1364 -18.1364 -16.2044 -16.2044 -16.1990 -16.1990 -15.8837 -15.8837 -15.8823 -15.8823 0.1625 0.1625 0.1671 0.1671 8.5809 8.5809 8.5835 8.5835 10.4425 10.4425 10.4731 10.4731 10.5543 10.5543 10.5845 10.5845 14.8103 14.8103 14.8132 14.8132 16.5580 16.5580 16.5623 16.5623 17.2788 17.2788 17.2823 17.2823 k = 0.4899 0.3062 0.2651 ( 2048 PWs) bands (ev): -40.4051 -40.4051 -40.4051 -40.4051 -18.1421 -18.1421 -18.1345 -18.1345 -16.2070 -16.2070 -16.1962 -16.1962 -15.8851 -15.8851 -15.8823 -15.8823 0.1608 0.1608 0.1701 0.1701 8.5834 8.5834 8.5887 8.5887 10.4180 10.4180 10.4662 10.4662 10.5598 10.5598 10.6072 10.6072 14.8063 14.8063 14.8120 14.8120 16.5487 16.5487 16.5571 16.5571 17.2781 17.2781 17.2849 17.2849 k = 0.4848 0.3149 0.2651 ( 2044 PWs) bands (ev): -40.4050 -40.4050 -40.4050 -40.4050 -18.1441 -18.1441 -18.1327 -18.1327 -16.2095 -16.2095 -16.1933 -16.1933 -15.8868 -15.8868 -15.8826 -15.8826 0.1595 0.1595 0.1734 0.1734 8.5884 8.5884 8.5963 8.5963 10.3914 10.3914 10.4467 10.4467 10.5769 10.5769 10.6309 10.6309 14.8004 14.8004 14.8089 14.8089 16.5347 16.5347 16.5471 16.5471 17.2780 17.2780 17.2883 17.2883 k = 0.4798 0.3237 0.2651 ( 2044 PWs) bands (ev): -40.4049 -40.4049 -40.4049 -40.4049 -18.1461 -18.1461 -18.1309 -18.1309 -16.2120 -16.2120 -16.1903 -16.1903 -15.8890 -15.8890 -15.8834 -15.8834 0.1587 0.1587 0.1772 0.1772 8.5960 8.5960 8.6065 8.6065 10.3636 10.3636 10.4217 10.4217 10.5986 10.5986 10.6549 10.6549 14.7927 14.7927 14.8040 14.8040 16.5163 16.5163 16.5326 16.5326 17.2786 17.2786 17.2922 17.2922 k = 0.4747 0.3324 0.2651 ( 2040 PWs) bands (ev): -40.4047 -40.4047 -40.4047 -40.4047 -18.1480 -18.1480 -18.1291 -18.1291 -16.2144 -16.2144 -16.1872 -16.1872 -15.8915 -15.8915 -15.8846 -15.8846 0.1583 0.1583 0.1813 0.1813 8.6059 8.6059 8.6191 8.6191 10.3350 10.3350 10.3942 10.3942 10.6220 10.6220 10.6789 10.6789 14.7831 14.7831 14.7971 14.7971 16.4938 16.4938 16.5137 16.5137 17.2799 17.2799 17.2968 17.2968 k = 0.4697 0.3412 0.2651 ( 2046 PWs) bands (ev): -40.4046 -40.4046 -40.4046 -40.4046 -18.1500 -18.1500 -18.1274 -18.1274 -16.2167 -16.2167 -16.1840 -16.1840 -15.8945 -15.8945 -15.8862 -15.8862 0.1583 0.1583 0.1858 0.1858 8.6183 8.6183 8.6340 8.6340 10.3056 10.3056 10.3652 10.3652 10.6460 10.6460 10.7027 10.7027 14.7715 14.7715 14.7881 14.7881 16.4674 16.4674 16.4907 16.4907 17.2819 17.2819 17.3021 17.3021 k = 0.4646 0.3499 0.2651 ( 2042 PWs) bands (ev): -40.4043 -40.4043 -40.4043 -40.4043 -18.1520 -18.1520 -18.1257 -18.1257 -16.2190 -16.2190 -16.1807 -16.1807 -15.8977 -15.8977 -15.8882 -15.8882 0.1587 0.1587 0.1906 0.1906 8.6330 8.6330 8.6512 8.6512 10.2756 10.2756 10.3352 10.3352 10.6704 10.6704 10.7264 10.7264 14.7579 14.7579 14.7769 14.7769 16.4377 16.4377 16.4640 16.4640 17.2848 17.2848 17.3081 17.3081 k = 0.4596 0.3587 0.2651 ( 2046 PWs) bands (ev): -40.4042 -40.4042 -40.4042 -40.4042 -18.1540 -18.1540 -18.1241 -18.1241 -16.2212 -16.2212 -16.1773 -16.1773 -15.9014 -15.9014 -15.8905 -15.8905 0.1595 0.1595 0.1956 0.1956 8.6499 8.6499 8.6706 8.6706 10.2450 10.2450 10.3045 10.3045 10.6950 10.6950 10.7501 10.7501 14.7421 14.7421 14.7635 14.7635 16.4050 16.4050 16.4341 16.4341 17.2884 17.2884 17.3148 17.3148 k = 0.4545 0.3674 0.2651 ( 2042 PWs) bands (ev): -40.4039 -40.4039 -40.4039 -40.4039 -18.1559 -18.1559 -18.1226 -18.1226 -16.2234 -16.2234 -16.1738 -16.1738 -15.9053 -15.9053 -15.8931 -15.8931 0.1607 0.1607 0.2010 0.2010 8.6690 8.6690 8.6920 8.6920 10.2140 10.2140 10.2731 10.2731 10.7199 10.7199 10.7736 10.7736 14.7240 14.7240 14.7477 14.7477 16.3699 16.3699 16.4015 16.4015 17.2927 17.2927 17.3220 17.3220 k = 0.4495 0.3762 0.2651 ( 2048 PWs) bands (ev): -40.4037 -40.4037 -40.4037 -40.4037 -18.1579 -18.1579 -18.1211 -18.1211 -16.2256 -16.2256 -16.1703 -16.1703 -15.9096 -15.9096 -15.8961 -15.8961 0.1621 0.1621 0.2065 0.2065 8.6900 8.6900 8.7154 8.7154 10.1826 10.1826 10.2412 10.2412 10.7450 10.7450 10.7972 10.7972 14.7037 14.7037 14.7294 14.7294 16.3329 16.3329 16.3665 16.3665 17.2978 17.2978 17.3299 17.3299 k = 0.4444 0.3849 0.2651 ( 2044 PWs) bands (ev): -40.4033 -40.4033 -40.4033 -40.4033 -18.1598 -18.1598 -18.1197 -18.1197 -16.2278 -16.2278 -16.1666 -16.1666 -15.9141 -15.9141 -15.8993 -15.8993 0.1639 0.1639 0.2122 0.2122 8.7129 8.7129 8.7405 8.7405 10.1509 10.1509 10.2088 10.2088 10.7704 10.7704 10.8209 10.8209 14.6809 14.6809 14.7086 14.7086 16.2945 16.2945 16.3299 16.3299 17.3035 17.3035 17.3382 17.3382 k = 0.4394 0.3936 0.2651 ( 2048 PWs) bands (ev): -40.4031 -40.4031 -40.4031 -40.4031 -18.1617 -18.1617 -18.1183 -18.1183 -16.2299 -16.2299 -16.1628 -16.1628 -15.9189 -15.9189 -15.9027 -15.9027 0.1659 0.1659 0.2181 0.2181 8.7375 8.7375 8.7673 8.7673 10.1189 10.1189 10.1761 10.1761 10.7961 10.7961 10.8448 10.8448 14.6558 14.6558 14.6853 14.6853 16.2551 16.2551 16.2920 16.2920 17.3098 17.3098 17.3468 17.3468 k = 0.4343 0.4024 0.2651 ( 2048 PWs) bands (ev): -40.4028 -40.4028 -40.4028 -40.4028 -18.1636 -18.1636 -18.1171 -18.1171 -16.2320 -16.2320 -16.1589 -16.1589 -15.9240 -15.9240 -15.9062 -15.9062 0.1682 0.1682 0.2241 0.2241 8.7637 8.7637 8.7956 8.7956 10.0866 10.0866 10.1431 10.1431 10.8222 10.8222 10.8689 10.8689 14.6283 14.6283 14.6595 14.6595 16.2153 16.2153 16.2534 16.2534 17.3164 17.3164 17.3555 17.3555 k = 0.4293 0.4111 0.2651 ( 2040 PWs) bands (ev): -40.4023 -40.4023 -40.4023 -40.4023 -18.1654 -18.1654 -18.1159 -18.1159 -16.2341 -16.2341 -16.1550 -16.1550 -15.9293 -15.9293 -15.9099 -15.9099 0.1707 0.1707 0.2301 0.2301 8.7913 8.7913 8.8252 8.8252 10.0543 10.0543 10.1099 10.1099 10.8489 10.8489 10.8934 10.8934 14.5985 14.5985 14.6314 14.6314 16.1756 16.1756 16.2147 16.2147 17.3233 17.3233 17.3641 17.3641 k = 0.4242 0.4199 0.2651 ( 2044 PWs) bands (ev): -40.4020 -40.4020 -40.4020 -40.4020 -18.1673 -18.1673 -18.1148 -18.1148 -16.2363 -16.2363 -16.1509 -16.1509 -15.9348 -15.9348 -15.9136 -15.9136 0.1733 0.1733 0.2361 0.2361 8.8201 8.8201 8.8559 8.8559 10.0218 10.0218 10.0765 10.0765 10.8760 10.8760 10.9182 10.9182 14.5665 14.5665 14.6009 14.6009 16.1362 16.1362 16.1762 16.1762 17.3300 17.3300 17.3722 17.3722 k = 0.4192 0.4286 0.2651 ( 2044 PWs) bands (ev): -40.4017 -40.4017 -40.4017 -40.4017 -18.1690 -18.1690 -18.1138 -18.1138 -16.2383 -16.2383 -16.1468 -16.1468 -15.9404 -15.9404 -15.9174 -15.9174 0.1761 0.1761 0.2421 0.2421 8.8500 8.8500 8.8876 8.8876 9.9892 9.9892 10.0429 10.0429 10.9036 10.9036 10.9434 10.9434 14.5325 14.5325 14.5683 14.5683 16.0976 16.0976 16.1384 16.1384 17.3365 17.3365 17.3796 17.3796 k = 0.4141 0.4374 0.2651 ( 2048 PWs) bands (ev): -40.4014 -40.4014 -40.4014 -40.4014 -18.1708 -18.1708 -18.1128 -18.1128 -16.2404 -16.2404 -16.1426 -16.1426 -15.9463 -15.9463 -15.9211 -15.9211 0.1790 0.1790 0.2480 0.2480 8.8808 8.8808 8.9200 8.9200 9.9567 9.9567 10.0094 10.0094 10.9317 10.9317 10.9690 10.9690 14.4967 14.4967 14.5339 14.5339 16.0601 16.0601 16.1016 16.1016 17.3424 17.3424 17.3859 17.3859 k = 0.4091 0.4461 0.2651 ( 2052 PWs) bands (ev): -40.4011 -40.4011 -40.4011 -40.4011 -18.1725 -18.1725 -18.1120 -18.1120 -16.2425 -16.2425 -16.1384 -16.1384 -15.9523 -15.9523 -15.9248 -15.9248 0.1820 0.1820 0.2538 0.2538 8.9123 8.9123 8.9530 8.9530 9.9243 9.9243 9.9758 9.9758 10.9603 10.9603 10.9950 10.9950 14.4595 14.4595 14.4980 14.4980 16.0240 16.0240 16.0661 16.0661 17.3476 17.3476 17.3909 17.3909 k = 0.4040 0.4549 0.2651 ( 2048 PWs) bands (ev): -40.4006 -40.4006 -40.4006 -40.4006 -18.1741 -18.1741 -18.1113 -18.1113 -16.2446 -16.2446 -16.1341 -16.1341 -15.9584 -15.9584 -15.9283 -15.9283 0.1849 0.1849 0.2594 0.2594 8.9443 8.9443 8.9865 8.9865 9.8921 9.8921 9.9423 9.9423 10.9892 10.9892 11.0212 11.0212 14.4212 14.4212 14.4609 14.4609 15.9895 15.9895 16.0323 16.0323 17.3517 17.3517 17.3943 17.3943 k = 0.3990 0.4636 0.2651 ( 2048 PWs) bands (ev): -40.4003 -40.4003 -40.4003 -40.4003 -18.1757 -18.1757 -18.1106 -18.1106 -16.2466 -16.2466 -16.1298 -16.1298 -15.9646 -15.9646 -15.9317 -15.9317 0.1879 0.1879 0.2648 0.2648 8.9767 8.9767 9.0202 9.0202 9.8600 9.8600 9.9089 9.9089 11.0185 11.0185 11.0477 11.0477 14.3822 14.3822 14.4232 14.4232 15.9567 15.9567 16.0002 16.0002 17.3547 17.3547 17.3961 17.3961 k = 0.3939 0.4724 0.2651 ( 2044 PWs) bands (ev): -40.3999 -40.3999 -40.3999 -40.3999 -18.1772 -18.1772 -18.1100 -18.1100 -16.2486 -16.2486 -16.1254 -16.1254 -15.9708 -15.9708 -15.9349 -15.9349 0.1908 0.1908 0.2701 0.2701 9.0091 9.0091 9.0540 9.0540 9.8282 9.8282 9.8756 9.8756 11.0478 11.0478 11.0743 11.0743 14.3430 14.3430 14.3852 14.3852 15.9258 15.9258 15.9701 15.9701 17.3564 17.3564 17.3960 17.3960 k = 0.3889 0.4811 0.2651 ( 2044 PWs) bands (ev): -40.3995 -40.3995 -40.3995 -40.3995 -18.1786 -18.1786 -18.1096 -18.1096 -16.2505 -16.2505 -16.1211 -16.1211 -15.9770 -15.9770 -15.9380 -15.9380 0.1936 0.1936 0.2750 0.2750 9.0416 9.0416 9.0877 9.0877 9.7968 9.7968 9.8427 9.8427 11.0770 11.0770 11.1007 11.1007 14.3042 14.3042 14.3475 14.3475 15.8969 15.8969 15.9420 15.9420 17.3568 17.3568 17.3943 17.3943 k = 0.3838 0.4899 0.2651 ( 2048 PWs) bands (ev): -40.3993 -40.3993 -40.3993 -40.3993 -18.1799 -18.1799 -18.1092 -18.1092 -16.2524 -16.2524 -16.1167 -16.1167 -15.9832 -15.9832 -15.9408 -15.9408 0.1964 0.1964 0.2796 0.2796 9.0738 9.0738 9.1212 9.1212 9.7657 9.7657 9.8100 9.8100 11.1057 11.1057 11.1268 11.1268 14.2661 14.2661 14.3107 14.3107 15.8702 15.8702 15.9161 15.9161 17.3559 17.3559 17.3910 17.3910 k = 0.3788 0.4986 0.2651 ( 2052 PWs) bands (ev): -40.3990 -40.3990 -40.3990 -40.3990 -18.1812 -18.1812 -18.1089 -18.1089 -16.2541 -16.2541 -16.1124 -16.1124 -15.9893 -15.9893 -15.9433 -15.9433 0.1989 0.1989 0.2839 0.2839 9.1055 9.1055 9.1543 9.1543 9.7352 9.7352 9.7777 9.7777 11.1337 11.1337 11.1521 11.1521 14.2296 14.2296 14.2752 14.2752 15.8456 15.8456 15.8923 15.8923 17.3540 17.3540 17.3866 17.3866 k = 0.3737 0.5074 0.2651 ( 2054 PWs) bands (ev): -40.3987 -40.3987 -40.3987 -40.3987 -18.1824 -18.1824 -18.1086 -18.1086 -16.2558 -16.2558 -16.1082 -16.1082 -15.9952 -15.9952 -15.9456 -15.9456 0.2013 0.2013 0.2878 0.2878 9.1365 9.1365 9.1868 9.1868 9.7053 9.7053 9.7460 9.7460 11.1606 11.1606 11.1765 11.1765 14.1951 14.1951 14.2417 14.2417 15.8232 15.8232 15.8709 15.8709 17.3511 17.3511 17.3813 17.3813 k = 0.3687 0.5161 0.2651 ( 2058 PWs) bands (ev): -40.3985 -40.3985 -40.3985 -40.3985 -18.1834 -18.1834 -18.1084 -18.1084 -16.2574 -16.2574 -16.1041 -16.1041 -16.0008 -16.0008 -15.9476 -15.9476 0.2035 0.2035 0.2913 0.2913 9.1666 9.1666 9.2187 9.2187 9.6761 9.6761 9.7151 9.7151 11.1860 11.1860 11.1995 11.1995 14.1631 14.1631 14.2107 14.2107 15.8032 15.8032 15.8516 15.8516 17.3476 17.3476 17.3754 17.3754 k = 0.3636 0.5249 0.2651 ( 2058 PWs) bands (ev): -40.3983 -40.3983 -40.3983 -40.3983 -18.1844 -18.1844 -18.1083 -18.1083 -16.2588 -16.2588 -16.1003 -16.1003 -16.0061 -16.0061 -15.9493 -15.9493 0.2055 0.2055 0.2945 0.2945 9.1954 9.1954 9.2497 9.2497 9.6480 9.6480 9.6851 9.6851 11.2093 11.2093 11.2206 11.2206 14.1344 14.1344 14.1828 14.1828 15.7855 15.7855 15.8348 15.8348 17.3437 17.3437 17.3694 17.3694 k = 0.3586 0.5336 0.2651 ( 2054 PWs) bands (ev): -40.3980 -40.3980 -40.3980 -40.3980 -18.1852 -18.1852 -18.1082 -18.1082 -16.2601 -16.2601 -16.0967 -16.0967 -16.0110 -16.0110 -15.9508 -15.9508 0.2073 0.2073 0.2971 0.2971 9.2224 9.2224 9.2795 9.2795 9.6210 9.6210 9.6566 9.6566 11.2302 11.2302 11.2395 11.2395 14.1093 14.1093 14.1584 14.1584 15.7702 15.7702 15.8203 15.8203 17.3397 17.3397 17.3636 17.3636 k = 0.3535 0.5424 0.2651 ( 2058 PWs) bands (ev): -40.3979 -40.3979 -40.3979 -40.3979 -18.1859 -18.1859 -18.1082 -18.1082 -16.2612 -16.2612 -16.0934 -16.0934 -16.0153 -16.0153 -15.9520 -15.9520 0.2087 0.2087 0.2993 0.2993 9.2471 9.2471 9.3077 9.3077 9.5956 9.5956 9.6303 9.6303 11.2481 11.2481 11.2558 11.2558 14.0883 14.0883 14.1380 14.1380 15.7575 15.7575 15.8082 15.8082 17.3358 17.3358 17.3583 17.3583 k = 0.3485 0.5511 0.2651 ( 2062 PWs) bands (ev): -40.3978 -40.3978 -40.3978 -40.3978 -18.1864 -18.1864 -18.1082 -18.1082 -16.2621 -16.2621 -16.0907 -16.0907 -16.0189 -16.0189 -15.9529 -15.9529 0.2099 0.2099 0.3011 0.3011 9.2684 9.2684 9.3334 9.3334 9.5725 9.5725 9.6071 9.6071 11.2626 11.2626 11.2690 11.2690 14.0717 14.0717 14.1219 14.1219 15.7474 15.7474 15.7987 15.7987 17.3323 17.3323 17.3538 17.3538 k = 0.3434 0.5599 0.2651 ( 2062 PWs) bands (ev): -40.3977 -40.3977 -40.3977 -40.3977 -18.1868 -18.1868 -18.1082 -18.1082 -16.2627 -16.2627 -16.0887 -16.0887 -16.0216 -16.0216 -15.9535 -15.9535 0.2107 0.2107 0.3023 0.3023 9.2851 9.2851 9.3553 9.3553 9.5528 9.5528 9.5888 9.5888 11.2732 11.2732 11.2788 11.2788 14.0598 14.0598 14.1104 14.1104 15.7400 15.7400 15.7917 15.7917 17.3296 17.3296 17.3504 17.3504 k = 0.3384 0.5686 0.2651 ( 2056 PWs) bands (ev): -40.3975 -40.3975 -40.3975 -40.3975 -18.1871 -18.1871 -18.1082 -18.1082 -16.2631 -16.2631 -16.0874 -16.0874 -16.0233 -16.0233 -15.9539 -15.9539 0.2112 0.2112 0.3031 0.3031 9.2960 9.2960 9.3708 9.3708 9.5386 9.5386 9.5768 9.5768 11.2798 11.2798 11.2848 11.2848 14.0527 14.0527 14.1035 14.1035 15.7354 15.7354 15.7875 15.7875 17.3278 17.3278 17.3482 17.3482 k = 0.3333 0.5774 0.2651 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.1871 -18.1871 -18.1082 -18.1082 -16.2632 -16.2632 -16.0870 -16.0870 -16.0239 -16.0239 -15.9540 -15.9540 0.2114 0.2114 0.3034 0.3034 9.2997 9.2997 9.3766 9.3766 9.5333 9.5333 9.5727 9.5727 11.2820 11.2820 11.2869 11.2869 14.0504 14.0504 14.1012 14.1012 15.7339 15.7339 15.7860 15.7860 17.3272 17.3272 17.3475 17.3475 k = 0.3333 0.5774 0.2651 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.1871 -18.1871 -18.1082 -18.1082 -16.2632 -16.2632 -16.0870 -16.0870 -16.0239 -16.0239 -15.9540 -15.9540 0.2114 0.2114 0.3034 0.3034 9.2997 9.2997 9.3766 9.3766 9.5333 9.5333 9.5727 9.5727 11.2820 11.2820 11.2869 11.2869 14.0504 14.0504 14.1012 14.1012 15.7339 15.7339 15.7860 15.7860 17.3272 17.3272 17.3475 17.3475 k = 0.3283 0.5686 0.2651 ( 2056 PWs) bands (ev): -40.3975 -40.3975 -40.3975 -40.3975 -18.1871 -18.1871 -18.1082 -18.1082 -16.2631 -16.2631 -16.0874 -16.0874 -16.0233 -16.0233 -15.9539 -15.9539 0.2112 0.2112 0.3031 0.3031 9.2961 9.2961 9.3709 9.3709 9.5386 9.5386 9.5767 9.5767 11.2797 11.2797 11.2848 11.2848 14.0526 14.0526 14.1034 14.1034 15.7355 15.7355 15.7875 15.7875 17.3279 17.3279 17.3482 17.3482 k = 0.3232 0.5599 0.2651 ( 2060 PWs) bands (ev): -40.3977 -40.3977 -40.3977 -40.3977 -18.1868 -18.1868 -18.1082 -18.1082 -16.2627 -16.2627 -16.0885 -16.0885 -16.0218 -16.0218 -15.9536 -15.9536 0.2107 0.2107 0.3023 0.3023 9.2859 9.2859 9.3558 9.3558 9.5525 9.5525 9.5879 9.5879 11.2731 11.2731 11.2784 11.2784 14.0591 14.0591 14.1097 14.1097 15.7404 15.7404 15.7920 15.7920 17.3299 17.3299 17.3506 17.3506 k = 0.3182 0.5511 0.2651 ( 2058 PWs) bands (ev): -40.3977 -40.3977 -40.3977 -40.3977 -18.1863 -18.1863 -18.1081 -18.1081 -16.2619 -16.2619 -16.0902 -16.0902 -16.0193 -16.0193 -15.9530 -15.9530 0.2098 0.2098 0.3010 0.3010 9.2706 9.2706 9.3350 9.3350 9.5716 9.5716 9.6047 9.6047 11.2622 11.2622 11.2678 11.2678 14.0694 14.0694 14.1197 14.1197 15.7487 15.7487 15.7998 15.7998 17.3334 17.3334 17.3546 17.3546 k = 0.3131 0.5424 0.2651 ( 2058 PWs) bands (ev): -40.3979 -40.3979 -40.3979 -40.3979 -18.1857 -18.1857 -18.1079 -18.1079 -16.2608 -16.2608 -16.0922 -16.0922 -16.0162 -16.0162 -15.9522 -15.9522 0.2084 0.2084 0.2992 0.2992 9.2517 9.2517 9.3109 9.3109 9.5936 9.5936 9.6253 9.6253 11.2472 11.2472 11.2531 11.2531 14.0830 14.0830 14.1329 14.1329 15.7605 15.7605 15.8108 15.8108 17.3383 17.3383 17.3600 17.3600 k = 0.3081 0.5336 0.2651 ( 2056 PWs) bands (ev): -40.3981 -40.3981 -40.3981 -40.3981 -18.1848 -18.1848 -18.1076 -18.1076 -16.2594 -16.2594 -16.0944 -16.0944 -16.0125 -16.0125 -15.9512 -15.9512 0.2067 0.2067 0.2969 0.2969 9.2305 9.2305 9.2851 9.2851 9.6171 9.6171 9.6486 9.6486 11.2282 11.2282 11.2347 11.2347 14.0991 14.0991 14.1486 14.1486 15.7758 15.7758 15.8251 15.8251 17.3442 17.3442 17.3666 17.3666 k = 0.3030 0.5249 0.2651 ( 2056 PWs) bands (ev): -40.3984 -40.3984 -40.3984 -40.3984 -18.1838 -18.1838 -18.1073 -18.1073 -16.2576 -16.2576 -16.0966 -16.0966 -16.0085 -16.0085 -15.9501 -15.9501 0.2046 0.2046 0.2941 0.2941 9.2076 9.2076 9.2585 9.2585 9.6414 9.6414 9.6734 9.6734 11.2057 11.2057 11.2126 11.2126 14.1172 14.1172 14.1663 14.1663 15.7947 15.7947 15.8427 15.8427 17.3507 17.3507 17.3740 17.3740 k = 0.2980 0.5161 0.2651 ( 2048 PWs) bands (ev): -40.3987 -40.3987 -40.3987 -40.3987 -18.1825 -18.1825 -18.1068 -18.1068 -16.2554 -16.2554 -16.0988 -16.0988 -16.0041 -16.0041 -15.9487 -15.9487 0.2020 0.2020 0.2907 0.2907 9.1839 9.1839 9.2314 9.2314 9.6662 9.6662 9.6991 9.6991 11.1799 11.1799 11.1875 11.1875 14.1367 14.1367 14.1852 14.1852 15.8171 15.8171 15.8635 15.8635 17.3570 17.3570 17.3813 17.3813 k = 0.2929 0.5074 0.2651 ( 2040 PWs) bands (ev): -40.3990 -40.3990 -40.3990 -40.3990 -18.1810 -18.1810 -18.1062 -18.1062 -16.2529 -16.2529 -16.1008 -16.1008 -15.9995 -15.9995 -15.9472 -15.9472 0.1990 0.1991 0.2869 0.2869 9.1595 9.1595 9.2042 9.2042 9.6911 9.6911 9.7253 9.7253 11.1512 11.1512 11.1595 11.1595 14.1568 14.1568 14.2047 14.2047 15.8427 15.8427 15.8874 15.8874 17.3621 17.3621 17.3876 17.3876 k = 0.2879 0.4986 0.2651 ( 2040 PWs) bands (ev): -40.3994 -40.3994 -40.3994 -40.3994 -18.1793 -18.1793 -18.1054 -18.1054 -16.2501 -16.2501 -16.1025 -16.1025 -15.9947 -15.9947 -15.9456 -15.9456 0.1956 0.1956 0.2825 0.2825 9.1349 9.1349 9.1771 9.1771 9.7159 9.7159 9.7516 9.7516 11.1201 11.1201 11.1292 11.1292 14.1771 14.1771 14.2244 14.2244 15.8711 15.8711 15.9141 15.9141 17.3644 17.3644 17.3913 17.3913 k = 0.2828 0.4899 0.2651 ( 2044 PWs) bands (ev): -40.4000 -40.4000 -40.4000 -40.4000 -18.1774 -18.1774 -18.1045 -18.1045 -16.2469 -16.2469 -16.1040 -16.1040 -15.9898 -15.9898 -15.9438 -15.9438 0.1918 0.1918 0.2777 0.2777 9.1102 9.1102 9.1503 9.1503 9.7405 9.7405 9.7778 9.7778 11.0869 11.0869 11.0968 11.0968 14.1972 14.1972 14.2438 14.2438 15.9020 15.9020 15.9431 15.9431 17.3621 17.3621 17.3908 17.3908 k = 0.2778 0.4811 0.2651 ( 2046 PWs) bands (ev): -40.4007 -40.4007 -40.4007 -40.4007 -18.1752 -18.1752 -18.1035 -18.1035 -16.2433 -16.2433 -16.1052 -16.1052 -15.9848 -15.9848 -15.9419 -15.9419 0.1875 0.1875 0.2723 0.2723 9.0855 9.0855 9.1238 9.1238 9.7647 9.7647 9.8036 9.8036 11.0521 11.0521 11.0629 11.0629 14.2166 14.2166 14.2626 14.2626 15.9348 15.9348 15.9741 15.9741 17.3534 17.3534 17.3842 17.3842 k = 0.2727 0.4724 0.2651 ( 2050 PWs) bands (ev): -40.4014 -40.4014 -40.4014 -40.4014 -18.1728 -18.1728 -18.1022 -18.1022 -16.2394 -16.2394 -16.1060 -16.1060 -15.9797 -15.9797 -15.9398 -15.9398 0.1828 0.1828 0.2665 0.2665 9.0611 9.0611 9.0977 9.0977 9.7883 9.7883 9.8288 9.8288 11.0160 11.0160 11.0277 11.0277 14.2352 14.2352 14.2806 14.2806 15.9688 15.9688 16.0065 16.0065 17.3371 17.3371 17.3702 17.3702 k = 0.2677 0.4636 0.2651 ( 2050 PWs) bands (ev): -40.4021 -40.4021 -40.4021 -40.4021 -18.1702 -18.1702 -18.1007 -18.1007 -16.2351 -16.2351 -16.1064 -16.1064 -15.9746 -15.9746 -15.9377 -15.9377 0.1776 0.1776 0.2602 0.2602 9.0369 9.0369 9.0721 9.0721 9.8112 9.8112 9.8533 9.8533 10.9789 10.9789 10.9916 10.9916 14.2529 14.2529 14.2977 14.2977 16.0032 16.0032 16.0395 16.0395 17.3127 17.3127 17.3481 17.3481 k = 0.2626 0.4549 0.2651 ( 2050 PWs) bands (ev): -40.4029 -40.4029 -40.4029 -40.4029 -18.1674 -18.1674 -18.0991 -18.0991 -16.2305 -16.2305 -16.1064 -16.1064 -15.9694 -15.9694 -15.9354 -15.9354 0.1720 0.1720 0.2534 0.2534 9.0132 9.0132 9.0471 9.0471 9.8332 9.8332 9.8768 9.8768 10.9413 10.9413 10.9550 10.9550 14.2697 14.2697 14.3140 14.3140 16.0371 16.0371 16.0726 16.0726 17.2810 17.2810 17.3183 17.3183 k = 0.2576 0.4461 0.2651 ( 2050 PWs) bands (ev): -40.4038 -40.4038 -40.4038 -40.4038 -18.1644 -18.1644 -18.0972 -18.0972 -16.2256 -16.2256 -16.1060 -16.1060 -15.9642 -15.9642 -15.9331 -15.9331 0.1659 0.1659 0.2462 0.2462 8.9898 8.9898 9.0227 9.0227 9.8541 9.8541 9.8992 9.8992 10.9035 10.9035 10.9181 10.9181 14.2857 14.2857 14.3294 14.3294 16.0695 16.0695 16.1048 16.1048 17.2435 17.2435 17.2818 17.2818 k = 0.2525 0.4374 0.2651 ( 2046 PWs) bands (ev): -40.4047 -40.4047 -40.4047 -40.4047 -18.1611 -18.1611 -18.0951 -18.0951 -16.2204 -16.2204 -16.1051 -16.1051 -15.9590 -15.9590 -15.9307 -15.9307 0.1593 0.1593 0.2385 0.2385 8.9670 8.9670 8.9989 8.9989 9.8738 9.8738 9.9203 9.9203 10.8656 10.8656 10.8813 10.8813 14.3010 14.3010 14.3441 14.3441 16.0995 16.0995 16.1354 16.1354 17.2021 17.2021 17.2405 17.2405 k = 0.2475 0.4286 0.2651 ( 2050 PWs) bands (ev): -40.4057 -40.4057 -40.4057 -40.4057 -18.1577 -18.1577 -18.0928 -18.0928 -16.2150 -16.2150 -16.1037 -16.1037 -15.9538 -15.9538 -15.9282 -15.9282 0.1522 0.1522 0.2303 0.2303 8.9448 8.9448 8.9760 8.9760 9.8922 9.8922 9.9398 9.9398 10.8281 10.8281 10.8448 10.8448 14.3158 14.3158 14.3583 14.3583 16.1259 16.1259 16.1635 16.1635 17.1588 17.1588 17.1960 17.1960 k = 0.2424 0.4199 0.2651 ( 2050 PWs) bands (ev): -40.4068 -40.4068 -40.4068 -40.4068 -18.1540 -18.1540 -18.0902 -18.0902 -16.2092 -16.2092 -16.1019 -16.1019 -15.9486 -15.9486 -15.9256 -15.9256 0.1447 0.1447 0.2217 0.2217 8.9232 8.9232 8.9538 8.9538 9.9089 9.9089 9.9575 9.9575 10.7911 10.7911 10.8088 10.8088 14.3303 14.3303 14.3723 14.3723 16.1478 16.1478 16.1882 16.1882 17.1156 17.1156 17.1504 17.1504 k = 0.2374 0.4111 0.2651 ( 2042 PWs) bands (ev): -40.4078 -40.4078 -40.4078 -40.4078 -18.1502 -18.1502 -18.0874 -18.0874 -16.2032 -16.2032 -16.0995 -16.0995 -15.9435 -15.9435 -15.9229 -15.9229 0.1367 0.1367 0.2127 0.2127 8.9024 8.9024 8.9324 8.9324 9.9239 9.9239 9.9733 9.9733 10.7548 10.7548 10.7736 10.7736 14.3448 14.3448 14.3863 14.3863 16.1642 16.1642 16.2085 16.2085 17.0741 17.0741 17.1053 17.1053 k = 0.2323 0.4024 0.2651 ( 2046 PWs) bands (ev): -40.4090 -40.4090 -40.4090 -40.4090 -18.1462 -18.1462 -18.0844 -18.0844 -16.1970 -16.1970 -16.0966 -16.0966 -15.9383 -15.9383 -15.9201 -15.9201 0.1282 0.1282 0.2032 0.2032 8.8822 8.8822 8.9119 8.9119 9.9369 9.9369 9.9868 9.9868 10.7195 10.7195 10.7394 10.7394 14.3595 14.3595 14.4005 14.4005 16.1741 16.1741 16.2234 16.2234 17.0361 17.0361 17.0628 17.0628 k = 0.2273 0.3936 0.2651 ( 2046 PWs) bands (ev): -40.4103 -40.4103 -40.4103 -40.4103 -18.1420 -18.1420 -18.0811 -18.0811 -16.1906 -16.1906 -16.0933 -16.0933 -15.9333 -15.9333 -15.9172 -15.9172 0.1192 0.1192 0.1933 0.1933 8.8629 8.8629 8.8923 8.8923 9.9479 9.9479 9.9980 9.9980 10.6854 10.6854 10.7063 10.7063 14.3747 14.3747 14.4152 14.4152 16.1768 16.1768 16.2318 16.2318 17.0028 17.0028 17.0242 17.0242 k = 0.2222 0.3849 0.2651 ( 2050 PWs) bands (ev): -40.4116 -40.4116 -40.4116 -40.4116 -18.1376 -18.1376 -18.0776 -18.0776 -16.1841 -16.1841 -16.0894 -16.0894 -15.9283 -15.9283 -15.9142 -15.9142 0.1098 0.1098 0.1829 0.1829 8.8444 8.8444 8.8736 8.8736 9.9565 9.9565 10.0066 10.0066 10.6525 10.6525 10.6745 10.6745 14.3907 14.3907 14.4306 14.4306 16.1719 16.1719 16.2332 16.2332 16.9752 16.9752 16.9914 16.9914 k = 0.2172 0.3762 0.2651 ( 2046 PWs) bands (ev): -40.4129 -40.4129 -40.4129 -40.4129 -18.1331 -18.1331 -18.0739 -18.0739 -16.1774 -16.1774 -16.0850 -16.0850 -15.9234 -15.9234 -15.9110 -15.9110 0.0998 0.0998 0.1721 0.1721 8.8269 8.8269 8.8560 8.8560 9.9628 9.9628 10.0124 10.0124 10.6210 10.6210 10.6440 10.6440 14.4076 14.4076 14.4470 14.4470 16.1595 16.1595 16.2271 16.2271 16.9535 16.9535 16.9655 16.9655 k = 0.2121 0.3674 0.2651 ( 2044 PWs) bands (ev): -40.4143 -40.4143 -40.4143 -40.4143 -18.1284 -18.1284 -18.0700 -18.0700 -16.1705 -16.1705 -16.0801 -16.0801 -15.9186 -15.9186 -15.9076 -15.9076 0.0894 0.0894 0.1609 0.1609 8.8102 8.8102 8.8393 8.8393 9.9667 9.9667 10.0154 10.0154 10.5909 10.5909 10.6150 10.6150 14.4257 14.4257 14.4645 14.4645 16.1402 16.1402 16.2134 16.2134 16.9370 16.9370 16.9476 16.9476 k = 0.2071 0.3587 0.2651 ( 2044 PWs) bands (ev): -40.4157 -40.4157 -40.4157 -40.4157 -18.1236 -18.1236 -18.0659 -18.0659 -16.1636 -16.1636 -16.0747 -16.0747 -15.9141 -15.9141 -15.9040 -15.9040 0.0785 0.0785 0.1493 0.1493 8.7946 8.7946 8.8236 8.8236 9.9680 9.9680 10.0155 10.0155 10.5622 10.5622 10.5874 10.5874 14.4451 14.4451 14.4833 14.4833 16.1150 16.1150 16.1931 16.1931 16.9253 16.9253 16.9374 16.9374 k = 0.2020 0.3499 0.2651 ( 2044 PWs) bands (ev): -40.4172 -40.4172 -40.4172 -40.4172 -18.1186 -18.1186 -18.0616 -18.0616 -16.1566 -16.1566 -16.0688 -16.0688 -15.9098 -15.9098 -15.9000 -15.9000 0.0671 0.0671 0.1372 0.1372 8.7799 8.7799 8.8090 8.8090 9.9669 9.9669 10.0127 10.0127 10.5348 10.5348 10.5612 10.5612 14.4660 14.4660 14.5037 14.5037 16.0852 16.0852 16.1671 16.1671 16.9185 16.9185 16.9333 16.9333 k = 0.1970 0.3412 0.2651 ( 2046 PWs) bands (ev): -40.4188 -40.4188 -40.4188 -40.4188 -18.1136 -18.1136 -18.0571 -18.0571 -16.1494 -16.1494 -16.0625 -16.0625 -15.9058 -15.9058 -15.8957 -15.8957 0.0552 0.0552 0.1247 0.1247 8.7663 8.7663 8.7954 8.7954 9.9633 9.9633 10.0071 10.0071 10.5087 10.5087 10.5363 10.5363 14.4885 14.4885 14.5257 14.5257 16.0522 16.0522 16.1369 16.1369 16.9162 16.9162 16.9337 16.9337 k = 0.1919 0.3324 0.2651 ( 2046 PWs) bands (ev): -40.4203 -40.4203 -40.4203 -40.4203 -18.1084 -18.1084 -18.0525 -18.0525 -16.1423 -16.1423 -16.0558 -16.0558 -15.9020 -15.9020 -15.8912 -15.8912 0.0429 0.0429 0.1118 0.1118 8.7537 8.7537 8.7828 8.7828 9.9575 9.9575 9.9989 9.9989 10.4837 10.4837 10.5124 10.5124 14.5128 14.5128 14.5495 14.5495 16.0174 16.0174 16.1040 16.1040 16.9176 16.9176 16.9375 16.9375 k = 0.1869 0.3237 0.2651 ( 2046 PWs) bands (ev): -40.4219 -40.4219 -40.4219 -40.4219 -18.1031 -18.1031 -18.0478 -18.0478 -16.1350 -16.1350 -16.0487 -16.0487 -15.8982 -15.8982 -15.8863 -15.8863 0.0302 0.0302 0.0985 0.0985 8.7422 8.7422 8.7713 8.7713 9.9496 9.9496 9.9883 9.9883 10.4596 10.4596 10.4895 10.4895 14.5389 14.5389 14.5752 14.5752 15.9820 15.9820 16.0697 16.0697 16.9217 16.9217 16.9435 16.9435 k = 0.1818 0.3149 0.2651 ( 2046 PWs) bands (ev): -40.4236 -40.4236 -40.4236 -40.4236 -18.0978 -18.0978 -18.0429 -18.0429 -16.1277 -16.1277 -16.0414 -16.0414 -15.8946 -15.8946 -15.8813 -15.8813 0.0171 0.0171 0.0848 0.0848 8.7317 8.7317 8.7608 8.7608 9.9398 9.9398 9.9757 9.9757 10.4362 10.4362 10.4672 10.4672 14.5668 14.5668 14.6028 14.6028 15.9470 15.9470 16.0352 16.0352 16.9276 16.9276 16.9511 16.9511 k = 0.1768 0.3062 0.2651 ( 2046 PWs) bands (ev): -40.4253 -40.4252 -40.4252 -40.4252 -18.0924 -18.0924 -18.0380 -18.0380 -16.1204 -16.1204 -16.0338 -16.0338 -15.8909 -15.8909 -15.8762 -15.8762 0.0035 0.0035 0.0707 0.0707 8.7223 8.7223 8.7513 8.7513 9.9284 9.9284 9.9613 9.9613 10.4132 10.4132 10.4452 10.4452 14.5967 14.5967 14.6324 14.6324 15.9132 15.9132 16.0014 16.0014 16.9347 16.9347 16.9595 16.9595 k = 0.1717 0.2974 0.2651 ( 2050 PWs) bands (ev): -40.4270 -40.4270 -40.4270 -40.4270 -18.0869 -18.0869 -18.0329 -18.0329 -16.1131 -16.1131 -16.0260 -16.0260 -15.8871 -15.8871 -15.8710 -15.8710 -0.0104 -0.0104 0.0563 0.0563 8.7138 8.7138 8.7428 8.7428 9.9157 9.9157 9.9455 9.9455 10.3905 10.3905 10.4234 10.4234 14.6284 14.6284 14.6640 14.6640 15.8812 15.8812 15.9692 15.9692 16.9424 16.9424 16.9683 16.9683 k = 0.1667 0.2887 0.2651 ( 2042 PWs) bands (ev): -40.4286 -40.4286 -40.4286 -40.4286 -18.0814 -18.0814 -18.0278 -18.0278 -16.1057 -16.1057 -16.0181 -16.0181 -15.8832 -15.8832 -15.8656 -15.8656 -0.0247 -0.0247 0.0415 0.0415 8.7064 8.7064 8.7351 8.7351 9.9020 9.9020 9.9287 9.9287 10.3678 10.3678 10.4016 10.4016 14.6621 14.6621 14.6976 14.6976 15.8517 15.8517 15.9391 15.9391 16.9501 16.9501 16.9770 16.9770 k = 0.1616 0.2799 0.2651 ( 2042 PWs) bands (ev): -40.4303 -40.4303 -40.4303 -40.4303 -18.0758 -18.0758 -18.0227 -18.0227 -16.0983 -16.0983 -16.0102 -16.0102 -15.8791 -15.8791 -15.8602 -15.8602 -0.0393 -0.0393 0.0263 0.0263 8.6999 8.6999 8.7283 8.7283 9.8875 9.8875 9.9112 9.9112 10.3450 10.3450 10.3794 10.3794 14.6976 14.6976 14.7332 14.7332 15.8249 15.8249 15.9115 15.9115 16.9575 16.9575 16.9852 16.9852 k = 0.1566 0.2712 0.2651 ( 2054 PWs) bands (ev): -40.4322 -40.4322 -40.4322 -40.4322 -18.0702 -18.0702 -18.0177 -18.0177 -16.0909 -16.0909 -16.0024 -16.0024 -15.8748 -15.8748 -15.8546 -15.8546 -0.0541 -0.0541 0.0108 0.0108 8.6943 8.6943 8.7223 8.7223 9.8726 9.8726 9.8933 9.8933 10.3219 10.3219 10.3568 10.3568 14.7349 14.7349 14.7706 14.7706 15.8011 15.8011 15.8868 15.8868 16.9642 16.9642 16.9927 16.9927 k = 0.1515 0.2624 0.2651 ( 2046 PWs) bands (ev): -40.4338 -40.4338 -40.4338 -40.4338 -18.0646 -18.0646 -18.0126 -18.0126 -16.0835 -16.0835 -15.9946 -15.9946 -15.8702 -15.8702 -15.8490 -15.8490 -0.0693 -0.0693 -0.0050 -0.0050 8.6895 8.6895 8.7171 8.7171 9.8575 9.8575 9.8754 9.8754 10.2986 10.2986 10.3337 10.3337 14.7739 14.7739 14.8098 14.8098 15.7805 15.7805 15.8652 15.8652 16.9701 16.9701 16.9993 16.9993 k = 0.1465 0.2537 0.2651 ( 2042 PWs) bands (ev): -40.4355 -40.4355 -40.4355 -40.4355 -18.0590 -18.0590 -18.0075 -18.0075 -16.0761 -16.0761 -15.9872 -15.9872 -15.8653 -15.8653 -15.8433 -15.8433 -0.0846 -0.0846 -0.0210 -0.0210 8.6854 8.6854 8.7124 8.7124 9.8424 9.8424 9.8576 9.8576 10.2748 10.2748 10.3100 10.3100 14.8146 14.8146 14.8508 14.8508 15.7633 15.7633 15.8468 15.8468 16.9748 16.9748 17.0046 17.0046 k = 0.1414 0.2449 0.2651 ( 2036 PWs) bands (ev): -40.4372 -40.4372 -40.4372 -40.4372 -18.0533 -18.0533 -18.0025 -18.0025 -16.0687 -16.0687 -15.9800 -15.9800 -15.8601 -15.8601 -15.8375 -15.8375 -0.1002 -0.1002 -0.0373 -0.0373 8.6820 8.6820 8.7083 8.7083 9.8276 9.8276 9.8404 9.8404 10.2507 10.2507 10.2858 10.2858 14.8568 14.8568 14.8933 14.8933 15.7493 15.7493 15.8316 15.8316 16.9782 16.9782 17.0085 17.0085 k = 0.1364 0.2362 0.2651 ( 2044 PWs) bands (ev): -40.4390 -40.4390 -40.4390 -40.4390 -18.0478 -18.0478 -17.9976 -17.9976 -16.0614 -16.0614 -15.9732 -15.9732 -15.8545 -15.8545 -15.8317 -15.8317 -0.1158 -0.1158 -0.0538 -0.0538 8.6791 8.6791 8.7046 8.7046 9.8131 9.8131 9.8239 9.8239 10.2263 10.2263 10.2610 10.2610 14.9004 14.9004 14.9373 14.9373 15.7386 15.7386 15.8195 15.8195 16.9800 16.9800 17.0108 17.0108 k = 0.1313 0.2274 0.2651 ( 2050 PWs) bands (ev): -40.4408 -40.4408 -40.4408 -40.4408 -18.0422 -18.0422 -17.9928 -17.9928 -16.0542 -16.0542 -15.9668 -15.9668 -15.8485 -15.8485 -15.8257 -15.8257 -0.1315 -0.1315 -0.0704 -0.0704 8.6765 8.6765 8.7011 8.7011 9.7992 9.7992 9.8085 9.8085 10.2016 10.2016 10.2358 10.2358 14.9453 14.9453 14.9826 14.9826 15.7311 15.7311 15.8106 15.8106 16.9801 16.9801 17.0113 17.0113 k = 0.1263 0.2187 0.2651 ( 2046 PWs) bands (ev): -40.4425 -40.4425 -40.4425 -40.4425 -18.0367 -18.0367 -17.9881 -17.9881 -16.0471 -16.0471 -15.9609 -15.9609 -15.8421 -15.8421 -15.8197 -15.8197 -0.1473 -0.1473 -0.0872 -0.0872 8.6743 8.6743 8.6979 8.6979 9.7859 9.7859 9.7944 9.7944 10.1767 10.1767 10.2102 10.2102 14.9914 14.9914 15.0291 15.0291 15.7266 15.7266 15.8046 15.8046 16.9785 16.9785 17.0099 17.0099 k = 0.1212 0.2099 0.2651 ( 2052 PWs) bands (ev): -40.4443 -40.4443 -40.4443 -40.4443 -18.0312 -18.0312 -17.9836 -17.9836 -16.0401 -16.0401 -15.9555 -15.9555 -15.8353 -15.8353 -15.8136 -15.8136 -0.1631 -0.1631 -0.1041 -0.1041 8.6722 8.6722 8.6948 8.6948 9.7733 9.7733 9.7819 9.7819 10.1517 10.1517 10.1844 10.1844 15.0384 15.0384 15.0765 15.0765 15.7250 15.7250 15.8013 15.8013 16.9748 16.9748 17.0064 17.0064 k = 0.1162 0.2012 0.2651 ( 2044 PWs) bands (ev): -40.4458 -40.4458 -40.4458 -40.4458 -18.0258 -18.0258 -17.9792 -17.9792 -16.0332 -16.0332 -15.9507 -15.9507 -15.8282 -15.8282 -15.8074 -15.8074 -0.1787 -0.1787 -0.1210 -0.1210 8.6702 8.6702 8.6917 8.6917 9.7617 9.7617 9.7710 9.7710 10.1268 10.1268 10.1585 10.1585 15.0863 15.0863 15.1247 15.1247 15.7260 15.7260 15.8006 15.8006 16.9691 16.9691 17.0008 17.0008 k = 0.1111 0.1925 0.2651 ( 2048 PWs) bands (ev): -40.4475 -40.4475 -40.4475 -40.4475 -18.0205 -18.0205 -17.9749 -17.9749 -16.0264 -16.0264 -15.9464 -15.9464 -15.8208 -15.8208 -15.8012 -15.8012 -0.1943 -0.1943 -0.1379 -0.1379 8.6681 8.6681 8.6884 8.6884 9.7513 9.7513 9.7616 9.7616 10.1020 10.1020 10.1326 10.1326 15.1348 15.1348 15.1735 15.1735 15.7293 15.7293 15.8022 15.8022 16.9613 16.9613 16.9928 16.9928 k = 0.1061 0.1837 0.2651 ( 2048 PWs) bands (ev): -40.4491 -40.4491 -40.4490 -40.4490 -18.0153 -18.0153 -17.9709 -17.9709 -16.0199 -16.0199 -15.9425 -15.9425 -15.8131 -15.8131 -15.7949 -15.7949 -0.2096 -0.2096 -0.1547 -0.1547 8.6658 8.6658 8.6849 8.6849 9.7422 9.7422 9.7539 9.7539 10.0775 10.0775 10.1069 10.1069 15.1839 15.1839 15.2227 15.2227 15.7348 15.7348 15.8057 15.8057 16.9512 16.9512 16.9826 16.9826 k = 0.1010 0.1750 0.2651 ( 2052 PWs) bands (ev): -40.4507 -40.4507 -40.4507 -40.4507 -18.0101 -18.0101 -17.9671 -17.9671 -16.0135 -16.0135 -15.9392 -15.9392 -15.8053 -15.8053 -15.7886 -15.7886 -0.2247 -0.2247 -0.1713 -0.1713 8.6632 8.6632 8.6810 8.6810 9.7347 9.7347 9.7478 9.7478 10.0533 10.0533 10.0815 10.0815 15.2332 15.2332 15.2720 15.2720 15.7422 15.7422 15.8110 15.8110 16.9390 16.9390 16.9699 16.9699 k = 0.0960 0.1662 0.2651 ( 2048 PWs) bands (ev): -40.4521 -40.4521 -40.4521 -40.4521 -18.0051 -18.0051 -17.9634 -17.9634 -16.0073 -16.0073 -15.9363 -15.9363 -15.7973 -15.7973 -15.7822 -15.7822 -0.2395 -0.2395 -0.1878 -0.1878 8.6603 8.6603 8.6769 8.6769 9.7289 9.7289 9.7432 9.7432 10.0298 10.0298 10.0566 10.0566 15.2826 15.2826 15.3213 15.3213 15.7510 15.7510 15.8177 15.8177 16.9247 16.9247 16.9550 16.9550 k = 0.0909 0.1575 0.2651 ( 2048 PWs) bands (ev): -40.4536 -40.4536 -40.4535 -40.4535 -18.0002 -18.0002 -17.9600 -17.9600 -16.0014 -16.0014 -15.9338 -15.9338 -15.7894 -15.7894 -15.7759 -15.7759 -0.2539 -0.2539 -0.2041 -0.2041 8.6570 8.6570 8.6723 8.6723 9.7247 9.7247 9.7401 9.7401 10.0068 10.0068 10.0323 10.0323 15.3319 15.3319 15.3704 15.3704 15.7612 15.7612 15.8254 15.8254 16.9083 16.9083 16.9378 16.9378 k = 0.0859 0.1487 0.2651 ( 2048 PWs) bands (ev): -40.4550 -40.4550 -40.4549 -40.4549 -17.9954 -17.9954 -17.9568 -17.9568 -15.9957 -15.9957 -15.9316 -15.9316 -15.7814 -15.7814 -15.7696 -15.7696 -0.2679 -0.2679 -0.2200 -0.2200 8.6532 8.6532 8.6673 8.6673 9.7221 9.7221 9.7385 9.7385 9.9847 9.9847 10.0086 10.0086 15.3810 15.3810 15.4189 15.4189 15.7722 15.7722 15.8340 15.8340 16.8900 16.8900 16.9186 16.9186 k = 0.0808 0.1400 0.2651 ( 2052 PWs) bands (ev): -40.4564 -40.4564 -40.4564 -40.4564 -17.9908 -17.9908 -17.9539 -17.9539 -15.9902 -15.9902 -15.9299 -15.9299 -15.7736 -15.7736 -15.7634 -15.7634 -0.2814 -0.2814 -0.2355 -0.2355 8.6490 8.6490 8.6619 8.6619 9.7212 9.7212 9.7383 9.7383 9.9633 9.9633 9.9859 9.9859 15.4294 15.4294 15.4668 15.4668 15.7840 15.7840 15.8431 15.8431 16.8701 16.8701 16.8975 16.8975 k = 0.0758 0.1312 0.2651 ( 2048 PWs) bands (ev): -40.4576 -40.4576 -40.4576 -40.4576 -17.9863 -17.9863 -17.9512 -17.9512 -15.9849 -15.9849 -15.9284 -15.9284 -15.7660 -15.7660 -15.7573 -15.7573 -0.2943 -0.2943 -0.2506 -0.2506 8.6444 8.6444 8.6562 8.6562 9.7218 9.7218 9.7393 9.7393 9.9430 9.9430 9.9640 9.9640 15.4771 15.4771 15.5136 15.5136 15.7961 15.7961 15.8524 15.8524 16.8488 16.8488 16.8750 16.8750 k = 0.0707 0.1225 0.2651 ( 2048 PWs) bands (ev): -40.4588 -40.4588 -40.4588 -40.4588 -17.9820 -17.9820 -17.9487 -17.9487 -15.9799 -15.9799 -15.9272 -15.9272 -15.7586 -15.7586 -15.7513 -15.7513 -0.3066 -0.3066 -0.2652 -0.2652 8.6394 8.6394 8.6502 8.6502 9.7237 9.7237 9.7416 9.7416 9.9237 9.9237 9.9432 9.9432 15.5237 15.5237 15.5592 15.5592 15.8084 15.8084 15.8616 15.8616 16.8264 16.8264 16.8512 16.8512 k = 0.0657 0.1137 0.2651 ( 2052 PWs) bands (ev): -40.4600 -40.4600 -40.4600 -40.4600 -17.9778 -17.9778 -17.9465 -17.9465 -15.9752 -15.9752 -15.9263 -15.9263 -15.7515 -15.7515 -15.7456 -15.7456 -0.3182 -0.3182 -0.2793 -0.2793 8.6341 8.6341 8.6439 8.6439 9.7269 9.7269 9.7447 9.7447 9.9055 9.9055 9.9235 9.9235 15.5690 15.5690 15.6032 15.6032 15.8205 15.8205 15.8706 15.8706 16.8034 16.8034 16.8266 16.8266 k = 0.0606 0.1050 0.2651 ( 2052 PWs) bands (ev): -40.4611 -40.4611 -40.4611 -40.4611 -17.9738 -17.9738 -17.9446 -17.9446 -15.9707 -15.9707 -15.9257 -15.9257 -15.7448 -15.7448 -15.7400 -15.7400 -0.3291 -0.3291 -0.2927 -0.2927 8.6286 8.6286 8.6374 8.6374 9.7312 9.7312 9.7487 9.7487 9.8885 9.8885 9.9050 9.9050 15.6127 15.6127 15.6454 15.6454 15.8323 15.8323 15.8791 15.8791 16.7800 16.7800 16.8016 16.8016 k = 0.0556 0.0962 0.2651 ( 2056 PWs) bands (ev): -40.4622 -40.4622 -40.4622 -40.4622 -17.9700 -17.9700 -17.9429 -17.9429 -15.9664 -15.9664 -15.9253 -15.9253 -15.7384 -15.7384 -15.7347 -15.7347 -0.3392 -0.3392 -0.3054 -0.3054 8.6230 8.6230 8.6309 8.6309 9.7363 9.7363 9.7533 9.7533 9.8728 9.8728 9.8878 9.8878 15.6546 15.6546 15.6855 15.6855 15.8436 15.8436 15.8869 15.8869 16.7569 16.7569 16.7767 16.7767 k = 0.0505 0.0875 0.2651 ( 2056 PWs) bands (ev): -40.4631 -40.4631 -40.4631 -40.4631 -17.9664 -17.9664 -17.9415 -17.9415 -15.9624 -15.9624 -15.9251 -15.9251 -15.7325 -15.7325 -15.7296 -15.7296 -0.3484 -0.3484 -0.3174 -0.3174 8.6174 8.6174 8.6245 8.6245 9.7421 9.7421 9.7583 9.7583 9.8583 9.8583 9.8718 9.8718 15.6943 15.6943 15.7233 15.7233 15.8542 15.8542 15.8939 15.8939 16.7343 16.7343 16.7523 16.7523 k = 0.0455 0.0787 0.2651 ( 2052 PWs) bands (ev): -40.4639 -40.4639 -40.4639 -40.4639 -17.9629 -17.9629 -17.9403 -17.9403 -15.9586 -15.9586 -15.9252 -15.9252 -15.7270 -15.7270 -15.7249 -15.7249 -0.3568 -0.3568 -0.3286 -0.3286 8.6119 8.6119 8.6182 8.6182 9.7483 9.7483 9.7634 9.7634 9.8452 9.8452 9.8573 9.8573 15.7315 15.7315 15.7584 15.7584 15.8640 15.8640 15.9000 15.9000 16.7127 16.7127 16.7289 16.7289 k = 0.0404 0.0700 0.2651 ( 2052 PWs) bands (ev): -40.4646 -40.4646 -40.4646 -40.4646 -17.9597 -17.9597 -17.9394 -17.9394 -15.9550 -15.9550 -15.9254 -15.9254 -15.7221 -15.7221 -15.7206 -15.7206 -0.3642 -0.3642 -0.3390 -0.3390 8.6067 8.6067 8.6122 8.6122 9.7547 9.7547 9.7685 9.7685 9.8335 9.8335 9.8441 9.8441 15.7660 15.7660 15.7905 15.7905 15.8730 15.8730 15.9051 15.9051 16.6925 16.6925 16.7068 16.7068 k = 0.0354 0.0612 0.2651 ( 2052 PWs) bands (ev): -40.4653 -40.4653 -40.4653 -40.4653 -17.9567 -17.9567 -17.9388 -17.9388 -15.9517 -15.9517 -15.9258 -15.9258 -15.7177 -15.7177 -15.7166 -15.7166 -0.3707 -0.3707 -0.3484 -0.3484 8.6018 8.6018 8.6066 8.6066 9.7610 9.7610 9.7734 9.7734 9.8233 9.8233 9.8324 9.8324 15.7975 15.7975 15.8194 15.8194 15.8811 15.8811 15.9092 15.9092 16.6740 16.6740 16.6864 16.6864 k = 0.0303 0.0525 0.2651 ( 2052 PWs) bands (ev): -40.4659 -40.4659 -40.4659 -40.4659 -17.9538 -17.9538 -17.9384 -17.9384 -15.9485 -15.9485 -15.9265 -15.9265 -15.7138 -15.7138 -15.7132 -15.7132 -0.3762 -0.3762 -0.3569 -0.3569 8.5974 8.5974 8.6015 8.6015 9.7671 9.7671 9.7778 9.7778 9.8145 9.8145 9.8221 9.8221 15.8257 15.8257 15.8447 15.8447 15.8883 15.8883 15.9123 15.9123 16.6575 16.6575 16.6681 16.6681 k = 0.0253 0.0437 0.2651 ( 2052 PWs) bands (ev): -40.4664 -40.4664 -40.4664 -40.4664 -17.9513 -17.9513 -17.9384 -17.9384 -15.9456 -15.9456 -15.9273 -15.9273 -15.7105 -15.7105 -15.7101 -15.7101 -0.3806 -0.3806 -0.3644 -0.3644 8.5935 8.5935 8.5969 8.5969 9.7728 9.7728 9.7814 9.7814 9.8073 9.8073 9.8134 9.8134 15.8502 15.8502 15.8662 15.8662 15.8947 15.8947 15.9145 15.9145 16.6433 16.6433 16.6521 16.6521 k = 0.0202 0.0350 0.2651 ( 2048 PWs) bands (ev): -40.4668 -40.4668 -40.4668 -40.4668 -17.9489 -17.9489 -17.9385 -17.9385 -15.9429 -15.9429 -15.9283 -15.9283 -15.7078 -15.7078 -15.7076 -15.7076 -0.3839 -0.3839 -0.3710 -0.3710 8.5903 8.5903 8.5930 8.5930 9.7777 9.7777 9.7842 9.7842 9.8018 9.8018 9.8062 9.8062 15.8709 15.8709 15.8834 15.8834 15.9006 15.9006 15.9159 15.9159 16.6316 16.6316 16.6386 16.6386 k = 0.0152 0.0262 0.2651 ( 2052 PWs) bands (ev): -40.4672 -40.4672 -40.4672 -40.4672 -17.9467 -17.9467 -17.9389 -17.9389 -15.9404 -15.9404 -15.9295 -15.9295 -15.7057 -15.7057 -15.7056 -15.7056 -0.3862 -0.3862 -0.3764 -0.3764 8.5878 8.5878 8.5898 8.5898 9.7817 9.7817 9.7857 9.7857 9.7980 9.7980 9.8008 9.8008 15.8875 15.8875 15.8959 15.8959 15.9062 15.9062 15.9165 15.9165 16.6226 16.6226 16.6278 16.6278 k = 0.0101 0.0175 0.2651 ( 2052 PWs) bands (ev): -40.4674 -40.4674 -40.4674 -40.4674 -17.9448 -17.9448 -17.9396 -17.9396 -15.9381 -15.9381 -15.9308 -15.9308 -15.7042 -15.7042 -15.7042 -15.7042 -0.3873 -0.3873 -0.3808 -0.3808 8.5860 8.5860 8.5874 8.5874 9.7845 9.7845 9.7860 9.7860 9.7958 9.7958 9.7975 9.7975 15.8995 15.8995 15.9035 15.9035 15.9119 15.9119 15.9166 15.9166 16.6163 16.6163 16.6197 16.6197 k = 0.0051 0.0087 0.2651 ( 2050 PWs) bands (ev): -40.4675 -40.4675 -40.4675 -40.4675 -17.9432 -17.9432 -17.9405 -17.9405 -15.9360 -15.9360 -15.9324 -15.9324 -15.7033 -15.7033 -15.7033 -15.7033 -0.3874 -0.3874 -0.3841 -0.3841 8.5851 8.5851 8.5858 8.5858 9.7856 9.7856 9.7859 9.7859 9.7949 9.7949 9.7960 9.7960 15.9063 15.9063 15.9077 15.9077 15.9160 15.9160 15.9168 15.9168 16.6128 16.6128 16.6145 16.6145 k = 0.0000 0.0000 0.2651 ( 2042 PWs) bands (ev): -40.4674 -40.4674 -40.4674 -40.4674 -17.9417 -17.9417 -17.9417 -17.9417 -15.9341 -15.9341 -15.9341 -15.9341 -15.7030 -15.7030 -15.7030 -15.7030 -0.3863 -0.3863 -0.3863 -0.3863 8.5850 8.5850 8.5850 8.5850 9.7858 9.7858 9.7858 9.7858 9.7952 9.7952 9.7952 9.7952 15.9087 15.9087 15.9087 15.9087 15.9172 15.9172 15.9172 15.9172 16.6122 16.6122 16.6122 16.6122 k = 0.5000 0.2887 0.2651 ( 2044 PWs) bands (ev): -40.4051 -40.4051 -40.4051 -40.4051 -18.1383 -18.1383 -18.1383 -18.1383 -16.2018 -16.2018 -16.2018 -16.2018 -15.8828 -15.8828 -15.8828 -15.8828 0.1646 0.1646 0.1646 0.1646 8.5809 8.5809 8.5809 8.5809 10.4628 10.4628 10.4628 10.4628 10.5648 10.5648 10.5648 10.5648 14.8126 14.8126 14.8126 14.8126 16.5626 16.5626 16.5626 16.5626 17.2803 17.2803 17.2803 17.2803 k = 0.5000 0.2887 0.2549 ( 2044 PWs) bands (ev): -40.4053 -40.4053 -40.4050 -40.4050 -18.1397 -18.1397 -18.1368 -18.1368 -16.2036 -16.2036 -16.1999 -16.1999 -15.8855 -15.8855 -15.8802 -15.8802 0.1555 0.1555 0.1736 0.1736 8.5750 8.5750 8.5881 8.5881 10.4390 10.4390 10.4804 10.4804 10.5332 10.5332 10.6031 10.6031 14.8020 14.8020 14.8196 14.8196 16.5167 16.5167 16.6057 16.6057 17.2761 17.2761 17.2845 17.2845 k = 0.5000 0.2887 0.2447 ( 2046 PWs) bands (ev): -40.4055 -40.4055 -40.4048 -40.4048 -18.1411 -18.1411 -18.1354 -18.1354 -16.2055 -16.2055 -16.1980 -16.1980 -15.8882 -15.8882 -15.8777 -15.8777 0.1465 0.1465 0.1826 0.1826 8.5704 8.5704 8.5966 8.5966 10.4135 10.4135 10.4700 10.4700 10.5300 10.5300 10.6432 10.6432 14.7872 14.7872 14.8232 14.8232 16.4692 16.4692 16.6451 16.6451 17.2721 17.2721 17.2889 17.2889 k = 0.5000 0.2887 0.2345 ( 2046 PWs) bands (ev): -40.4058 -40.4058 -40.4045 -40.4045 -18.1425 -18.1425 -18.1339 -18.1339 -16.2072 -16.2072 -16.1960 -16.1960 -15.8909 -15.8909 -15.8753 -15.8753 0.1376 0.1376 0.1916 0.1916 8.5670 8.5670 8.6064 8.6064 10.3870 10.3870 10.4384 10.4384 10.5489 10.5489 10.6840 10.6840 14.7679 14.7679 14.8239 14.8239 16.4212 16.4212 16.6798 16.6798 17.2682 17.2682 17.2934 17.2934 k = 0.5000 0.2887 0.2243 ( 2040 PWs) bands (ev): -40.4060 -40.4060 -40.4041 -40.4041 -18.1439 -18.1439 -18.1324 -18.1324 -16.2089 -16.2089 -16.1940 -16.1940 -15.8936 -15.8936 -15.8729 -15.8729 0.1289 0.1289 0.2005 0.2005 8.5648 8.5648 8.6174 8.6174 10.3596 10.3596 10.4045 10.4045 10.5714 10.5714 10.7252 10.7252 14.7439 14.7439 14.8221 14.8221 16.3741 16.3741 16.7094 16.7094 17.2644 17.2644 17.2980 17.2980 k = 0.5000 0.2887 0.2141 ( 2036 PWs) bands (ev): -40.4063 -40.4063 -40.4037 -40.4037 -18.1452 -18.1452 -18.1310 -18.1310 -16.2106 -16.2106 -16.1921 -16.1921 -15.8964 -15.8964 -15.8706 -15.8706 0.1202 0.1202 0.2093 0.2093 8.5638 8.5638 8.6296 8.6296 10.3310 10.3310 10.3718 10.3718 10.5943 10.5943 10.7665 10.7665 14.7149 14.7149 14.8182 14.8182 16.3287 16.3287 16.7335 16.7335 17.2607 17.2607 17.3027 17.3027 k = 0.5000 0.2887 0.2039 ( 2040 PWs) bands (ev): -40.4067 -40.4067 -40.4035 -40.4035 -18.1465 -18.1465 -18.1295 -18.1295 -16.2122 -16.2122 -16.1901 -16.1901 -15.8992 -15.8992 -15.8684 -15.8684 0.1118 0.1118 0.2179 0.2179 8.5638 8.5638 8.6430 8.6430 10.3013 10.3013 10.3411 10.3411 10.6169 10.6169 10.8076 10.8076 14.6810 14.6810 14.8124 14.8124 16.2860 16.2860 16.7522 16.7522 17.2571 17.2571 17.3075 17.3075 k = 0.5000 0.2887 0.1937 ( 2040 PWs) bands (ev): -40.4068 -40.4068 -40.4033 -40.4033 -18.1478 -18.1478 -18.1281 -18.1281 -16.2138 -16.2138 -16.1881 -16.1881 -15.9020 -15.9020 -15.8663 -15.8663 0.1035 0.1035 0.2263 0.2263 8.5649 8.5649 8.6573 8.6573 10.2708 10.2708 10.3126 10.3126 10.6391 10.6391 10.8484 10.8484 14.6422 14.6422 14.8053 14.8053 16.2466 16.2466 16.7655 16.7655 17.2536 17.2536 17.3124 17.3124 k = 0.5000 0.2887 0.1835 ( 2036 PWs) bands (ev): -40.4070 -40.4070 -40.4030 -40.4030 -18.1490 -18.1490 -18.1267 -18.1267 -16.2152 -16.2152 -16.1861 -16.1861 -15.9047 -15.9047 -15.8644 -15.8644 0.0955 0.0955 0.2345 0.2345 8.5669 8.5669 8.6727 8.6727 10.2401 10.2401 10.2860 10.2860 10.6606 10.6606 10.8887 10.8887 14.5989 14.5989 14.7971 14.7971 16.2110 16.2110 16.7740 16.7740 17.2503 17.2503 17.3174 17.3174 k = 0.5000 0.2887 0.1733 ( 2036 PWs) bands (ev): -40.4072 -40.4072 -40.4027 -40.4027 -18.1501 -18.1501 -18.1254 -18.1254 -16.2166 -16.2166 -16.1842 -16.1842 -15.9075 -15.9075 -15.8625 -15.8625 0.0878 0.0878 0.2424 0.2424 8.5697 8.5697 8.6888 8.6888 10.2097 10.2097 10.2609 10.2609 10.6814 10.6814 10.9283 10.9283 14.5515 14.5515 14.7880 14.7880 16.1795 16.1795 16.7781 16.7781 17.2471 17.2471 17.3225 17.3225 k = 0.5000 0.2887 0.1631 ( 2036 PWs) bands (ev): -40.4074 -40.4074 -40.4026 -40.4026 -18.1513 -18.1513 -18.1240 -18.1240 -16.2180 -16.2180 -16.1823 -16.1823 -15.9102 -15.9102 -15.8607 -15.8607 0.0803 0.0803 0.2501 0.2501 8.5733 8.5733 8.7057 8.7057 10.1800 10.1800 10.2371 10.2371 10.7014 10.7014 10.9669 10.9669 14.5007 14.5007 14.7783 14.7783 16.1519 16.1519 16.7783 16.7783 17.2440 17.2440 17.3276 17.3276 k = 0.5000 0.2887 0.1530 ( 2036 PWs) bands (ev): -40.4076 -40.4076 -40.4024 -40.4024 -18.1523 -18.1523 -18.1228 -18.1228 -16.2193 -16.2193 -16.1804 -16.1804 -15.9128 -15.9128 -15.8590 -15.8590 0.0732 0.0732 0.2575 0.2575 8.5775 8.5775 8.7231 8.7231 10.1515 10.1515 10.2143 10.2143 10.7206 10.7206 11.0045 11.0045 14.4473 14.4473 14.7684 14.7684 16.1282 16.1282 16.7753 16.7753 17.2411 17.2411 17.3328 17.3328 k = 0.5000 0.2887 0.1428 ( 2042 PWs) bands (ev): -40.4080 -40.4080 -40.4022 -40.4022 -18.1533 -18.1533 -18.1215 -18.1215 -16.2205 -16.2205 -16.1786 -16.1786 -15.9153 -15.9153 -15.8575 -15.8575 0.0664 0.0664 0.2645 0.2645 8.5822 8.5822 8.7408 8.7408 10.1243 10.1243 10.1927 10.1927 10.7388 10.7388 11.0408 11.0408 14.3920 14.3920 14.7582 14.7582 16.1082 16.1082 16.7697 16.7697 17.2383 17.2383 17.3380 17.3380 k = 0.5000 0.2887 0.1326 ( 2038 PWs) bands (ev): -40.4082 -40.4082 -40.4019 -40.4019 -18.1542 -18.1542 -18.1204 -18.1204 -16.2216 -16.2216 -16.1768 -16.1768 -15.9178 -15.9178 -15.8560 -15.8560 0.0600 0.0600 0.2711 0.2711 8.5873 8.5873 8.7587 8.7587 10.0986 10.0986 10.1721 10.1721 10.7560 10.7560 11.0756 11.0756 14.3358 14.3358 14.7482 14.7482 16.0915 16.0915 16.7619 16.7619 17.2357 17.2357 17.3433 17.3433 k = 0.5000 0.2887 0.1224 ( 2042 PWs) bands (ev): -40.4085 -40.4085 -40.4017 -40.4017 -18.1551 -18.1551 -18.1193 -18.1193 -16.2226 -16.2226 -16.1751 -16.1751 -15.9201 -15.9201 -15.8547 -15.8547 0.0540 0.0540 0.2774 0.2774 8.5926 8.5926 8.7766 8.7766 10.0744 10.0744 10.1527 10.1527 10.7722 10.7722 11.1087 11.1087 14.2795 14.2795 14.7383 14.7383 16.0776 16.0776 16.7526 16.7526 17.2332 17.2332 17.3485 17.3485 k = 0.5000 0.2887 0.1122 ( 2042 PWs) bands (ev): -40.4086 -40.4086 -40.4015 -40.4015 -18.1559 -18.1559 -18.1182 -18.1182 -16.2236 -16.2236 -16.1735 -16.1735 -15.9224 -15.9224 -15.8535 -15.8535 0.0484 0.0484 0.2833 0.2833 8.5982 8.5982 8.7942 8.7942 10.0519 10.0519 10.1344 10.1344 10.7873 10.7873 11.1400 11.1400 14.2242 14.2242 14.7288 14.7288 16.0663 16.0663 16.7423 16.7423 17.2309 17.2309 17.3536 17.3536 k = 0.5000 0.2887 0.1020 ( 2050 PWs) bands (ev): -40.4089 -40.4089 -40.4016 -40.4016 -18.1567 -18.1567 -18.1173 -18.1173 -16.2245 -16.2245 -16.1720 -16.1720 -15.9245 -15.9245 -15.8523 -15.8523 0.0432 0.0432 0.2887 0.2887 8.6037 8.6037 8.8114 8.8114 10.0312 10.0312 10.1175 10.1175 10.8012 10.8012 11.1693 11.1693 14.1705 14.1705 14.7197 14.7197 16.0572 16.0572 16.7313 16.7313 17.2287 17.2287 17.3587 17.3587 k = 0.5000 0.2887 0.0918 ( 2056 PWs) bands (ev): -40.4091 -40.4091 -40.4015 -40.4015 -18.1574 -18.1574 -18.1164 -18.1164 -16.2253 -16.2253 -16.1706 -16.1706 -15.9264 -15.9264 -15.8514 -15.8514 0.0385 0.0385 0.2936 0.2936 8.6092 8.6092 8.8278 8.8278 10.0123 10.0123 10.1018 10.1018 10.8140 10.8140 11.1964 11.1964 14.1194 14.1194 14.7112 14.7112 16.0499 16.0499 16.7201 16.7201 17.2268 17.2268 17.3637 17.3637 k = 0.5000 0.2887 0.0816 ( 2064 PWs) bands (ev): -40.4093 -40.4093 -40.4016 -40.4016 -18.1580 -18.1580 -18.1156 -18.1156 -16.2261 -16.2261 -16.1693 -16.1693 -15.9282 -15.9282 -15.8505 -15.8505 0.0342 0.0342 0.2981 0.2981 8.6144 8.6144 8.8434 8.8434 9.9952 9.9952 10.0876 10.0876 10.8255 10.8255 11.2211 11.2211 14.0715 14.0715 14.7034 14.7034 16.0442 16.0442 16.7092 16.7092 17.2250 17.2250 17.3684 17.3684 k = 0.5000 0.2887 0.0714 ( 2064 PWs) bands (ev): -40.4095 -40.4095 -40.4014 -40.4014 -18.1586 -18.1586 -18.1149 -18.1149 -16.2267 -16.2267 -16.1681 -16.1681 -15.9299 -15.9299 -15.8497 -15.8497 0.0304 0.0304 0.3021 0.3021 8.6194 8.6194 8.8577 8.8577 9.9801 9.9801 10.0749 10.0749 10.8358 10.8358 11.2434 11.2434 14.0277 14.0277 14.6963 14.6963 16.0397 16.0397 16.6987 16.6987 17.2234 17.2234 17.3729 17.3729 k = 0.5000 0.2887 0.0612 ( 2064 PWs) bands (ev): -40.4096 -40.4096 -40.4013 -40.4013 -18.1590 -18.1590 -18.1142 -18.1142 -16.2273 -16.2273 -16.1671 -16.1671 -15.9313 -15.9313 -15.8490 -15.8490 0.0271 0.0271 0.3056 0.3056 8.6239 8.6239 8.8707 8.8707 9.9669 9.9669 10.0637 10.0637 10.8448 10.8448 11.2629 11.2629 13.9884 13.9884 14.6900 14.6900 16.0363 16.0363 16.6890 16.6890 17.2221 17.2221 17.3770 17.3770 k = 0.5000 0.2887 0.0510 ( 2064 PWs) bands (ev): -40.4097 -40.4097 -40.4012 -40.4012 -18.1594 -18.1594 -18.1137 -18.1137 -16.2277 -16.2277 -16.1662 -16.1662 -15.9325 -15.9325 -15.8484 -15.8484 0.0242 0.0242 0.3086 0.3086 8.6279 8.6279 8.8821 8.8821 9.9556 9.9556 10.0541 10.0541 10.8524 10.8524 11.2797 11.2797 13.9542 13.9542 14.6846 14.6846 16.0337 16.0337 16.6804 16.6804 17.2209 17.2209 17.3807 17.3807 k = 0.5000 0.2887 0.0408 ( 2072 PWs) bands (ev): -40.4099 -40.4099 -40.4012 -40.4012 -18.1598 -18.1598 -18.1133 -18.1133 -16.2281 -16.2281 -16.1654 -16.1654 -15.9335 -15.9335 -15.8480 -15.8480 0.0219 0.0219 0.3110 0.3110 8.6313 8.6313 8.8916 8.8916 9.9464 9.9464 10.0461 10.0461 10.8587 10.8587 11.2936 11.2936 13.9255 13.9255 14.6801 14.6801 16.0317 16.0317 16.6730 16.6730 17.2200 17.2200 17.3838 17.3838 k = 0.5000 0.2887 0.0306 ( 2068 PWs) bands (ev): -40.4099 -40.4099 -40.4011 -40.4011 -18.1600 -18.1600 -18.1129 -18.1129 -16.2284 -16.2284 -16.1648 -16.1648 -15.9343 -15.9343 -15.8476 -15.8476 0.0201 0.0201 0.3129 0.3129 8.6340 8.6340 8.8993 8.8993 9.9392 9.9392 10.0399 10.0399 10.8637 10.8637 11.3045 11.3045 13.9029 13.9029 14.6766 14.6766 16.0304 16.0304 16.6672 16.6672 17.2192 17.2192 17.3864 17.3864 k = 0.5000 0.2887 0.0204 ( 2070 PWs) bands (ev): -40.4101 -40.4101 -40.4010 -40.4010 -18.1602 -18.1602 -18.1127 -18.1127 -16.2287 -16.2287 -16.1644 -16.1644 -15.9349 -15.9349 -15.8473 -15.8473 0.0188 0.0188 0.3143 0.3143 8.6360 8.6360 8.9048 8.9048 9.9341 9.9341 10.0355 10.0355 10.8672 10.8672 11.3124 11.3124 13.8865 13.8865 14.6741 14.6741 16.0295 16.0295 16.6629 16.6629 17.2187 17.2187 17.3882 17.3882 k = 0.5000 0.2887 0.0102 ( 2070 PWs) bands (ev): -40.4101 -40.4101 -40.4010 -40.4010 -18.1603 -18.1603 -18.1125 -18.1125 -16.2288 -16.2288 -16.1642 -16.1642 -15.9353 -15.9353 -15.8472 -15.8472 0.0180 0.0180 0.3151 0.3151 8.6372 8.6372 8.9082 8.9082 9.9310 9.9310 10.0328 10.0328 10.8693 10.8693 11.3171 11.3171 13.8765 13.8765 14.6725 14.6725 16.0290 16.0290 16.6602 16.6602 17.2184 17.2184 17.3894 17.3894 k = 0.5000 0.2887-0.0000 ( 2062 PWs) bands (ev): -40.4099 -40.4099 -40.4009 -40.4009 -18.1603 -18.1603 -18.1124 -18.1124 -16.2288 -16.2288 -16.1641 -16.1641 -15.9354 -15.9354 -15.8471 -15.8471 0.0178 0.0178 0.3154 0.3154 8.6376 8.6376 8.9094 8.9094 9.9299 9.9299 10.0319 10.0319 10.8700 10.8700 11.3187 11.3187 13.8732 13.8732 14.6720 14.6720 16.0288 16.0288 16.6594 16.6594 17.2183 17.2183 17.3898 17.3898 k = 0.3333 0.5774-0.0000 ( 2043 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2087 -18.1590 -18.1075 -18.1075 -16.2409 -16.2409 -16.0905 -16.0905 -16.0652 -15.9922 -15.9752 -15.9752 0.1626 0.2635 0.3076 0.3076 8.6441 8.6441 10.1860 10.1860 10.2414 10.3176 10.3176 10.3337 10.5662 10.6081 10.6081 10.6122 13.7640 13.7640 14.4369 14.4369 14.5296 14.6199 14.6199 14.6570 17.2253 17.2253 18.5335 18.5335 k = 0.3333 0.5774 0.0102 ( 2043 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2087 -18.1591 -18.1075 -18.1075 -16.2410 -16.2410 -16.0905 -16.0905 -16.0651 -15.9923 -15.9751 -15.9751 0.1627 0.2634 0.3076 0.3076 8.6453 8.6453 10.1840 10.1840 10.2326 10.3085 10.3085 10.3233 10.5749 10.6173 10.6173 10.6224 13.7645 13.7645 14.4362 14.4362 14.5323 14.6227 14.6227 14.6597 17.2271 17.2271 18.5329 18.5329 k = 0.3333 0.5774 0.0204 ( 2025 PWs) bands (ev): -40.3970 -40.3970 -40.3970 -40.3970 -18.2086 -18.1592 -18.1075 -18.1075 -16.2412 -16.2412 -16.0904 -16.0904 -16.0648 -15.9924 -15.9748 -15.9748 0.1629 0.2631 0.3076 0.3076 8.6488 8.6488 10.1778 10.1778 10.2089 10.2844 10.2844 10.2958 10.5986 10.6420 10.6420 10.6491 13.7661 13.7661 14.4341 14.4341 14.5407 14.6310 14.6310 14.6679 17.2326 17.2326 18.5311 18.5311 k = 0.3333 0.5774 0.0306 ( 2025 PWs) bands (ev): -40.3970 -40.3970 -40.3970 -40.3970 -18.2084 -18.1595 -18.1075 -18.1075 -16.2417 -16.2417 -16.0903 -16.0903 -16.0644 -15.9926 -15.9744 -15.9744 0.1634 0.2626 0.3075 0.3075 8.6546 8.6546 10.1671 10.1671 10.1751 10.2511 10.2511 10.2578 10.6323 10.6764 10.6764 10.6857 13.7688 13.7688 14.4306 14.4306 14.5544 14.6447 14.6447 14.6815 17.2416 17.2416 18.5279 18.5279 k = 0.3333 0.5774 0.0408 ( 2028 PWs) bands (ev): -40.3970 -40.3970 -40.3970 -40.3970 -18.2082 -18.1599 -18.1075 -18.1075 -16.2423 -16.2423 -16.0902 -16.0902 -16.0638 -15.9930 -15.9739 -15.9739 0.1640 0.2619 0.3074 0.3074 8.6627 8.6627 10.1354 10.1511 10.1511 10.2142 10.2142 10.2143 10.6718 10.7160 10.7160 10.7272 13.7725 13.7725 14.4258 14.4258 14.5737 14.6638 14.6638 14.7004 17.2542 17.2542 18.5234 18.5234 k = 0.3333 0.5774 0.0510 ( 2046 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2079 -18.1605 -18.1076 -18.1076 -16.2431 -16.2431 -16.0901 -16.0901 -16.0631 -15.9934 -15.9732 -15.9732 0.1647 0.2611 0.3073 0.3073 8.6730 8.6730 10.0927 10.1277 10.1277 10.1681 10.1784 10.1784 10.7143 10.7583 10.7583 10.7709 13.7772 13.7772 14.4195 14.4195 14.5983 14.6883 14.6883 14.7246 17.2701 17.2701 18.5175 18.5175 k = 0.3333 0.5774 0.0612 ( 2046 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2075 -18.1611 -18.1076 -18.1076 -16.2440 -16.2440 -16.0899 -16.0899 -16.0622 -15.9940 -15.9724 -15.9724 0.1657 0.2600 0.3071 0.3071 8.6857 8.6857 10.0485 10.0955 10.0955 10.1207 10.1470 10.1470 10.7582 10.8014 10.8014 10.8152 13.7829 13.7829 14.4120 14.4120 14.6282 14.7181 14.7181 14.7540 17.2892 17.2892 18.5011 18.5102 k = 0.3333 0.5774 0.0714 ( 2046 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2071 -18.1618 -18.1076 -18.1076 -16.2450 -16.2450 -16.0897 -16.0897 -16.0611 -15.9946 -15.9715 -15.9715 0.1668 0.2588 0.3069 0.3069 8.7006 8.7006 10.0041 10.0567 10.0567 10.0731 10.1188 10.1188 10.8022 10.8445 10.8445 10.8591 13.7897 13.7897 14.4031 14.4031 14.6633 14.7532 14.7532 14.7886 17.3115 17.3115 18.4553 18.5013 k = 0.3333 0.5774 0.0816 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.2066 -18.1626 -18.1077 -18.1077 -16.2462 -16.2462 -16.0895 -16.0895 -16.0600 -15.9954 -15.9705 -15.9705 0.1680 0.2574 0.3067 0.3067 8.7176 8.7176 9.9601 10.0152 10.0152 10.0260 10.0907 10.0907 10.8457 10.8868 10.8868 10.9020 13.7974 13.7974 14.3930 14.3930 14.7035 14.7934 14.7934 14.8281 17.3368 17.3368 18.4036 18.4896 k = 0.3333 0.5774 0.0918 ( 2046 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2060 -18.1635 -18.1077 -18.1077 -16.2474 -16.2474 -16.0893 -16.0893 -16.0586 -15.9962 -15.9693 -15.9693 0.1694 0.2558 0.3065 0.3065 8.7369 8.7369 9.9170 9.9732 9.9732 9.9798 10.0613 10.0613 10.8883 10.9280 10.9280 10.9434 13.8061 13.8061 14.3817 14.3817 14.7487 14.8385 14.8385 14.8723 17.3647 17.3647 18.3465 18.4608 k = 0.3333 0.5774 0.1020 ( 2046 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2054 -18.1645 -18.1077 -18.1077 -16.2486 -16.2486 -16.0891 -16.0891 -16.0571 -15.9971 -15.9682 -15.9682 0.1710 0.2541 0.3063 0.3063 8.7583 8.7583 9.8752 9.9318 9.9318 9.9349 10.0298 10.0298 10.9294 10.9676 10.9676 10.9831 13.8158 13.8158 14.3693 14.3693 14.7985 14.8882 14.8882 14.9211 17.3952 17.3952 18.2844 18.3989 k = 0.3333 0.5774 0.1122 ( 2046 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.2046 -18.1656 -18.1078 -18.1078 -16.2500 -16.2500 -16.0888 -16.0888 -16.0555 -15.9982 -15.9669 -15.9669 0.1727 0.2522 0.3060 0.3060 8.7818 8.7818 9.8350 9.8915 9.8915 9.8916 9.9963 9.9963 10.9689 11.0053 11.0053 11.0207 13.8264 13.8264 14.3558 14.3558 14.8527 14.9424 14.9424 14.9741 17.4280 17.4280 18.2180 18.3287 k = 0.3333 0.5774 0.1224 ( 2058 PWs) bands (ev): -40.3975 -40.3975 -40.3975 -40.3975 -18.2039 -18.1668 -18.1078 -18.1078 -16.2513 -16.2513 -16.0886 -16.0886 -16.0539 -15.9993 -15.9657 -15.9657 0.1745 0.2501 0.3058 0.3058 8.8073 8.8073 9.7967 9.8500 9.8529 9.8529 9.9608 9.9608 11.0064 11.0411 11.0411 11.0560 13.8379 13.8379 14.3414 14.3414 14.9110 15.0007 15.0007 15.0309 17.4627 17.4627 18.1476 18.2540 k = 0.3333 0.5774 0.1326 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.2031 -18.1680 -18.1079 -18.1079 -16.2527 -16.2527 -16.0884 -16.0884 -16.0521 -16.0005 -15.9644 -15.9644 0.1765 0.2480 0.3055 0.3055 8.8347 8.8347 9.7605 9.8104 9.8160 9.8160 9.9233 9.9233 11.0419 11.0746 11.0746 11.0891 13.8503 13.8503 14.3260 14.3260 14.9731 15.0627 15.0627 15.0913 17.4993 17.4993 18.0741 18.1758 k = 0.3333 0.5774 0.1428 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.2022 -18.1693 -18.1079 -18.1079 -16.2540 -16.2540 -16.0882 -16.0882 -16.0502 -16.0018 -15.9631 -15.9631 0.1786 0.2456 0.3052 0.3052 8.8641 8.8641 9.7265 9.7729 9.7813 9.7813 9.8841 9.8841 11.0752 11.1059 11.1059 11.1196 13.8635 13.8635 14.3098 14.3098 15.0384 15.1280 15.1280 15.1546 17.5373 17.5373 17.9981 18.0950 k = 0.3333 0.5774 0.1530 ( 2058 PWs) bands (ev): -40.3975 -40.3975 -40.3975 -40.3975 -18.2012 -18.1706 -18.1080 -18.1080 -16.2553 -16.2553 -16.0880 -16.0880 -16.0482 -16.0032 -15.9619 -15.9619 0.1809 0.2432 0.3050 0.3050 8.8953 8.8953 9.6949 9.7378 9.7487 9.7487 9.8434 9.8434 11.1061 11.1348 11.1348 11.1476 13.8775 13.8775 14.2928 14.2928 15.1065 15.1960 15.1960 15.2203 17.5763 17.5763 17.9204 18.0123 k = 0.3333 0.5774 0.1631 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.2002 -18.1720 -18.1080 -18.1080 -16.2565 -16.2565 -16.0878 -16.0878 -16.0461 -16.0047 -15.9607 -15.9607 0.1832 0.2407 0.3047 0.3047 8.9283 8.9283 9.6658 9.7051 9.7184 9.7184 9.8014 9.8014 11.1347 11.1612 11.1612 11.1729 13.8923 13.8923 14.2752 14.2752 15.1767 15.2660 15.2660 15.2875 17.6159 17.6159 17.8419 17.9291 k = 0.3333 0.5774 0.1733 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.1991 -18.1735 -18.1080 -18.1080 -16.2577 -16.2577 -16.0877 -16.0877 -16.0440 -16.0063 -15.9595 -15.9595 0.1857 0.2380 0.3045 0.3045 8.9629 8.9629 9.6394 9.6750 9.6905 9.6905 9.7583 9.7583 11.1608 11.1852 11.1852 11.1957 13.9078 13.9078 14.2570 14.2570 15.2483 15.3372 15.3372 15.3554 17.6545 17.6545 17.7636 17.8474 k = 0.3333 0.5774 0.1835 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.1980 -18.1749 -18.1081 -18.1081 -16.2588 -16.2588 -16.0875 -16.0875 -16.0418 -16.0080 -15.9585 -15.9585 0.1883 0.2353 0.3043 0.3043 8.9991 8.9991 9.6157 9.6476 9.6648 9.6648 9.7147 9.7147 11.1844 11.2066 11.2066 11.2158 13.9239 13.9239 14.2383 14.2383 15.3204 15.4087 15.4087 15.4228 17.6846 17.6846 17.6868 17.7758 k = 0.3333 0.5774 0.1937 ( 2043 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.1967 -18.1764 -18.1081 -18.1081 -16.2598 -16.2598 -16.0874 -16.0874 -16.0396 -16.0097 -15.9575 -15.9575 0.1910 0.2324 0.3041 0.3041 9.0367 9.0367 9.5949 9.6230 9.6405 9.6405 9.6717 9.6717 11.2055 11.2255 11.2255 11.2332 13.9407 13.9407 14.2192 14.2192 15.3919 15.4792 15.4792 15.4885 17.6130 17.6584 17.6584 17.7388 k = 0.3333 0.5774 0.2039 ( 2043 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.1955 -18.1779 -18.1081 -18.1081 -16.2607 -16.2607 -16.0873 -16.0873 -16.0374 -16.0115 -15.9566 -15.9566 0.1937 0.2296 0.3039 0.3039 9.0757 9.0757 9.5770 9.6012 9.6119 9.6119 9.6353 9.6353 11.2240 11.2418 11.2418 11.2480 13.9579 13.9579 14.1999 14.1999 15.4614 15.5472 15.5472 15.5508 17.5438 17.5894 17.5894 17.6583 k = 0.3333 0.5774 0.2141 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.1942 -18.1795 -18.1082 -18.1082 -16.2615 -16.2615 -16.0872 -16.0872 -16.0351 -16.0135 -15.9558 -15.9558 0.1965 0.2266 0.3037 0.3037 9.1159 9.1159 9.5620 9.5716 9.5716 9.5823 9.6131 9.6131 11.2400 11.2556 11.2556 11.2601 13.9756 13.9756 14.1804 14.1804 15.5274 15.6076 15.6110 15.6110 17.4812 17.5196 17.5196 17.5824 k = 0.3333 0.5774 0.2243 ( 2046 PWs) bands (ev): -40.3973 -40.3973 -40.3973 -40.3973 -18.1929 -18.1810 -18.1082 -18.1082 -16.2621 -16.2621 -16.0871 -16.0871 -16.0328 -16.0154 -15.9552 -15.9552 0.1994 0.2236 0.3036 0.3036 9.1570 9.1570 9.5271 9.5271 9.5501 9.5664 9.5980 9.5980 11.2535 11.2669 11.2669 11.2697 13.9935 13.9935 14.1610 14.1610 15.5882 15.6570 15.6685 15.6685 17.4276 17.4563 17.4563 17.5132 k = 0.3333 0.5774 0.2345 ( 2049 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.1915 -18.1826 -18.1082 -18.1082 -16.2626 -16.2626 -16.0871 -16.0871 -16.0306 -16.0175 -15.9547 -15.9547 0.2024 0.2206 0.3035 0.3035 9.1987 9.1987 9.4822 9.4822 9.5413 9.5535 9.5868 9.5868 11.2644 11.2757 11.2757 11.2766 14.0114 14.0114 14.1419 14.1419 15.6415 15.6963 15.7171 15.7171 17.3853 17.4027 17.4027 17.4528 k = 0.3333 0.5774 0.2447 ( 2058 PWs) bands (ev): -40.3975 -40.3975 -40.3975 -40.3975 -18.1901 -18.1841 -18.1082 -18.1082 -16.2630 -16.2630 -16.0870 -16.0870 -16.0283 -16.0196 -15.9543 -15.9543 0.2054 0.2175 0.3034 0.3034 9.2402 9.2402 9.4382 9.4382 9.5355 9.5437 9.5790 9.5790 11.2728 11.2809 11.2819 11.2819 14.0286 14.0286 14.1237 14.1237 15.6850 15.7233 15.7544 15.7544 17.3567 17.3617 17.3617 17.4035 k = 0.3333 0.5774 0.2549 ( 2058 PWs) bands (ev): -40.3975 -40.3975 -40.3975 -40.3975 -18.1886 -18.1857 -18.1082 -18.1082 -16.2632 -16.2632 -16.0870 -16.0870 -16.0261 -16.0217 -15.9541 -15.9541 0.2084 0.2145 0.3034 0.3034 9.2787 9.2787 9.3981 9.3981 9.5329 9.5370 9.5743 9.5743 11.2786 11.2827 11.2857 11.2857 14.0435 14.0435 14.1083 14.1083 15.7164 15.7362 15.7779 15.7779 17.3360 17.3360 17.3437 17.3678 k = 0.3333 0.5774 0.2651 ( 2052 PWs) bands (ev): -40.3974 -40.3974 -40.3974 -40.3974 -18.1871 -18.1871 -18.1082 -18.1082 -16.2632 -16.2632 -16.0870 -16.0870 -16.0239 -16.0239 -15.9540 -15.9540 0.2114 0.2114 0.3034 0.3034 9.2997 9.2997 9.3766 9.3766 9.5333 9.5333 9.5727 9.5727 11.2820 11.2820 11.2869 11.2869 14.0504 14.0504 14.1012 14.1012 15.7339 15.7339 15.7860 15.7860 17.3272 17.3272 17.3475 17.3475 Writing output data file NbN.save init_run : 2.45s CPU 14.06s WALL ( 1 calls) electrons : 464.95s CPU 475.44s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.56s CPU 1.51s WALL ( 1 calls) Called by electrons: c_bands : 464.92s CPU 474.53s WALL ( 1 calls) v_of_rho : 0.24s CPU 0.97s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.24s CPU 0.58s WALL ( 1 calls) newd : 0.36s CPU 0.44s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.21s WALL ( 399 calls) cegterg : 298.52s CPU 301.41s WALL ( 509 calls) Called by sum_band: Called by *egterg: h_psi : 139.81s CPU 145.42s WALL ( 9082 calls) s_psi : 13.02s CPU 13.57s WALL ( 9082 calls) g_psi : 0.27s CPU 0.31s WALL ( 8174 calls) cdiaghg : 115.14s CPU 113.88s WALL ( 8573 calls) cegterg:over : 27.16s CPU 24.54s WALL ( 8174 calls) cegterg:upda : 3.33s CPU 5.46s WALL ( 8174 calls) cegterg:last : 3.66s CPU 4.33s WALL ( 1706 calls) Called by h_psi: h_psi:vloc : 113.64s CPU 118.36s WALL ( 9082 calls) h_psi:vnl : 26.09s CPU 26.76s WALL ( 9082 calls) add_vuspsi : 6.85s CPU 9.99s WALL ( 9082 calls) General routines calbec : 19.22s CPU 16.72s WALL ( 9082 calls) fft : 0.39s CPU 1.60s WALL ( 19 calls) ffts : 0.01s CPU 0.02s WALL ( 4 calls) fftw : 107.83s CPU 112.68s WALL ( 971780 calls) interpolate : 0.05s CPU 0.05s WALL ( 4 calls) davcio : 0.02s CPU 7.70s WALL ( 798 calls) Parallel routines fft_scatter : 70.32s CPU 73.21s WALL ( 971803 calls) PWSCF : 9m13.08s CPU 11m27.05s WALL This run was terminated on: 23:23:24 26Jun2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=