Program PWSCF v.5.4.0 starts on 10Feb2017 at 15:42:37 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 & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CoO.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 22 22 6 858 837 132 Max 23 23 7 867 855 139 Sum 823 817 241 31095 30429 4903 bravais-lattice index = 14 lattice parameter (alat) = 6.0660 a.u. unit-cell volume = 315.5502 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 324.0000 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)= 1.632399 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 1.632399 ) 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 0.612595 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Co read from file: /users/gautes/Pseudo/Co.rel-pbe-oncvpsp.UPF MD5 check sum: 638ceb3e57836b9ea4bada7149e48805 Pseudo is Norm-conserving, Zval = 17.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1388 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Co 17.00 58.93320 Co( 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 ) ( 0.8161994 ) 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 ) ( 0.8161994 ) 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 ) ( 0.8161994 ) 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 ) ( 0.8161994 ) 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 ) ( 0.8161994 ) 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 ) ( 0.8161994 ) 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 2C6 -2C6 2C3 -2C3 C2 3s_v 3s_d -C2 -3s_v -3s_d G_7 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 G_8 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 G_9 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C6 3 4 60 deg rotation - cryst. axis [0,0,1] -2C6 -3 -4 60 deg rotation - cryst. axis [0,0,1] E 2C3 5 6 120 deg rotation - cryst. axis [0,0,1] -2C3 -5 -6 120 deg rotation - cryst. axis [0,0,1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 3s_v-3s_v 7 -7 9 10 -10 -9 inv. 180 deg rotation - cart. axis [0,1,0] 3s_d-3s_d 8 -8 12 -11 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] Cartesian axes number of k points= 411 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024331 k( 2) = ( 0.0087719 0.0050645 -0.0000000), wk = 0.0024331 k( 3) = ( 0.0175439 0.0101290 -0.0000000), wk = 0.0024331 k( 4) = ( 0.0263158 0.0151934 -0.0000000), wk = 0.0024331 k( 5) = ( 0.0350877 0.0202579 -0.0000000), wk = 0.0024331 k( 6) = ( 0.0438597 0.0253224 -0.0000000), wk = 0.0024331 k( 7) = ( 0.0526316 0.0303869 -0.0000000), wk = 0.0024331 k( 8) = ( 0.0614035 0.0354513 -0.0000000), wk = 0.0024331 k( 9) = ( 0.0701754 0.0405158 -0.0000000), wk = 0.0024331 k( 10) = ( 0.0789474 0.0455803 -0.0000000), wk = 0.0024331 k( 11) = ( 0.0877193 0.0506448 -0.0000000), wk = 0.0024331 k( 12) = ( 0.0964912 0.0557092 -0.0000000), wk = 0.0024331 k( 13) = ( 0.1052632 0.0607737 -0.0000000), wk = 0.0024331 k( 14) = ( 0.1140351 0.0658382 -0.0000000), wk = 0.0024331 k( 15) = ( 0.1228070 0.0709027 -0.0000000), wk = 0.0024331 k( 16) = ( 0.1315790 0.0759671 -0.0000000), wk = 0.0024331 k( 17) = ( 0.1403509 0.0810316 -0.0000000), wk = 0.0024331 k( 18) = ( 0.1491228 0.0860961 -0.0000000), wk = 0.0024331 k( 19) = ( 0.1578947 0.0911606 -0.0000000), wk = 0.0024331 k( 20) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0024331 k( 21) = ( 0.1754386 0.1012895 -0.0000000), wk = 0.0024331 k( 22) = ( 0.1842105 0.1063540 -0.0000000), wk = 0.0024331 k( 23) = ( 0.1929825 0.1114185 -0.0000000), wk = 0.0024331 k( 24) = ( 0.2017544 0.1164830 -0.0000000), wk = 0.0024331 k( 25) = ( 0.2105263 0.1215474 -0.0000000), wk = 0.0024331 k( 26) = ( 0.2192983 0.1266119 -0.0000000), wk = 0.0024331 k( 27) = ( 0.2280702 0.1316764 -0.0000000), wk = 0.0024331 k( 28) = ( 0.2368421 0.1367409 -0.0000000), wk = 0.0024331 k( 29) = ( 0.2456140 0.1418053 -0.0000000), wk = 0.0024331 k( 30) = ( 0.2543860 0.1468698 -0.0000000), wk = 0.0024331 k( 31) = ( 0.2631579 0.1519343 -0.0000000), wk = 0.0024331 k( 32) = ( 0.2719298 0.1569988 -0.0000000), wk = 0.0024331 k( 33) = ( 0.2807018 0.1620632 -0.0000000), wk = 0.0024331 k( 34) = ( 0.2894737 0.1671277 -0.0000000), wk = 0.0024331 k( 35) = ( 0.2982456 0.1721922 -0.0000000), wk = 0.0024331 k( 36) = ( 0.3070175 0.1772567 -0.0000000), wk = 0.0024331 k( 37) = ( 0.3157895 0.1823211 -0.0000000), wk = 0.0024331 k( 38) = ( 0.3245614 0.1873856 -0.0000000), wk = 0.0024331 k( 39) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0024331 k( 40) = ( 0.3421053 0.1975146 -0.0000000), wk = 0.0024331 k( 41) = ( 0.3508772 0.2025790 -0.0000000), wk = 0.0024331 k( 42) = ( 0.3596491 0.2076435 -0.0000000), wk = 0.0024331 k( 43) = ( 0.3684211 0.2127080 -0.0000000), wk = 0.0024331 k( 44) = ( 0.3771930 0.2177725 -0.0000000), wk = 0.0024331 k( 45) = ( 0.3859649 0.2228369 -0.0000000), wk = 0.0024331 k( 46) = ( 0.3947368 0.2279014 -0.0000000), wk = 0.0024331 k( 47) = ( 0.4035088 0.2329659 -0.0000000), wk = 0.0024331 k( 48) = ( 0.4122807 0.2380304 -0.0000000), wk = 0.0024331 k( 49) = ( 0.4210526 0.2430948 -0.0000000), wk = 0.0024331 k( 50) = ( 0.4298246 0.2481593 -0.0000000), wk = 0.0024331 k( 51) = ( 0.4385965 0.2532238 -0.0000000), wk = 0.0024331 k( 52) = ( 0.4473684 0.2582883 -0.0000000), wk = 0.0024331 k( 53) = ( 0.4561404 0.2633528 -0.0000000), wk = 0.0024331 k( 54) = ( 0.4649123 0.2684172 -0.0000000), wk = 0.0024331 k( 55) = ( 0.4736842 0.2734817 -0.0000000), wk = 0.0024331 k( 56) = ( 0.4824561 0.2785462 -0.0000000), wk = 0.0024331 k( 57) = ( 0.4912281 0.2836107 -0.0000000), wk = 0.0024331 k( 58) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0024331 k( 59) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0024331 k( 60) = ( 0.4949495 0.2974229 -0.0000000), wk = 0.0024331 k( 61) = ( 0.4898990 0.3061706 -0.0000000), wk = 0.0024331 k( 62) = ( 0.4848485 0.3149183 -0.0000000), wk = 0.0024331 k( 63) = ( 0.4797980 0.3236661 -0.0000000), wk = 0.0024331 k( 64) = ( 0.4747475 0.3324138 -0.0000000), wk = 0.0024331 k( 65) = ( 0.4696970 0.3411615 -0.0000000), wk = 0.0024331 k( 66) = ( 0.4646465 0.3499093 -0.0000000), wk = 0.0024331 k( 67) = ( 0.4595960 0.3586570 -0.0000000), wk = 0.0024331 k( 68) = ( 0.4545455 0.3674047 -0.0000000), wk = 0.0024331 k( 69) = ( 0.4494950 0.3761524 -0.0000000), wk = 0.0024331 k( 70) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0024331 k( 71) = ( 0.4393939 0.3936479 -0.0000000), wk = 0.0024331 k( 72) = ( 0.4343434 0.4023956 -0.0000000), wk = 0.0024331 k( 73) = ( 0.4292929 0.4111434 -0.0000000), wk = 0.0024331 k( 74) = ( 0.4242424 0.4198911 -0.0000000), wk = 0.0024331 k( 75) = ( 0.4191919 0.4286388 -0.0000000), wk = 0.0024331 k( 76) = ( 0.4141414 0.4373866 -0.0000000), wk = 0.0024331 k( 77) = ( 0.4090909 0.4461343 -0.0000000), wk = 0.0024331 k( 78) = ( 0.4040404 0.4548820 -0.0000000), wk = 0.0024331 k( 79) = ( 0.3989899 0.4636298 -0.0000000), wk = 0.0024331 k( 80) = ( 0.3939394 0.4723775 -0.0000000), wk = 0.0024331 k( 81) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0024331 k( 82) = ( 0.3838384 0.4898730 -0.0000000), wk = 0.0024331 k( 83) = ( 0.3787879 0.4986207 -0.0000000), wk = 0.0024331 k( 84) = ( 0.3737374 0.5073684 -0.0000000), wk = 0.0024331 k( 85) = ( 0.3686869 0.5161161 -0.0000000), wk = 0.0024331 k( 86) = ( 0.3636364 0.5248639 -0.0000000), wk = 0.0024331 k( 87) = ( 0.3585859 0.5336116 -0.0000000), wk = 0.0024331 k( 88) = ( 0.3535354 0.5423593 -0.0000000), wk = 0.0024331 k( 89) = ( 0.3484849 0.5511071 -0.0000000), wk = 0.0024331 k( 90) = ( 0.3434343 0.5598548 -0.0000000), wk = 0.0024331 k( 91) = ( 0.3383838 0.5686025 -0.0000000), wk = 0.0024331 k( 92) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0024331 k( 93) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0024331 k( 94) = ( 0.3282828 0.5686025 -0.0000000), wk = 0.0024331 k( 95) = ( 0.3232323 0.5598548 -0.0000000), wk = 0.0024331 k( 96) = ( 0.3181818 0.5511071 -0.0000000), wk = 0.0024331 k( 97) = ( 0.3131313 0.5423593 -0.0000000), wk = 0.0024331 k( 98) = ( 0.3080808 0.5336116 -0.0000000), wk = 0.0024331 k( 99) = ( 0.3030303 0.5248639 -0.0000000), wk = 0.0024331 k( 100) = ( 0.2979798 0.5161162 -0.0000000), wk = 0.0024331 k( 101) = ( 0.2929293 0.5073684 -0.0000000), wk = 0.0024331 k( 102) = ( 0.2878788 0.4986207 -0.0000000), wk = 0.0024331 k( 103) = ( 0.2828283 0.4898730 -0.0000000), wk = 0.0024331 k( 104) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0024331 k( 105) = ( 0.2727273 0.4723775 -0.0000000), wk = 0.0024331 k( 106) = ( 0.2676768 0.4636298 -0.0000000), wk = 0.0024331 k( 107) = ( 0.2626263 0.4548820 -0.0000000), wk = 0.0024331 k( 108) = ( 0.2575758 0.4461343 -0.0000000), wk = 0.0024331 k( 109) = ( 0.2525252 0.4373866 -0.0000000), wk = 0.0024331 k( 110) = ( 0.2474747 0.4286388 -0.0000000), wk = 0.0024331 k( 111) = ( 0.2424242 0.4198911 -0.0000000), wk = 0.0024331 k( 112) = ( 0.2373737 0.4111434 -0.0000000), wk = 0.0024331 k( 113) = ( 0.2323232 0.4023956 -0.0000000), wk = 0.0024331 k( 114) = ( 0.2272727 0.3936479 -0.0000000), wk = 0.0024331 k( 115) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0024331 k( 116) = ( 0.2171717 0.3761525 -0.0000000), wk = 0.0024331 k( 117) = ( 0.2121212 0.3674047 -0.0000000), wk = 0.0024331 k( 118) = ( 0.2070707 0.3586570 -0.0000000), wk = 0.0024331 k( 119) = ( 0.2020202 0.3499093 -0.0000000), wk = 0.0024331 k( 120) = ( 0.1969697 0.3411615 -0.0000000), wk = 0.0024331 k( 121) = ( 0.1919192 0.3324138 -0.0000000), wk = 0.0024331 k( 122) = ( 0.1868687 0.3236661 -0.0000000), wk = 0.0024331 k( 123) = ( 0.1818182 0.3149183 -0.0000000), wk = 0.0024331 k( 124) = ( 0.1767677 0.3061706 -0.0000000), wk = 0.0024331 k( 125) = ( 0.1717172 0.2974229 -0.0000000), wk = 0.0024331 k( 126) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0024331 k( 127) = ( 0.1616162 0.2799274 -0.0000000), wk = 0.0024331 k( 128) = ( 0.1565657 0.2711797 -0.0000000), wk = 0.0024331 k( 129) = ( 0.1515151 0.2624319 -0.0000000), wk = 0.0024331 k( 130) = ( 0.1464647 0.2536842 -0.0000000), wk = 0.0024331 k( 131) = ( 0.1414141 0.2449365 -0.0000000), wk = 0.0024331 k( 132) = ( 0.1363636 0.2361888 -0.0000000), wk = 0.0024331 k( 133) = ( 0.1313131 0.2274410 -0.0000000), wk = 0.0024331 k( 134) = ( 0.1262626 0.2186933 -0.0000000), wk = 0.0024331 k( 135) = ( 0.1212121 0.2099456 -0.0000000), wk = 0.0024331 k( 136) = ( 0.1161616 0.2011978 -0.0000000), wk = 0.0024331 k( 137) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0024331 k( 138) = ( 0.1060606 0.1837024 -0.0000000), wk = 0.0024331 k( 139) = ( 0.1010101 0.1749546 -0.0000000), wk = 0.0024331 k( 140) = ( 0.0959596 0.1662069 -0.0000000), wk = 0.0024331 k( 141) = ( 0.0909091 0.1574592 -0.0000000), wk = 0.0024331 k( 142) = ( 0.0858586 0.1487114 -0.0000000), wk = 0.0024331 k( 143) = ( 0.0808081 0.1399637 -0.0000000), wk = 0.0024331 k( 144) = ( 0.0757576 0.1312160 -0.0000000), wk = 0.0024331 k( 145) = ( 0.0707071 0.1224682 -0.0000000), wk = 0.0024331 k( 146) = ( 0.0656566 0.1137205 -0.0000000), wk = 0.0024331 k( 147) = ( 0.0606061 0.1049728 -0.0000000), wk = 0.0024331 k( 148) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0024331 k( 149) = ( 0.0505051 0.0874773 -0.0000000), wk = 0.0024331 k( 150) = ( 0.0454546 0.0787296 -0.0000000), wk = 0.0024331 k( 151) = ( 0.0404040 0.0699819 -0.0000000), wk = 0.0024331 k( 152) = ( 0.0353535 0.0612341 -0.0000000), wk = 0.0024331 k( 153) = ( 0.0303030 0.0524864 -0.0000000), wk = 0.0024331 k( 154) = ( 0.0252525 0.0437387 -0.0000000), wk = 0.0024331 k( 155) = ( 0.0202020 0.0349909 -0.0000000), wk = 0.0024331 k( 156) = ( 0.0151515 0.0262432 -0.0000000), wk = 0.0024331 k( 157) = ( 0.0101010 0.0174955 -0.0000000), wk = 0.0024331 k( 158) = ( 0.0050505 0.0087477 -0.0000000), wk = 0.0024331 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024331 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024331 k( 161) = ( 0.0000000 0.0000000 0.0102099), wk = 0.0024331 k( 162) = ( 0.0000000 0.0000000 0.0204198), wk = 0.0024331 k( 163) = ( 0.0000000 0.0000000 0.0306298), wk = 0.0024331 k( 164) = ( 0.0000000 0.0000000 0.0408397), wk = 0.0024331 k( 165) = ( 0.0000000 0.0000000 0.0510496), wk = 0.0024331 k( 166) = ( 0.0000000 0.0000000 0.0612595), wk = 0.0024331 k( 167) = ( 0.0000000 0.0000000 0.0714695), wk = 0.0024331 k( 168) = ( 0.0000000 0.0000000 0.0816794), wk = 0.0024331 k( 169) = ( 0.0000000 0.0000000 0.0918893), wk = 0.0024331 k( 170) = ( 0.0000000 0.0000000 0.1020992), wk = 0.0024331 k( 171) = ( 0.0000000 0.0000000 0.1123092), wk = 0.0024331 k( 172) = ( 0.0000000 0.0000000 0.1225191), wk = 0.0024331 k( 173) = ( 0.0000000 0.0000000 0.1327290), wk = 0.0024331 k( 174) = ( 0.0000000 0.0000000 0.1429389), wk = 0.0024331 k( 175) = ( 0.0000000 0.0000000 0.1531489), wk = 0.0024331 k( 176) = ( 0.0000000 0.0000000 0.1633588), wk = 0.0024331 k( 177) = ( 0.0000000 0.0000000 0.1735687), wk = 0.0024331 k( 178) = ( 0.0000000 0.0000000 0.1837786), wk = 0.0024331 k( 179) = ( 0.0000000 0.0000000 0.1939886), wk = 0.0024331 k( 180) = ( 0.0000000 0.0000000 0.2041985), wk = 0.0024331 k( 181) = ( 0.0000000 0.0000000 0.2144084), wk = 0.0024331 k( 182) = ( 0.0000000 0.0000000 0.2246183), wk = 0.0024331 k( 183) = ( 0.0000000 0.0000000 0.2348282), wk = 0.0024331 k( 184) = ( 0.0000000 0.0000000 0.2450382), wk = 0.0024331 k( 185) = ( 0.0000000 0.0000000 0.2552481), wk = 0.0024331 k( 186) = ( 0.0000000 0.0000000 0.2654580), wk = 0.0024331 k( 187) = ( 0.0000000 0.0000000 0.2756679), wk = 0.0024331 k( 188) = ( 0.0000000 0.0000000 0.2858779), wk = 0.0024331 k( 189) = ( 0.0000000 0.0000000 0.2960878), wk = 0.0024331 k( 190) = ( 0.0000000 0.0000000 0.3062977), wk = 0.0024331 k( 191) = ( 0.0000000 0.0000000 0.3062977), wk = 0.0024331 k( 192) = ( 0.0087719 0.0050645 0.3062977), wk = 0.0024331 k( 193) = ( 0.0175439 0.0101290 0.3062977), wk = 0.0024331 k( 194) = ( 0.0263158 0.0151934 0.3062977), wk = 0.0024331 k( 195) = ( 0.0350877 0.0202579 0.3062977), wk = 0.0024331 k( 196) = ( 0.0438597 0.0253224 0.3062977), wk = 0.0024331 k( 197) = ( 0.0526316 0.0303869 0.3062977), wk = 0.0024331 k( 198) = ( 0.0614035 0.0354513 0.3062977), wk = 0.0024331 k( 199) = ( 0.0701754 0.0405158 0.3062977), wk = 0.0024331 k( 200) = ( 0.0789474 0.0455803 0.3062977), wk = 0.0024331 k( 201) = ( 0.0877193 0.0506448 0.3062977), wk = 0.0024331 k( 202) = ( 0.0964912 0.0557092 0.3062977), wk = 0.0024331 k( 203) = ( 0.1052632 0.0607737 0.3062977), wk = 0.0024331 k( 204) = ( 0.1140351 0.0658382 0.3062977), wk = 0.0024331 k( 205) = ( 0.1228070 0.0709027 0.3062977), wk = 0.0024331 k( 206) = ( 0.1315790 0.0759671 0.3062977), wk = 0.0024331 k( 207) = ( 0.1403509 0.0810316 0.3062977), wk = 0.0024331 k( 208) = ( 0.1491228 0.0860961 0.3062977), wk = 0.0024331 k( 209) = ( 0.1578947 0.0911606 0.3062977), wk = 0.0024331 k( 210) = ( 0.1666667 0.0962250 0.3062977), wk = 0.0024331 k( 211) = ( 0.1754386 0.1012895 0.3062977), wk = 0.0024331 k( 212) = ( 0.1842105 0.1063540 0.3062977), wk = 0.0024331 k( 213) = ( 0.1929825 0.1114185 0.3062977), wk = 0.0024331 k( 214) = ( 0.2017544 0.1164830 0.3062977), wk = 0.0024331 k( 215) = ( 0.2105263 0.1215474 0.3062977), wk = 0.0024331 k( 216) = ( 0.2192983 0.1266119 0.3062977), wk = 0.0024331 k( 217) = ( 0.2280702 0.1316764 0.3062977), wk = 0.0024331 k( 218) = ( 0.2368421 0.1367409 0.3062977), wk = 0.0024331 k( 219) = ( 0.2456140 0.1418053 0.3062977), wk = 0.0024331 k( 220) = ( 0.2543860 0.1468698 0.3062977), wk = 0.0024331 k( 221) = ( 0.2631579 0.1519343 0.3062977), wk = 0.0024331 k( 222) = ( 0.2719298 0.1569988 0.3062977), wk = 0.0024331 k( 223) = ( 0.2807018 0.1620632 0.3062977), wk = 0.0024331 k( 224) = ( 0.2894737 0.1671277 0.3062977), wk = 0.0024331 k( 225) = ( 0.2982456 0.1721922 0.3062977), wk = 0.0024331 k( 226) = ( 0.3070175 0.1772567 0.3062977), wk = 0.0024331 k( 227) = ( 0.3157895 0.1823211 0.3062977), wk = 0.0024331 k( 228) = ( 0.3245614 0.1873856 0.3062977), wk = 0.0024331 k( 229) = ( 0.3333333 0.1924501 0.3062977), wk = 0.0024331 k( 230) = ( 0.3421053 0.1975146 0.3062977), wk = 0.0024331 k( 231) = ( 0.3508772 0.2025790 0.3062977), wk = 0.0024331 k( 232) = ( 0.3596491 0.2076435 0.3062977), wk = 0.0024331 k( 233) = ( 0.3684211 0.2127080 0.3062977), wk = 0.0024331 k( 234) = ( 0.3771930 0.2177725 0.3062977), wk = 0.0024331 k( 235) = ( 0.3859649 0.2228369 0.3062977), wk = 0.0024331 k( 236) = ( 0.3947368 0.2279014 0.3062977), wk = 0.0024331 k( 237) = ( 0.4035088 0.2329659 0.3062977), wk = 0.0024331 k( 238) = ( 0.4122807 0.2380304 0.3062977), wk = 0.0024331 k( 239) = ( 0.4210526 0.2430948 0.3062977), wk = 0.0024331 k( 240) = ( 0.4298246 0.2481593 0.3062977), wk = 0.0024331 k( 241) = ( 0.4385965 0.2532238 0.3062977), wk = 0.0024331 k( 242) = ( 0.4473684 0.2582883 0.3062977), wk = 0.0024331 k( 243) = ( 0.4561404 0.2633528 0.3062977), wk = 0.0024331 k( 244) = ( 0.4649123 0.2684172 0.3062977), wk = 0.0024331 k( 245) = ( 0.4736842 0.2734817 0.3062977), wk = 0.0024331 k( 246) = ( 0.4824561 0.2785462 0.3062977), wk = 0.0024331 k( 247) = ( 0.4912281 0.2836107 0.3062977), wk = 0.0024331 k( 248) = ( 0.5000000 0.2886751 0.3062977), wk = 0.0024331 k( 249) = ( 0.5000000 0.2886751 0.3062977), wk = 0.0024331 k( 250) = ( 0.4949495 0.2974229 0.3062977), wk = 0.0024331 k( 251) = ( 0.4898990 0.3061706 0.3062977), wk = 0.0024331 k( 252) = ( 0.4848485 0.3149183 0.3062977), wk = 0.0024331 k( 253) = ( 0.4797980 0.3236661 0.3062977), wk = 0.0024331 k( 254) = ( 0.4747475 0.3324138 0.3062977), wk = 0.0024331 k( 255) = ( 0.4696970 0.3411615 0.3062977), wk = 0.0024331 k( 256) = ( 0.4646465 0.3499093 0.3062977), wk = 0.0024331 k( 257) = ( 0.4595960 0.3586570 0.3062977), wk = 0.0024331 k( 258) = ( 0.4545455 0.3674047 0.3062977), wk = 0.0024331 k( 259) = ( 0.4494950 0.3761524 0.3062977), wk = 0.0024331 k( 260) = ( 0.4444444 0.3849002 0.3062977), wk = 0.0024331 k( 261) = ( 0.4393939 0.3936479 0.3062977), wk = 0.0024331 k( 262) = ( 0.4343434 0.4023956 0.3062977), wk = 0.0024331 k( 263) = ( 0.4292929 0.4111434 0.3062977), wk = 0.0024331 k( 264) = ( 0.4242424 0.4198911 0.3062977), wk = 0.0024331 k( 265) = ( 0.4191919 0.4286388 0.3062977), wk = 0.0024331 k( 266) = ( 0.4141414 0.4373866 0.3062977), wk = 0.0024331 k( 267) = ( 0.4090909 0.4461343 0.3062977), wk = 0.0024331 k( 268) = ( 0.4040404 0.4548820 0.3062977), wk = 0.0024331 k( 269) = ( 0.3989899 0.4636298 0.3062977), wk = 0.0024331 k( 270) = ( 0.3939394 0.4723775 0.3062977), wk = 0.0024331 k( 271) = ( 0.3888889 0.4811252 0.3062977), wk = 0.0024331 k( 272) = ( 0.3838384 0.4898730 0.3062977), wk = 0.0024331 k( 273) = ( 0.3787879 0.4986207 0.3062977), wk = 0.0024331 k( 274) = ( 0.3737374 0.5073684 0.3062977), wk = 0.0024331 k( 275) = ( 0.3686869 0.5161161 0.3062977), wk = 0.0024331 k( 276) = ( 0.3636364 0.5248639 0.3062977), wk = 0.0024331 k( 277) = ( 0.3585859 0.5336116 0.3062977), wk = 0.0024331 k( 278) = ( 0.3535354 0.5423593 0.3062977), wk = 0.0024331 k( 279) = ( 0.3484849 0.5511071 0.3062977), wk = 0.0024331 k( 280) = ( 0.3434343 0.5598548 0.3062977), wk = 0.0024331 k( 281) = ( 0.3383838 0.5686025 0.3062977), wk = 0.0024331 k( 282) = ( 0.3333333 0.5773503 0.3062977), wk = 0.0024331 k( 283) = ( 0.3333333 0.5773503 0.3062977), wk = 0.0024331 k( 284) = ( 0.3282828 0.5686025 0.3062977), wk = 0.0024331 k( 285) = ( 0.3232323 0.5598548 0.3062977), wk = 0.0024331 k( 286) = ( 0.3181818 0.5511071 0.3062977), wk = 0.0024331 k( 287) = ( 0.3131313 0.5423593 0.3062977), wk = 0.0024331 k( 288) = ( 0.3080808 0.5336116 0.3062977), wk = 0.0024331 k( 289) = ( 0.3030303 0.5248639 0.3062977), wk = 0.0024331 k( 290) = ( 0.2979798 0.5161162 0.3062977), wk = 0.0024331 k( 291) = ( 0.2929293 0.5073684 0.3062977), wk = 0.0024331 k( 292) = ( 0.2878788 0.4986207 0.3062977), wk = 0.0024331 k( 293) = ( 0.2828283 0.4898730 0.3062977), wk = 0.0024331 k( 294) = ( 0.2777778 0.4811252 0.3062977), wk = 0.0024331 k( 295) = ( 0.2727273 0.4723775 0.3062977), wk = 0.0024331 k( 296) = ( 0.2676768 0.4636298 0.3062977), wk = 0.0024331 k( 297) = ( 0.2626263 0.4548820 0.3062977), wk = 0.0024331 k( 298) = ( 0.2575758 0.4461343 0.3062977), wk = 0.0024331 k( 299) = ( 0.2525252 0.4373866 0.3062977), wk = 0.0024331 k( 300) = ( 0.2474747 0.4286388 0.3062977), wk = 0.0024331 k( 301) = ( 0.2424242 0.4198911 0.3062977), wk = 0.0024331 k( 302) = ( 0.2373737 0.4111434 0.3062977), wk = 0.0024331 k( 303) = ( 0.2323232 0.4023956 0.3062977), wk = 0.0024331 k( 304) = ( 0.2272727 0.3936479 0.3062977), wk = 0.0024331 k( 305) = ( 0.2222222 0.3849002 0.3062977), wk = 0.0024331 k( 306) = ( 0.2171717 0.3761525 0.3062977), wk = 0.0024331 k( 307) = ( 0.2121212 0.3674047 0.3062977), wk = 0.0024331 k( 308) = ( 0.2070707 0.3586570 0.3062977), wk = 0.0024331 k( 309) = ( 0.2020202 0.3499093 0.3062977), wk = 0.0024331 k( 310) = ( 0.1969697 0.3411615 0.3062977), wk = 0.0024331 k( 311) = ( 0.1919192 0.3324138 0.3062977), wk = 0.0024331 k( 312) = ( 0.1868687 0.3236661 0.3062977), wk = 0.0024331 k( 313) = ( 0.1818182 0.3149183 0.3062977), wk = 0.0024331 k( 314) = ( 0.1767677 0.3061706 0.3062977), wk = 0.0024331 k( 315) = ( 0.1717172 0.2974229 0.3062977), wk = 0.0024331 k( 316) = ( 0.1666667 0.2886751 0.3062977), wk = 0.0024331 k( 317) = ( 0.1616162 0.2799274 0.3062977), wk = 0.0024331 k( 318) = ( 0.1565657 0.2711797 0.3062977), wk = 0.0024331 k( 319) = ( 0.1515151 0.2624319 0.3062977), wk = 0.0024331 k( 320) = ( 0.1464647 0.2536842 0.3062977), wk = 0.0024331 k( 321) = ( 0.1414141 0.2449365 0.3062977), wk = 0.0024331 k( 322) = ( 0.1363636 0.2361888 0.3062977), wk = 0.0024331 k( 323) = ( 0.1313131 0.2274410 0.3062977), wk = 0.0024331 k( 324) = ( 0.1262626 0.2186933 0.3062977), wk = 0.0024331 k( 325) = ( 0.1212121 0.2099456 0.3062977), wk = 0.0024331 k( 326) = ( 0.1161616 0.2011978 0.3062977), wk = 0.0024331 k( 327) = ( 0.1111111 0.1924501 0.3062977), wk = 0.0024331 k( 328) = ( 0.1060606 0.1837024 0.3062977), wk = 0.0024331 k( 329) = ( 0.1010101 0.1749546 0.3062977), wk = 0.0024331 k( 330) = ( 0.0959596 0.1662069 0.3062977), wk = 0.0024331 k( 331) = ( 0.0909091 0.1574592 0.3062977), wk = 0.0024331 k( 332) = ( 0.0858586 0.1487114 0.3062977), wk = 0.0024331 k( 333) = ( 0.0808081 0.1399637 0.3062977), wk = 0.0024331 k( 334) = ( 0.0757576 0.1312160 0.3062977), wk = 0.0024331 k( 335) = ( 0.0707071 0.1224682 0.3062977), wk = 0.0024331 k( 336) = ( 0.0656566 0.1137205 0.3062977), wk = 0.0024331 k( 337) = ( 0.0606061 0.1049728 0.3062977), wk = 0.0024331 k( 338) = ( 0.0555556 0.0962251 0.3062977), wk = 0.0024331 k( 339) = ( 0.0505051 0.0874773 0.3062977), wk = 0.0024331 k( 340) = ( 0.0454546 0.0787296 0.3062977), wk = 0.0024331 k( 341) = ( 0.0404040 0.0699819 0.3062977), wk = 0.0024331 k( 342) = ( 0.0353535 0.0612341 0.3062977), wk = 0.0024331 k( 343) = ( 0.0303030 0.0524864 0.3062977), wk = 0.0024331 k( 344) = ( 0.0252525 0.0437387 0.3062977), wk = 0.0024331 k( 345) = ( 0.0202020 0.0349909 0.3062977), wk = 0.0024331 k( 346) = ( 0.0151515 0.0262432 0.3062977), wk = 0.0024331 k( 347) = ( 0.0101010 0.0174955 0.3062977), wk = 0.0024331 k( 348) = ( 0.0050505 0.0087477 0.3062977), wk = 0.0024331 k( 349) = ( 0.0000000 0.0000000 0.3062977), wk = 0.0024331 k( 350) = ( 0.5000000 0.2886751 0.3062977), wk = 0.0024331 k( 351) = ( 0.5000000 0.2886751 0.2960878), wk = 0.0024331 k( 352) = ( 0.5000000 0.2886751 0.2858779), wk = 0.0024331 k( 353) = ( 0.5000000 0.2886751 0.2756679), wk = 0.0024331 k( 354) = ( 0.5000000 0.2886751 0.2654580), wk = 0.0024331 k( 355) = ( 0.5000000 0.2886751 0.2552481), wk = 0.0024331 k( 356) = ( 0.5000000 0.2886751 0.2450382), wk = 0.0024331 k( 357) = ( 0.5000000 0.2886751 0.2348282), wk = 0.0024331 k( 358) = ( 0.5000000 0.2886751 0.2246183), wk = 0.0024331 k( 359) = ( 0.5000000 0.2886751 0.2144084), wk = 0.0024331 k( 360) = ( 0.5000000 0.2886751 0.2041985), wk = 0.0024331 k( 361) = ( 0.5000000 0.2886751 0.1939886), wk = 0.0024331 k( 362) = ( 0.5000000 0.2886751 0.1837786), wk = 0.0024331 k( 363) = ( 0.5000000 0.2886751 0.1735687), wk = 0.0024331 k( 364) = ( 0.5000000 0.2886751 0.1633588), wk = 0.0024331 k( 365) = ( 0.5000000 0.2886751 0.1531489), wk = 0.0024331 k( 366) = ( 0.5000000 0.2886751 0.1429389), wk = 0.0024331 k( 367) = ( 0.5000000 0.2886751 0.1327290), wk = 0.0024331 k( 368) = ( 0.5000000 0.2886751 0.1225191), wk = 0.0024331 k( 369) = ( 0.5000000 0.2886751 0.1123092), wk = 0.0024331 k( 370) = ( 0.5000000 0.2886751 0.1020992), wk = 0.0024331 k( 371) = ( 0.5000000 0.2886751 0.0918893), wk = 0.0024331 k( 372) = ( 0.5000000 0.2886751 0.0816794), wk = 0.0024331 k( 373) = ( 0.5000000 0.2886751 0.0714695), wk = 0.0024331 k( 374) = ( 0.5000000 0.2886751 0.0612595), wk = 0.0024331 k( 375) = ( 0.5000000 0.2886751 0.0510496), wk = 0.0024331 k( 376) = ( 0.5000000 0.2886751 0.0408397), wk = 0.0024331 k( 377) = ( 0.5000000 0.2886751 0.0306298), wk = 0.0024331 k( 378) = ( 0.5000000 0.2886751 0.0204198), wk = 0.0024331 k( 379) = ( 0.5000000 0.2886751 0.0102099), wk = 0.0024331 k( 380) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0024331 k( 381) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0024331 k( 382) = ( 0.3333333 0.5773503 0.0102099), wk = 0.0024331 k( 383) = ( 0.3333333 0.5773503 0.0204198), wk = 0.0024331 k( 384) = ( 0.3333333 0.5773503 0.0306298), wk = 0.0024331 k( 385) = ( 0.3333333 0.5773503 0.0408397), wk = 0.0024331 k( 386) = ( 0.3333333 0.5773503 0.0510496), wk = 0.0024331 k( 387) = ( 0.3333333 0.5773503 0.0612595), wk = 0.0024331 k( 388) = ( 0.3333333 0.5773503 0.0714695), wk = 0.0024331 k( 389) = ( 0.3333333 0.5773503 0.0816794), wk = 0.0024331 k( 390) = ( 0.3333333 0.5773503 0.0918893), wk = 0.0024331 k( 391) = ( 0.3333333 0.5773503 0.1020992), wk = 0.0024331 k( 392) = ( 0.3333333 0.5773503 0.1123092), wk = 0.0024331 k( 393) = ( 0.3333333 0.5773503 0.1225191), wk = 0.0024331 k( 394) = ( 0.3333333 0.5773503 0.1327290), wk = 0.0024331 k( 395) = ( 0.3333333 0.5773503 0.1429389), wk = 0.0024331 k( 396) = ( 0.3333333 0.5773503 0.1531489), wk = 0.0024331 k( 397) = ( 0.3333333 0.5773503 0.1633588), wk = 0.0024331 k( 398) = ( 0.3333333 0.5773503 0.1735687), wk = 0.0024331 k( 399) = ( 0.3333333 0.5773503 0.1837786), wk = 0.0024331 k( 400) = ( 0.3333333 0.5773503 0.1939886), wk = 0.0024331 k( 401) = ( 0.3333333 0.5773503 0.2041985), wk = 0.0024331 k( 402) = ( 0.3333333 0.5773503 0.2144084), wk = 0.0024331 k( 403) = ( 0.3333333 0.5773503 0.2246183), wk = 0.0024331 k( 404) = ( 0.3333333 0.5773503 0.2348282), wk = 0.0024331 k( 405) = ( 0.3333333 0.5773503 0.2450382), wk = 0.0024331 k( 406) = ( 0.3333333 0.5773503 0.2552481), wk = 0.0024331 k( 407) = ( 0.3333333 0.5773503 0.2654580), wk = 0.0024331 k( 408) = ( 0.3333333 0.5773503 0.2756679), wk = 0.0024331 k( 409) = ( 0.3333333 0.5773503 0.2858779), wk = 0.0024331 k( 410) = ( 0.3333333 0.5773503 0.2960878), wk = 0.0024331 k( 411) = ( 0.3333333 0.5773503 0.3062977), wk = 0.0024331 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024331 k( 2) = ( 0.0087719 0.0000000 0.0000000), wk = 0.0024331 k( 3) = ( 0.0175439 0.0000000 0.0000000), wk = 0.0024331 k( 4) = ( 0.0263158 0.0000000 0.0000000), wk = 0.0024331 k( 5) = ( 0.0350877 0.0000000 0.0000000), wk = 0.0024331 k( 6) = ( 0.0438597 -0.0000000 -0.0000000), wk = 0.0024331 k( 7) = ( 0.0526316 0.0000000 0.0000000), wk = 0.0024331 k( 8) = ( 0.0614035 -0.0000000 0.0000000), wk = 0.0024331 k( 9) = ( 0.0701754 0.0000000 0.0000000), wk = 0.0024331 k( 10) = ( 0.0789474 0.0000000 0.0000000), wk = 0.0024331 k( 11) = ( 0.0877193 -0.0000000 -0.0000000), wk = 0.0024331 k( 12) = ( 0.0964912 0.0000000 0.0000000), wk = 0.0024331 k( 13) = ( 0.1052632 0.0000000 0.0000000), wk = 0.0024331 k( 14) = ( 0.1140351 0.0000000 0.0000000), wk = 0.0024331 k( 15) = ( 0.1228070 -0.0000000 0.0000000), wk = 0.0024331 k( 16) = ( 0.1315790 0.0000000 0.0000000), wk = 0.0024331 k( 17) = ( 0.1403509 0.0000000 0.0000000), wk = 0.0024331 k( 18) = ( 0.1491228 0.0000000 0.0000000), wk = 0.0024331 k( 19) = ( 0.1578947 0.0000000 0.0000000), wk = 0.0024331 k( 20) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0024331 k( 21) = ( 0.1754386 -0.0000000 -0.0000000), wk = 0.0024331 k( 22) = ( 0.1842105 -0.0000000 0.0000000), wk = 0.0024331 k( 23) = ( 0.1929825 0.0000000 0.0000000), wk = 0.0024331 k( 24) = ( 0.2017544 0.0000000 0.0000000), wk = 0.0024331 k( 25) = ( 0.2105263 0.0000000 0.0000000), wk = 0.0024331 k( 26) = ( 0.2192983 0.0000000 0.0000000), wk = 0.0024331 k( 27) = ( 0.2280702 0.0000000 0.0000000), wk = 0.0024331 k( 28) = ( 0.2368421 0.0000000 0.0000000), wk = 0.0024331 k( 29) = ( 0.2456140 -0.0000000 0.0000000), wk = 0.0024331 k( 30) = ( 0.2543860 0.0000000 0.0000000), wk = 0.0024331 k( 31) = ( 0.2631579 0.0000000 0.0000000), wk = 0.0024331 k( 32) = ( 0.2719298 0.0000000 0.0000000), wk = 0.0024331 k( 33) = ( 0.2807018 0.0000000 0.0000000), wk = 0.0024331 k( 34) = ( 0.2894737 0.0000000 0.0000000), wk = 0.0024331 k( 35) = ( 0.2982456 0.0000000 0.0000000), wk = 0.0024331 k( 36) = ( 0.3070175 0.0000000 0.0000000), wk = 0.0024331 k( 37) = ( 0.3157895 -0.0000000 0.0000000), wk = 0.0024331 k( 38) = ( 0.3245614 0.0000000 0.0000000), wk = 0.0024331 k( 39) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0024331 k( 40) = ( 0.3421053 0.0000000 0.0000000), wk = 0.0024331 k( 41) = ( 0.3508772 0.0000000 0.0000000), wk = 0.0024331 k( 42) = ( 0.3596491 0.0000000 0.0000000), wk = 0.0024331 k( 43) = ( 0.3684211 0.0000000 0.0000000), wk = 0.0024331 k( 44) = ( 0.3771930 0.0000000 0.0000000), wk = 0.0024331 k( 45) = ( 0.3859649 0.0000000 0.0000000), wk = 0.0024331 k( 46) = ( 0.3947368 0.0000000 0.0000000), wk = 0.0024331 k( 47) = ( 0.4035088 0.0000000 -0.0000000), wk = 0.0024331 k( 48) = ( 0.4122807 0.0000000 0.0000000), wk = 0.0024331 k( 49) = ( 0.4210526 0.0000000 0.0000000), wk = 0.0024331 k( 50) = ( 0.4298246 0.0000000 0.0000000), wk = 0.0024331 k( 51) = ( 0.4385965 -0.0000000 0.0000000), wk = 0.0024331 k( 52) = ( 0.4473684 -0.0000000 0.0000000), wk = 0.0024331 k( 53) = ( 0.4561404 0.0000000 0.0000000), wk = 0.0024331 k( 54) = ( 0.4649123 0.0000000 0.0000000), wk = 0.0024331 k( 55) = ( 0.4736842 0.0000000 0.0000000), wk = 0.0024331 k( 56) = ( 0.4824561 0.0000000 0.0000000), wk = 0.0024331 k( 57) = ( 0.4912281 0.0000000 0.0000000), wk = 0.0024331 k( 58) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0024331 k( 59) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0024331 k( 60) = ( 0.4949495 0.0101010 0.0000000), wk = 0.0024331 k( 61) = ( 0.4898990 0.0202020 0.0000000), wk = 0.0024331 k( 62) = ( 0.4848485 0.0303030 0.0000000), wk = 0.0024331 k( 63) = ( 0.4797980 0.0404040 0.0000000), wk = 0.0024331 k( 64) = ( 0.4747475 0.0505051 0.0000000), wk = 0.0024331 k( 65) = ( 0.4696970 0.0606061 0.0000000), wk = 0.0024331 k( 66) = ( 0.4646465 0.0707071 0.0000000), wk = 0.0024331 k( 67) = ( 0.4595960 0.0808081 0.0000000), wk = 0.0024331 k( 68) = ( 0.4545455 0.0909091 0.0000000), wk = 0.0024331 k( 69) = ( 0.4494950 0.1010101 0.0000000), wk = 0.0024331 k( 70) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0024331 k( 71) = ( 0.4393939 0.1212121 0.0000000), wk = 0.0024331 k( 72) = ( 0.4343434 0.1313131 0.0000000), wk = 0.0024331 k( 73) = ( 0.4292929 0.1414141 0.0000000), wk = 0.0024331 k( 74) = ( 0.4242424 0.1515151 0.0000000), wk = 0.0024331 k( 75) = ( 0.4191919 0.1616162 -0.0000000), wk = 0.0024331 k( 76) = ( 0.4141414 0.1717172 0.0000000), wk = 0.0024331 k( 77) = ( 0.4090909 0.1818182 0.0000000), wk = 0.0024331 k( 78) = ( 0.4040404 0.1919192 0.0000000), wk = 0.0024331 k( 79) = ( 0.3989899 0.2020202 0.0000000), wk = 0.0024331 k( 80) = ( 0.3939394 0.2121212 0.0000000), wk = 0.0024331 k( 81) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0024331 k( 82) = ( 0.3838384 0.2323232 0.0000000), wk = 0.0024331 k( 83) = ( 0.3787879 0.2424242 0.0000000), wk = 0.0024331 k( 84) = ( 0.3737374 0.2525253 0.0000000), wk = 0.0024331 k( 85) = ( 0.3686869 0.2626263 -0.0000000), wk = 0.0024331 k( 86) = ( 0.3636364 0.2727273 0.0000000), wk = 0.0024331 k( 87) = ( 0.3585859 0.2828283 0.0000000), wk = 0.0024331 k( 88) = ( 0.3535354 0.2929293 -0.0000000), wk = 0.0024331 k( 89) = ( 0.3484849 0.3030303 0.0000000), wk = 0.0024331 k( 90) = ( 0.3434343 0.3131313 0.0000000), wk = 0.0024331 k( 91) = ( 0.3383838 0.3232323 -0.0000000), wk = 0.0024331 k( 92) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0024331 k( 93) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0024331 k( 94) = ( 0.3282828 0.3282828 0.0000000), wk = 0.0024331 k( 95) = ( 0.3232323 0.3232323 0.0000000), wk = 0.0024331 k( 96) = ( 0.3181818 0.3181818 0.0000000), wk = 0.0024331 k( 97) = ( 0.3131313 0.3131313 0.0000000), wk = 0.0024331 k( 98) = ( 0.3080808 0.3080808 0.0000000), wk = 0.0024331 k( 99) = ( 0.3030303 0.3030303 0.0000000), wk = 0.0024331 k( 100) = ( 0.2979798 0.2979798 0.0000000), wk = 0.0024331 k( 101) = ( 0.2929293 0.2929293 0.0000000), wk = 0.0024331 k( 102) = ( 0.2878788 0.2878788 0.0000000), wk = 0.0024331 k( 103) = ( 0.2828283 0.2828283 -0.0000000), wk = 0.0024331 k( 104) = ( 0.2777778 0.2777778 0.0000000), wk = 0.0024331 k( 105) = ( 0.2727273 0.2727273 0.0000000), wk = 0.0024331 k( 106) = ( 0.2676768 0.2676768 0.0000000), wk = 0.0024331 k( 107) = ( 0.2626263 0.2626263 0.0000000), wk = 0.0024331 k( 108) = ( 0.2575758 0.2575758 -0.0000000), wk = 0.0024331 k( 109) = ( 0.2525252 0.2525253 0.0000000), wk = 0.0024331 k( 110) = ( 0.2474747 0.2474747 0.0000000), wk = 0.0024331 k( 111) = ( 0.2424242 0.2424242 0.0000000), wk = 0.0024331 k( 112) = ( 0.2373737 0.2373737 0.0000000), wk = 0.0024331 k( 113) = ( 0.2323232 0.2323232 0.0000000), wk = 0.0024331 k( 114) = ( 0.2272727 0.2272727 0.0000000), wk = 0.0024331 k( 115) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0024331 k( 116) = ( 0.2171717 0.2171717 0.0000000), wk = 0.0024331 k( 117) = ( 0.2121212 0.2121212 0.0000000), wk = 0.0024331 k( 118) = ( 0.2070707 0.2070707 0.0000000), wk = 0.0024331 k( 119) = ( 0.2020202 0.2020202 0.0000000), wk = 0.0024331 k( 120) = ( 0.1969697 0.1969697 0.0000000), wk = 0.0024331 k( 121) = ( 0.1919192 0.1919192 0.0000000), wk = 0.0024331 k( 122) = ( 0.1868687 0.1868687 0.0000000), wk = 0.0024331 k( 123) = ( 0.1818182 0.1818182 0.0000000), wk = 0.0024331 k( 124) = ( 0.1767677 0.1767677 0.0000000), wk = 0.0024331 k( 125) = ( 0.1717172 0.1717172 -0.0000000), wk = 0.0024331 k( 126) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0024331 k( 127) = ( 0.1616162 0.1616162 0.0000000), wk = 0.0024331 k( 128) = ( 0.1565657 0.1565657 0.0000000), wk = 0.0024331 k( 129) = ( 0.1515151 0.1515151 0.0000000), wk = 0.0024331 k( 130) = ( 0.1464647 0.1464647 -0.0000000), wk = 0.0024331 k( 131) = ( 0.1414141 0.1414141 -0.0000000), wk = 0.0024331 k( 132) = ( 0.1363636 0.1363636 -0.0000000), wk = 0.0024331 k( 133) = ( 0.1313131 0.1313131 0.0000000), wk = 0.0024331 k( 134) = ( 0.1262626 0.1262626 0.0000000), wk = 0.0024331 k( 135) = ( 0.1212121 0.1212121 0.0000000), wk = 0.0024331 k( 136) = ( 0.1161616 0.1161616 -0.0000000), wk = 0.0024331 k( 137) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0024331 k( 138) = ( 0.1060606 0.1060606 0.0000000), wk = 0.0024331 k( 139) = ( 0.1010101 0.1010101 0.0000000), wk = 0.0024331 k( 140) = ( 0.0959596 0.0959596 0.0000000), wk = 0.0024331 k( 141) = ( 0.0909091 0.0909091 0.0000000), wk = 0.0024331 k( 142) = ( 0.0858586 0.0858586 0.0000000), wk = 0.0024331 k( 143) = ( 0.0808081 0.0808081 0.0000000), wk = 0.0024331 k( 144) = ( 0.0757576 0.0757576 0.0000000), wk = 0.0024331 k( 145) = ( 0.0707071 0.0707071 -0.0000000), wk = 0.0024331 k( 146) = ( 0.0656566 0.0656566 0.0000000), wk = 0.0024331 k( 147) = ( 0.0606061 0.0606061 0.0000000), wk = 0.0024331 k( 148) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0024331 k( 149) = ( 0.0505051 0.0505051 0.0000000), wk = 0.0024331 k( 150) = ( 0.0454546 0.0454546 0.0000000), wk = 0.0024331 k( 151) = ( 0.0404040 0.0404040 0.0000000), wk = 0.0024331 k( 152) = ( 0.0353535 0.0353535 -0.0000000), wk = 0.0024331 k( 153) = ( 0.0303030 0.0303030 0.0000000), wk = 0.0024331 k( 154) = ( 0.0252525 0.0252525 0.0000000), wk = 0.0024331 k( 155) = ( 0.0202020 0.0202020 0.0000000), wk = 0.0024331 k( 156) = ( 0.0151515 0.0151515 0.0000000), wk = 0.0024331 k( 157) = ( 0.0101010 0.0101010 0.0000000), wk = 0.0024331 k( 158) = ( 0.0050505 0.0050505 0.0000000), wk = 0.0024331 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024331 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024331 k( 161) = ( 0.0000000 0.0000000 0.0166667), wk = 0.0024331 k( 162) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0024331 k( 163) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0024331 k( 164) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0024331 k( 165) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0024331 k( 166) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0024331 k( 167) = ( 0.0000000 0.0000000 0.1166667), wk = 0.0024331 k( 168) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0024331 k( 169) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0024331 k( 170) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0024331 k( 171) = ( 0.0000000 0.0000000 0.1833333), wk = 0.0024331 k( 172) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0024331 k( 173) = ( 0.0000000 0.0000000 0.2166667), wk = 0.0024331 k( 174) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0024331 k( 175) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0024331 k( 176) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0024331 k( 177) = ( 0.0000000 0.0000000 0.2833333), wk = 0.0024331 k( 178) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0024331 k( 179) = ( 0.0000000 0.0000000 0.3166667), wk = 0.0024331 k( 180) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0024331 k( 181) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0024331 k( 182) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0024331 k( 183) = ( 0.0000000 0.0000000 0.3833333), wk = 0.0024331 k( 184) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0024331 k( 185) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0024331 k( 186) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0024331 k( 187) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0024331 k( 188) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0024331 k( 189) = ( 0.0000000 0.0000000 0.4833333), wk = 0.0024331 k( 190) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024331 k( 191) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024331 k( 192) = ( 0.0087719 0.0000000 0.5000000), wk = 0.0024331 k( 193) = ( 0.0175439 0.0000000 0.5000000), wk = 0.0024331 k( 194) = ( 0.0263158 0.0000000 0.5000000), wk = 0.0024331 k( 195) = ( 0.0350877 0.0000000 0.5000000), wk = 0.0024331 k( 196) = ( 0.0438597 -0.0000000 0.5000000), wk = 0.0024331 k( 197) = ( 0.0526316 0.0000000 0.5000000), wk = 0.0024331 k( 198) = ( 0.0614035 -0.0000000 0.5000000), wk = 0.0024331 k( 199) = ( 0.0701754 0.0000000 0.5000000), wk = 0.0024331 k( 200) = ( 0.0789474 0.0000000 0.5000000), wk = 0.0024331 k( 201) = ( 0.0877193 -0.0000000 0.5000000), wk = 0.0024331 k( 202) = ( 0.0964912 0.0000000 0.5000000), wk = 0.0024331 k( 203) = ( 0.1052632 0.0000000 0.5000000), wk = 0.0024331 k( 204) = ( 0.1140351 0.0000000 0.5000000), wk = 0.0024331 k( 205) = ( 0.1228070 -0.0000000 0.5000000), wk = 0.0024331 k( 206) = ( 0.1315790 0.0000000 0.5000000), wk = 0.0024331 k( 207) = ( 0.1403509 0.0000000 0.5000000), wk = 0.0024331 k( 208) = ( 0.1491228 0.0000000 0.5000000), wk = 0.0024331 k( 209) = ( 0.1578947 0.0000000 0.5000000), wk = 0.0024331 k( 210) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0024331 k( 211) = ( 0.1754386 -0.0000000 0.5000000), wk = 0.0024331 k( 212) = ( 0.1842105 -0.0000000 0.5000000), wk = 0.0024331 k( 213) = ( 0.1929825 0.0000000 0.5000000), wk = 0.0024331 k( 214) = ( 0.2017544 0.0000000 0.5000000), wk = 0.0024331 k( 215) = ( 0.2105263 0.0000000 0.5000000), wk = 0.0024331 k( 216) = ( 0.2192983 0.0000000 0.5000000), wk = 0.0024331 k( 217) = ( 0.2280702 0.0000000 0.5000000), wk = 0.0024331 k( 218) = ( 0.2368421 0.0000000 0.5000000), wk = 0.0024331 k( 219) = ( 0.2456140 -0.0000000 0.5000000), wk = 0.0024331 k( 220) = ( 0.2543860 0.0000000 0.5000000), wk = 0.0024331 k( 221) = ( 0.2631579 0.0000000 0.5000000), wk = 0.0024331 k( 222) = ( 0.2719298 0.0000000 0.5000000), wk = 0.0024331 k( 223) = ( 0.2807018 0.0000000 0.5000000), wk = 0.0024331 k( 224) = ( 0.2894737 0.0000000 0.5000000), wk = 0.0024331 k( 225) = ( 0.2982456 0.0000000 0.5000000), wk = 0.0024331 k( 226) = ( 0.3070175 0.0000000 0.5000000), wk = 0.0024331 k( 227) = ( 0.3157895 -0.0000000 0.5000000), wk = 0.0024331 k( 228) = ( 0.3245614 0.0000000 0.5000000), wk = 0.0024331 k( 229) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0024331 k( 230) = ( 0.3421053 0.0000000 0.5000000), wk = 0.0024331 k( 231) = ( 0.3508772 0.0000000 0.5000000), wk = 0.0024331 k( 232) = ( 0.3596491 0.0000000 0.5000000), wk = 0.0024331 k( 233) = ( 0.3684211 0.0000000 0.5000000), wk = 0.0024331 k( 234) = ( 0.3771930 0.0000000 0.5000000), wk = 0.0024331 k( 235) = ( 0.3859649 0.0000000 0.5000000), wk = 0.0024331 k( 236) = ( 0.3947368 0.0000000 0.5000000), wk = 0.0024331 k( 237) = ( 0.4035088 0.0000000 0.5000000), wk = 0.0024331 k( 238) = ( 0.4122807 0.0000000 0.5000000), wk = 0.0024331 k( 239) = ( 0.4210526 0.0000000 0.5000000), wk = 0.0024331 k( 240) = ( 0.4298246 0.0000000 0.5000000), wk = 0.0024331 k( 241) = ( 0.4385965 -0.0000000 0.5000000), wk = 0.0024331 k( 242) = ( 0.4473684 -0.0000000 0.5000000), wk = 0.0024331 k( 243) = ( 0.4561404 0.0000000 0.5000000), wk = 0.0024331 k( 244) = ( 0.4649123 0.0000000 0.5000000), wk = 0.0024331 k( 245) = ( 0.4736842 0.0000000 0.5000000), wk = 0.0024331 k( 246) = ( 0.4824561 0.0000000 0.5000000), wk = 0.0024331 k( 247) = ( 0.4912281 0.0000000 0.5000000), wk = 0.0024331 k( 248) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0024331 k( 249) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0024331 k( 250) = ( 0.4949495 0.0101010 0.5000000), wk = 0.0024331 k( 251) = ( 0.4898990 0.0202020 0.5000000), wk = 0.0024331 k( 252) = ( 0.4848485 0.0303030 0.5000000), wk = 0.0024331 k( 253) = ( 0.4797980 0.0404040 0.5000000), wk = 0.0024331 k( 254) = ( 0.4747475 0.0505051 0.5000000), wk = 0.0024331 k( 255) = ( 0.4696970 0.0606061 0.5000000), wk = 0.0024331 k( 256) = ( 0.4646465 0.0707071 0.5000000), wk = 0.0024331 k( 257) = ( 0.4595960 0.0808081 0.5000000), wk = 0.0024331 k( 258) = ( 0.4545455 0.0909091 0.5000000), wk = 0.0024331 k( 259) = ( 0.4494950 0.1010101 0.5000000), wk = 0.0024331 k( 260) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0024331 k( 261) = ( 0.4393939 0.1212121 0.5000000), wk = 0.0024331 k( 262) = ( 0.4343434 0.1313131 0.5000000), wk = 0.0024331 k( 263) = ( 0.4292929 0.1414141 0.5000000), wk = 0.0024331 k( 264) = ( 0.4242424 0.1515151 0.5000000), wk = 0.0024331 k( 265) = ( 0.4191919 0.1616162 0.5000000), wk = 0.0024331 k( 266) = ( 0.4141414 0.1717172 0.5000000), wk = 0.0024331 k( 267) = ( 0.4090909 0.1818182 0.5000000), wk = 0.0024331 k( 268) = ( 0.4040404 0.1919192 0.5000000), wk = 0.0024331 k( 269) = ( 0.3989899 0.2020202 0.5000000), wk = 0.0024331 k( 270) = ( 0.3939394 0.2121212 0.5000000), wk = 0.0024331 k( 271) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0024331 k( 272) = ( 0.3838384 0.2323232 0.5000000), wk = 0.0024331 k( 273) = ( 0.3787879 0.2424242 0.5000000), wk = 0.0024331 k( 274) = ( 0.3737374 0.2525253 0.5000000), wk = 0.0024331 k( 275) = ( 0.3686869 0.2626263 0.5000000), wk = 0.0024331 k( 276) = ( 0.3636364 0.2727273 0.5000000), wk = 0.0024331 k( 277) = ( 0.3585859 0.2828283 0.5000000), wk = 0.0024331 k( 278) = ( 0.3535354 0.2929293 0.5000000), wk = 0.0024331 k( 279) = ( 0.3484849 0.3030303 0.5000000), wk = 0.0024331 k( 280) = ( 0.3434343 0.3131313 0.5000000), wk = 0.0024331 k( 281) = ( 0.3383838 0.3232323 0.5000000), wk = 0.0024331 k( 282) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0024331 k( 283) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0024331 k( 284) = ( 0.3282828 0.3282828 0.5000000), wk = 0.0024331 k( 285) = ( 0.3232323 0.3232323 0.5000000), wk = 0.0024331 k( 286) = ( 0.3181818 0.3181818 0.5000000), wk = 0.0024331 k( 287) = ( 0.3131313 0.3131313 0.5000000), wk = 0.0024331 k( 288) = ( 0.3080808 0.3080808 0.5000000), wk = 0.0024331 k( 289) = ( 0.3030303 0.3030303 0.5000000), wk = 0.0024331 k( 290) = ( 0.2979798 0.2979798 0.5000000), wk = 0.0024331 k( 291) = ( 0.2929293 0.2929293 0.5000000), wk = 0.0024331 k( 292) = ( 0.2878788 0.2878788 0.5000000), wk = 0.0024331 k( 293) = ( 0.2828283 0.2828283 0.5000000), wk = 0.0024331 k( 294) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0024331 k( 295) = ( 0.2727273 0.2727273 0.5000000), wk = 0.0024331 k( 296) = ( 0.2676768 0.2676768 0.5000000), wk = 0.0024331 k( 297) = ( 0.2626263 0.2626263 0.5000000), wk = 0.0024331 k( 298) = ( 0.2575758 0.2575758 0.5000000), wk = 0.0024331 k( 299) = ( 0.2525252 0.2525253 0.5000000), wk = 0.0024331 k( 300) = ( 0.2474747 0.2474747 0.5000000), wk = 0.0024331 k( 301) = ( 0.2424242 0.2424242 0.5000000), wk = 0.0024331 k( 302) = ( 0.2373737 0.2373737 0.5000000), wk = 0.0024331 k( 303) = ( 0.2323232 0.2323232 0.5000000), wk = 0.0024331 k( 304) = ( 0.2272727 0.2272727 0.5000000), wk = 0.0024331 k( 305) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0024331 k( 306) = ( 0.2171717 0.2171717 0.5000000), wk = 0.0024331 k( 307) = ( 0.2121212 0.2121212 0.5000000), wk = 0.0024331 k( 308) = ( 0.2070707 0.2070707 0.5000000), wk = 0.0024331 k( 309) = ( 0.2020202 0.2020202 0.5000000), wk = 0.0024331 k( 310) = ( 0.1969697 0.1969697 0.5000000), wk = 0.0024331 k( 311) = ( 0.1919192 0.1919192 0.5000000), wk = 0.0024331 k( 312) = ( 0.1868687 0.1868687 0.5000000), wk = 0.0024331 k( 313) = ( 0.1818182 0.1818182 0.5000000), wk = 0.0024331 k( 314) = ( 0.1767677 0.1767677 0.5000000), wk = 0.0024331 k( 315) = ( 0.1717172 0.1717172 0.5000000), wk = 0.0024331 k( 316) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0024331 k( 317) = ( 0.1616162 0.1616162 0.5000000), wk = 0.0024331 k( 318) = ( 0.1565657 0.1565657 0.5000000), wk = 0.0024331 k( 319) = ( 0.1515151 0.1515151 0.5000000), wk = 0.0024331 k( 320) = ( 0.1464647 0.1464647 0.5000000), wk = 0.0024331 k( 321) = ( 0.1414141 0.1414141 0.5000000), wk = 0.0024331 k( 322) = ( 0.1363636 0.1363636 0.5000000), wk = 0.0024331 k( 323) = ( 0.1313131 0.1313131 0.5000000), wk = 0.0024331 k( 324) = ( 0.1262626 0.1262626 0.5000000), wk = 0.0024331 k( 325) = ( 0.1212121 0.1212121 0.5000000), wk = 0.0024331 k( 326) = ( 0.1161616 0.1161616 0.5000000), wk = 0.0024331 k( 327) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0024331 k( 328) = ( 0.1060606 0.1060606 0.5000000), wk = 0.0024331 k( 329) = ( 0.1010101 0.1010101 0.5000000), wk = 0.0024331 k( 330) = ( 0.0959596 0.0959596 0.5000000), wk = 0.0024331 k( 331) = ( 0.0909091 0.0909091 0.5000000), wk = 0.0024331 k( 332) = ( 0.0858586 0.0858586 0.5000000), wk = 0.0024331 k( 333) = ( 0.0808081 0.0808081 0.5000000), wk = 0.0024331 k( 334) = ( 0.0757576 0.0757576 0.5000000), wk = 0.0024331 k( 335) = ( 0.0707071 0.0707071 0.5000000), wk = 0.0024331 k( 336) = ( 0.0656566 0.0656566 0.5000000), wk = 0.0024331 k( 337) = ( 0.0606061 0.0606061 0.5000000), wk = 0.0024331 k( 338) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0024331 k( 339) = ( 0.0505051 0.0505051 0.5000000), wk = 0.0024331 k( 340) = ( 0.0454546 0.0454546 0.5000000), wk = 0.0024331 k( 341) = ( 0.0404040 0.0404040 0.5000000), wk = 0.0024331 k( 342) = ( 0.0353535 0.0353535 0.5000000), wk = 0.0024331 k( 343) = ( 0.0303030 0.0303030 0.5000000), wk = 0.0024331 k( 344) = ( 0.0252525 0.0252525 0.5000000), wk = 0.0024331 k( 345) = ( 0.0202020 0.0202020 0.5000000), wk = 0.0024331 k( 346) = ( 0.0151515 0.0151515 0.5000000), wk = 0.0024331 k( 347) = ( 0.0101010 0.0101010 0.5000000), wk = 0.0024331 k( 348) = ( 0.0050505 0.0050505 0.5000000), wk = 0.0024331 k( 349) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024331 k( 350) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0024331 k( 351) = ( 0.5000000 0.0000000 0.4833333), wk = 0.0024331 k( 352) = ( 0.5000000 0.0000000 0.4666667), wk = 0.0024331 k( 353) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0024331 k( 354) = ( 0.5000000 0.0000000 0.4333333), wk = 0.0024331 k( 355) = ( 0.5000000 0.0000000 0.4166667), wk = 0.0024331 k( 356) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0024331 k( 357) = ( 0.5000000 0.0000000 0.3833333), wk = 0.0024331 k( 358) = ( 0.5000000 0.0000000 0.3666667), wk = 0.0024331 k( 359) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0024331 k( 360) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0024331 k( 361) = ( 0.5000000 0.0000000 0.3166667), wk = 0.0024331 k( 362) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0024331 k( 363) = ( 0.5000000 0.0000000 0.2833333), wk = 0.0024331 k( 364) = ( 0.5000000 0.0000000 0.2666667), wk = 0.0024331 k( 365) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0024331 k( 366) = ( 0.5000000 0.0000000 0.2333333), wk = 0.0024331 k( 367) = ( 0.5000000 0.0000000 0.2166667), wk = 0.0024331 k( 368) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0024331 k( 369) = ( 0.5000000 0.0000000 0.1833333), wk = 0.0024331 k( 370) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0024331 k( 371) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0024331 k( 372) = ( 0.5000000 0.0000000 0.1333333), wk = 0.0024331 k( 373) = ( 0.5000000 0.0000000 0.1166667), wk = 0.0024331 k( 374) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0024331 k( 375) = ( 0.5000000 0.0000000 0.0833333), wk = 0.0024331 k( 376) = ( 0.5000000 0.0000000 0.0666667), wk = 0.0024331 k( 377) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0024331 k( 378) = ( 0.5000000 0.0000000 0.0333333), wk = 0.0024331 k( 379) = ( 0.5000000 0.0000000 0.0166667), wk = 0.0024331 k( 380) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0024331 k( 381) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0024331 k( 382) = ( 0.3333333 0.3333333 0.0166667), wk = 0.0024331 k( 383) = ( 0.3333333 0.3333333 0.0333333), wk = 0.0024331 k( 384) = ( 0.3333333 0.3333333 0.0500000), wk = 0.0024331 k( 385) = ( 0.3333333 0.3333333 0.0666667), wk = 0.0024331 k( 386) = ( 0.3333333 0.3333333 0.0833333), wk = 0.0024331 k( 387) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0024331 k( 388) = ( 0.3333333 0.3333333 0.1166667), wk = 0.0024331 k( 389) = ( 0.3333333 0.3333333 0.1333333), wk = 0.0024331 k( 390) = ( 0.3333333 0.3333333 0.1500000), wk = 0.0024331 k( 391) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0024331 k( 392) = ( 0.3333333 0.3333333 0.1833333), wk = 0.0024331 k( 393) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0024331 k( 394) = ( 0.3333333 0.3333333 0.2166667), wk = 0.0024331 k( 395) = ( 0.3333333 0.3333333 0.2333333), wk = 0.0024331 k( 396) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0024331 k( 397) = ( 0.3333333 0.3333333 0.2666667), wk = 0.0024331 k( 398) = ( 0.3333333 0.3333333 0.2833333), wk = 0.0024331 k( 399) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0024331 k( 400) = ( 0.3333333 0.3333333 0.3166667), wk = 0.0024331 k( 401) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0024331 k( 402) = ( 0.3333333 0.3333333 0.3500000), wk = 0.0024331 k( 403) = ( 0.3333333 0.3333333 0.3666667), wk = 0.0024331 k( 404) = ( 0.3333333 0.3333333 0.3833333), wk = 0.0024331 k( 405) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0024331 k( 406) = ( 0.3333333 0.3333333 0.4166667), wk = 0.0024331 k( 407) = ( 0.3333333 0.3333333 0.4333333), wk = 0.0024331 k( 408) = ( 0.3333333 0.3333333 0.4500000), wk = 0.0024331 k( 409) = ( 0.3333333 0.3333333 0.4666667), wk = 0.0024331 k( 410) = ( 0.3333333 0.3333333 0.4833333), wk = 0.0024331 k( 411) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0024331 Dense grid: 31095 G-vectors FFT dimensions: ( 36, 36, 60) Smooth grid: 30429 G-vectors FFT dimensions: ( 36, 36, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.19 Mb ( 218, 56) NL pseudopotentials 0.16 Mb ( 109, 96) Each V/rho on FFT grid 0.04 Mb ( 2592) Each G-vector array 0.01 Mb ( 867) G-vector shells 0.00 Mb ( 422) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.75 Mb ( 218, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.16 Mb ( 96, 2, 56) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./CoO.save/charge-density.dat Starting wfc are 56 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.8 secs Computing kpt #: 2 total cpu time spent up to now is 2.2 secs Computing kpt #: 3 total cpu time spent up to now is 2.6 secs Computing kpt #: 4 total cpu time spent up to now is 3.0 secs Computing kpt #: 5 total cpu time spent up to now is 3.4 secs Computing kpt #: 6 total cpu time spent up to now is 3.8 secs Computing kpt #: 7 total cpu time spent up to now is 4.2 secs Computing kpt #: 8 total cpu time spent up to now is 4.6 secs Computing kpt #: 9 total cpu time spent up to now is 5.0 secs Computing kpt #: 10 total cpu time spent up to now is 5.4 secs Computing kpt #: 11 total cpu time spent up to now is 5.8 secs Computing kpt #: 12 total cpu time spent up to now is 6.3 secs Computing kpt #: 13 total cpu time spent up to now is 6.7 secs Computing kpt #: 14 total cpu time spent up to now is 7.1 secs Computing kpt #: 15 total cpu time spent up to now is 7.5 secs Computing kpt #: 16 total cpu time spent up to now is 8.0 secs Computing kpt #: 17 total cpu time spent up to now is 8.4 secs Computing kpt #: 18 total cpu time spent up to now is 8.8 secs Computing kpt #: 19 total cpu time spent up to now is 9.3 secs Computing kpt #: 20 total cpu time spent up to now is 9.8 secs Computing kpt #: 21 total cpu time spent up to now is 10.3 secs Computing kpt #: 22 total cpu time spent up to now is 10.8 secs Computing kpt #: 23 total cpu time spent up to now is 11.4 secs Computing kpt #: 24 total cpu time spent up to now is 11.9 secs Computing kpt #: 25 total cpu time spent up to now is 12.4 secs Computing kpt #: 26 total cpu time spent up to now is 13.0 secs Computing kpt #: 27 total cpu time spent up to now is 13.5 secs Computing kpt #: 28 total cpu time spent up to now is 14.1 secs Computing kpt #: 29 total cpu time spent up to now is 14.6 secs Computing kpt #: 30 total cpu time spent up to now is 15.2 secs Computing kpt #: 31 total cpu time spent up to now is 15.7 secs Computing kpt #: 32 total cpu time spent up to now is 16.2 secs Computing kpt #: 33 total cpu time spent up to now is 16.8 secs Computing kpt #: 34 total cpu time spent up to now is 17.3 secs Computing kpt #: 35 total cpu time spent up to now is 17.8 secs Computing kpt #: 36 total cpu time spent up to now is 18.3 secs Computing kpt #: 37 total cpu time spent up to now is 18.8 secs Computing kpt #: 38 total cpu time spent up to now is 19.4 secs Computing kpt #: 39 total cpu time spent up to now is 19.9 secs Computing kpt #: 40 total cpu time spent up to now is 20.4 secs Computing kpt #: 41 total cpu time spent up to now is 20.9 secs Computing kpt #: 42 total cpu time spent up to now is 21.4 secs Computing kpt #: 43 total cpu time spent up to now is 22.0 secs Computing kpt #: 44 total cpu time spent up to now is 22.5 secs Computing kpt #: 45 total cpu time spent up to now is 23.1 secs Computing kpt #: 46 total cpu time spent up to now is 23.6 secs Computing kpt #: 47 total cpu time spent up to now is 24.1 secs Computing kpt #: 48 total cpu time spent up to now is 24.7 secs Computing kpt #: 49 total cpu time spent up to now is 25.2 secs Computing kpt #: 50 total cpu time spent up to now is 25.7 secs Computing kpt #: 51 total cpu time spent up to now is 26.2 secs Computing kpt #: 52 total cpu time spent up to now is 26.6 secs Computing kpt #: 53 total cpu time spent up to now is 27.0 secs Computing kpt #: 54 total cpu time spent up to now is 27.5 secs Computing kpt #: 55 total cpu time spent up to now is 28.0 secs Computing kpt #: 56 total cpu time spent up to now is 28.4 secs Computing kpt #: 57 total cpu time spent up to now is 28.8 secs Computing kpt #: 58 total cpu time spent up to now is 29.3 secs Computing kpt #: 59 total cpu time spent up to now is 29.8 secs Computing kpt #: 60 total cpu time spent up to now is 30.2 secs Computing kpt #: 61 total cpu time spent up to now is 30.6 secs Computing kpt #: 62 total cpu time spent up to now is 31.0 secs Computing kpt #: 63 total cpu time spent up to now is 31.8 secs Computing kpt #: 64 total cpu time spent up to now is 32.2 secs Computing kpt #: 65 total cpu time spent up to now is 32.7 secs Computing kpt #: 66 total cpu time spent up to now is 33.1 secs Computing kpt #: 67 total cpu time spent up to now is 33.6 secs Computing kpt #: 68 total cpu time spent up to now is 34.0 secs Computing kpt #: 69 total cpu time spent up to now is 34.4 secs Computing kpt #: 70 total cpu time spent up to now is 34.8 secs Computing kpt #: 71 total cpu time spent up to now is 35.2 secs Computing kpt #: 72 total cpu time spent up to now is 35.6 secs Computing kpt #: 73 total cpu time spent up to now is 36.1 secs Computing kpt #: 74 total cpu time spent up to now is 36.6 secs Computing kpt #: 75 total cpu time spent up to now is 37.0 secs Computing kpt #: 76 total cpu time spent up to now is 37.5 secs Computing kpt #: 77 total cpu time spent up to now is 38.0 secs Computing kpt #: 78 total cpu time spent up to now is 38.4 secs Computing kpt #: 79 total cpu time spent up to now is 38.9 secs Computing kpt #: 80 total cpu time spent up to now is 39.4 secs Computing kpt #: 81 total cpu time spent up to now is 39.8 secs Computing kpt #: 82 total cpu time spent up to now is 40.2 secs Computing kpt #: 83 total cpu time spent up to now is 40.6 secs Computing kpt #: 84 total cpu time spent up to now is 41.2 secs Computing kpt #: 85 total cpu time spent up to now is 41.6 secs Computing kpt #: 86 total cpu time spent up to now is 42.2 secs Computing kpt #: 87 total cpu time spent up to now is 42.6 secs Computing kpt #: 88 total cpu time spent up to now is 43.0 secs Computing kpt #: 89 total cpu time spent up to now is 43.6 secs Computing kpt #: 90 total cpu time spent up to now is 44.2 secs Computing kpt #: 91 total cpu time spent up to now is 44.7 secs Computing kpt #: 92 total cpu time spent up to now is 45.3 secs Computing kpt #: 93 total cpu time spent up to now is 45.9 secs Computing kpt #: 94 total cpu time spent up to now is 46.4 secs Computing kpt #: 95 total cpu time spent up to now is 46.9 secs Computing kpt #: 96 total cpu time spent up to now is 47.5 secs Computing kpt #: 97 total cpu time spent up to now is 48.0 secs Computing kpt #: 98 total cpu time spent up to now is 48.6 secs Computing kpt #: 99 total cpu time spent up to now is 49.1 secs Computing kpt #: 100 total cpu time spent up to now is 49.6 secs Computing kpt #: 101 total cpu time spent up to now is 50.1 secs Computing kpt #: 102 total cpu time spent up to now is 50.6 secs Computing kpt #: 103 total cpu time spent up to now is 51.0 secs Computing kpt #: 104 total cpu time spent up to now is 51.5 secs Computing kpt #: 105 total cpu time spent up to now is 52.0 secs Computing kpt #: 106 total cpu time spent up to now is 52.5 secs Computing kpt #: 107 total cpu time spent up to now is 53.0 secs Computing kpt #: 108 total cpu time spent up to now is 53.4 secs Computing kpt #: 109 total cpu time spent up to now is 53.8 secs Computing kpt #: 110 total cpu time spent up to now is 54.3 secs Computing kpt #: 111 total cpu time spent up to now is 54.8 secs Computing kpt #: 112 total cpu time spent up to now is 55.2 secs Computing kpt #: 113 total cpu time spent up to now is 55.6 secs Computing kpt #: 114 total cpu time spent up to now is 56.0 secs Computing kpt #: 115 total cpu time spent up to now is 56.5 secs Computing kpt #: 116 total cpu time spent up to now is 57.0 secs Computing kpt #: 117 total cpu time spent up to now is 57.4 secs Computing kpt #: 118 total cpu time spent up to now is 57.8 secs Computing kpt #: 119 total cpu time spent up to now is 58.3 secs Computing kpt #: 120 total cpu time spent up to now is 58.8 secs Computing kpt #: 121 total cpu time spent up to now is 59.2 secs Computing kpt #: 122 total cpu time spent up to now is 59.8 secs Computing kpt #: 123 total cpu time spent up to now is 60.2 secs Computing kpt #: 124 total cpu time spent up to now is 60.7 secs Computing kpt #: 125 total cpu time spent up to now is 61.2 secs Computing kpt #: 126 total cpu time spent up to now is 61.8 secs Computing kpt #: 127 total cpu time spent up to now is 62.3 secs Computing kpt #: 128 total cpu time spent up to now is 62.8 secs Computing kpt #: 129 total cpu time spent up to now is 63.3 secs Computing kpt #: 130 total cpu time spent up to now is 63.9 secs Computing kpt #: 131 total cpu time spent up to now is 64.4 secs Computing kpt #: 132 total cpu time spent up to now is 65.0 secs Computing kpt #: 133 total cpu time spent up to now is 65.5 secs Computing kpt #: 134 total cpu time spent up to now is 66.0 secs Computing kpt #: 135 total cpu time spent up to now is 66.5 secs Computing kpt #: 136 total cpu time spent up to now is 67.0 secs Computing kpt #: 137 total cpu time spent up to now is 67.5 secs Computing kpt #: 138 total cpu time spent up to now is 68.0 secs Computing kpt #: 139 total cpu time spent up to now is 68.5 secs Computing kpt #: 140 total cpu time spent up to now is 69.0 secs Computing kpt #: 141 total cpu time spent up to now is 69.4 secs Computing kpt #: 142 total cpu time spent up to now is 69.9 secs Computing kpt #: 143 total cpu time spent up to now is 70.4 secs Computing kpt #: 144 total cpu time spent up to now is 70.8 secs Computing kpt #: 145 total cpu time spent up to now is 71.2 secs Computing kpt #: 146 total cpu time spent up to now is 71.6 secs Computing kpt #: 147 total cpu time spent up to now is 72.1 secs Computing kpt #: 148 total cpu time spent up to now is 72.5 secs Computing kpt #: 149 total cpu time spent up to now is 72.9 secs Computing kpt #: 150 total cpu time spent up to now is 73.4 secs Computing kpt #: 151 total cpu time spent up to now is 73.8 secs Computing kpt #: 152 total cpu time spent up to now is 74.2 secs Computing kpt #: 153 total cpu time spent up to now is 74.6 secs Computing kpt #: 154 total cpu time spent up to now is 75.0 secs Computing kpt #: 155 total cpu time spent up to now is 75.4 secs Computing kpt #: 156 total cpu time spent up to now is 75.8 secs Computing kpt #: 157 total cpu time spent up to now is 76.3 secs Computing kpt #: 158 total cpu time spent up to now is 76.9 secs Computing kpt #: 159 total cpu time spent up to now is 77.4 secs Computing kpt #: 160 total cpu time spent up to now is 78.0 secs Computing kpt #: 161 total cpu time spent up to now is 78.5 secs Computing kpt #: 162 total cpu time spent up to now is 79.0 secs Computing kpt #: 163 total cpu time spent up to now is 79.4 secs Computing kpt #: 164 total cpu time spent up to now is 79.8 secs Computing kpt #: 165 total cpu time spent up to now is 80.2 secs Computing kpt #: 166 total cpu time spent up to now is 80.6 secs Computing kpt #: 167 total cpu time spent up to now is 81.0 secs Computing kpt #: 168 total cpu time spent up to now is 81.4 secs Computing kpt #: 169 total cpu time spent up to now is 81.8 secs Computing kpt #: 170 total cpu time spent up to now is 82.2 secs Computing kpt #: 171 total cpu time spent up to now is 82.6 secs Computing kpt #: 172 total cpu time spent up to now is 83.0 secs Computing kpt #: 173 total cpu time spent up to now is 83.4 secs Computing kpt #: 174 total cpu time spent up to now is 83.8 secs Computing kpt #: 175 total cpu time spent up to now is 84.2 secs Computing kpt #: 176 total cpu time spent up to now is 84.6 secs Computing kpt #: 177 total cpu time spent up to now is 85.0 secs Computing kpt #: 178 total cpu time spent up to now is 85.3 secs Computing kpt #: 179 total cpu time spent up to now is 85.7 secs Computing kpt #: 180 total cpu time spent up to now is 86.1 secs Computing kpt #: 181 total cpu time spent up to now is 86.5 secs Computing kpt #: 182 total cpu time spent up to now is 86.9 secs Computing kpt #: 183 total cpu time spent up to now is 87.3 secs Computing kpt #: 184 total cpu time spent up to now is 87.7 secs Computing kpt #: 185 total cpu time spent up to now is 88.1 secs Computing kpt #: 186 total cpu time spent up to now is 88.5 secs Computing kpt #: 187 total cpu time spent up to now is 88.9 secs Computing kpt #: 188 total cpu time spent up to now is 89.2 secs Computing kpt #: 189 total cpu time spent up to now is 89.6 secs Computing kpt #: 190 total cpu time spent up to now is 90.0 secs Computing kpt #: 191 total cpu time spent up to now is 90.3 secs Computing kpt #: 192 total cpu time spent up to now is 90.7 secs Computing kpt #: 193 total cpu time spent up to now is 91.1 secs Computing kpt #: 194 total cpu time spent up to now is 91.5 secs Computing kpt #: 195 total cpu time spent up to now is 91.9 secs Computing kpt #: 196 total cpu time spent up to now is 92.3 secs Computing kpt #: 197 total cpu time spent up to now is 92.7 secs Computing kpt #: 198 total cpu time spent up to now is 93.1 secs Computing kpt #: 199 total cpu time spent up to now is 93.5 secs Computing kpt #: 200 total cpu time spent up to now is 93.9 secs Computing kpt #: 201 total cpu time spent up to now is 94.3 secs Computing kpt #: 202 total cpu time spent up to now is 94.8 secs Computing kpt #: 203 total cpu time spent up to now is 95.1 secs Computing kpt #: 204 total cpu time spent up to now is 95.5 secs Computing kpt #: 205 total cpu time spent up to now is 95.9 secs Computing kpt #: 206 total cpu time spent up to now is 96.2 secs Computing kpt #: 207 total cpu time spent up to now is 96.6 secs Computing kpt #: 208 total cpu time spent up to now is 97.0 secs Computing kpt #: 209 total cpu time spent up to now is 97.3 secs Computing kpt #: 210 total cpu time spent up to now is 97.7 secs Computing kpt #: 211 total cpu time spent up to now is 98.1 secs Computing kpt #: 212 total cpu time spent up to now is 98.5 secs Computing kpt #: 213 total cpu time spent up to now is 98.9 secs Computing kpt #: 214 total cpu time spent up to now is 99.3 secs Computing kpt #: 215 total cpu time spent up to now is 99.7 secs Computing kpt #: 216 total cpu time spent up to now is 100.1 secs Computing kpt #: 217 total cpu time spent up to now is 100.5 secs Computing kpt #: 218 total cpu time spent up to now is 100.9 secs Computing kpt #: 219 total cpu time spent up to now is 101.3 secs Computing kpt #: 220 total cpu time spent up to now is 101.7 secs Computing kpt #: 221 total cpu time spent up to now is 102.1 secs Computing kpt #: 222 total cpu time spent up to now is 102.5 secs Computing kpt #: 223 total cpu time spent up to now is 102.9 secs Computing kpt #: 224 total cpu time spent up to now is 103.3 secs Computing kpt #: 225 total cpu time spent up to now is 103.7 secs Computing kpt #: 226 total cpu time spent up to now is 104.1 secs Computing kpt #: 227 total cpu time spent up to now is 104.5 secs Computing kpt #: 228 total cpu time spent up to now is 104.9 secs Computing kpt #: 229 total cpu time spent up to now is 105.3 secs Computing kpt #: 230 total cpu time spent up to now is 105.7 secs Computing kpt #: 231 total cpu time spent up to now is 106.1 secs Computing kpt #: 232 total cpu time spent up to now is 106.6 secs Computing kpt #: 233 total cpu time spent up to now is 107.0 secs Computing kpt #: 234 total cpu time spent up to now is 107.4 secs Computing kpt #: 235 total cpu time spent up to now is 107.8 secs Computing kpt #: 236 total cpu time spent up to now is 108.2 secs Computing kpt #: 237 total cpu time spent up to now is 108.6 secs Computing kpt #: 238 total cpu time spent up to now is 109.0 secs Computing kpt #: 239 total cpu time spent up to now is 109.4 secs Computing kpt #: 240 total cpu time spent up to now is 109.9 secs Computing kpt #: 241 total cpu time spent up to now is 110.3 secs Computing kpt #: 242 total cpu time spent up to now is 110.8 secs Computing kpt #: 243 total cpu time spent up to now is 111.2 secs Computing kpt #: 244 total cpu time spent up to now is 111.6 secs Computing kpt #: 245 total cpu time spent up to now is 112.0 secs Computing kpt #: 246 total cpu time spent up to now is 112.4 secs Computing kpt #: 247 total cpu time spent up to now is 112.9 secs Computing kpt #: 248 total cpu time spent up to now is 113.3 secs Computing kpt #: 249 total cpu time spent up to now is 113.8 secs Computing kpt #: 250 total cpu time spent up to now is 114.2 secs Computing kpt #: 251 total cpu time spent up to now is 114.6 secs Computing kpt #: 252 total cpu time spent up to now is 115.1 secs Computing kpt #: 253 total cpu time spent up to now is 115.5 secs Computing kpt #: 254 total cpu time spent up to now is 116.0 secs Computing kpt #: 255 total cpu time spent up to now is 116.4 secs Computing kpt #: 256 total cpu time spent up to now is 116.8 secs Computing kpt #: 257 total cpu time spent up to now is 117.3 secs Computing kpt #: 258 total cpu time spent up to now is 117.7 secs Computing kpt #: 259 total cpu time spent up to now is 118.2 secs Computing kpt #: 260 total cpu time spent up to now is 118.6 secs Computing kpt #: 261 total cpu time spent up to now is 119.0 secs Computing kpt #: 262 total cpu time spent up to now is 119.5 secs Computing kpt #: 263 total cpu time spent up to now is 119.9 secs Computing kpt #: 264 total cpu time spent up to now is 120.4 secs Computing kpt #: 265 total cpu time spent up to now is 120.8 secs Computing kpt #: 266 total cpu time spent up to now is 121.3 secs Computing kpt #: 267 total cpu time spent up to now is 121.7 secs Computing kpt #: 268 total cpu time spent up to now is 122.2 secs Computing kpt #: 269 total cpu time spent up to now is 122.7 secs Computing kpt #: 270 total cpu time spent up to now is 123.2 secs Computing kpt #: 271 total cpu time spent up to now is 123.6 secs Computing kpt #: 272 total cpu time spent up to now is 124.1 secs Computing kpt #: 273 total cpu time spent up to now is 124.6 secs Computing kpt #: 274 total cpu time spent up to now is 125.0 secs Computing kpt #: 275 total cpu time spent up to now is 125.5 secs Computing kpt #: 276 total cpu time spent up to now is 126.0 secs Computing kpt #: 277 total cpu time spent up to now is 126.5 secs Computing kpt #: 278 total cpu time spent up to now is 127.0 secs Computing kpt #: 279 total cpu time spent up to now is 127.5 secs Computing kpt #: 280 total cpu time spent up to now is 128.0 secs Computing kpt #: 281 total cpu time spent up to now is 128.5 secs Computing kpt #: 282 total cpu time spent up to now is 128.9 secs Computing kpt #: 283 total cpu time spent up to now is 129.4 secs Computing kpt #: 284 total cpu time spent up to now is 130.1 secs Computing kpt #: 285 total cpu time spent up to now is 130.5 secs Computing kpt #: 286 total cpu time spent up to now is 131.0 secs Computing kpt #: 287 total cpu time spent up to now is 131.5 secs Computing kpt #: 288 total cpu time spent up to now is 131.9 secs Computing kpt #: 289 total cpu time spent up to now is 132.4 secs Computing kpt #: 290 total cpu time spent up to now is 132.9 secs Computing kpt #: 291 total cpu time spent up to now is 133.4 secs Computing kpt #: 292 total cpu time spent up to now is 133.8 secs Computing kpt #: 293 total cpu time spent up to now is 134.2 secs Computing kpt #: 294 total cpu time spent up to now is 134.7 secs Computing kpt #: 295 total cpu time spent up to now is 135.2 secs Computing kpt #: 296 total cpu time spent up to now is 135.6 secs Computing kpt #: 297 total cpu time spent up to now is 136.0 secs Computing kpt #: 298 total cpu time spent up to now is 136.5 secs Computing kpt #: 299 total cpu time spent up to now is 136.9 secs Computing kpt #: 300 total cpu time spent up to now is 137.3 secs Computing kpt #: 301 total cpu time spent up to now is 137.8 secs Computing kpt #: 302 total cpu time spent up to now is 138.2 secs Computing kpt #: 303 total cpu time spent up to now is 138.6 secs Computing kpt #: 304 total cpu time spent up to now is 139.1 secs Computing kpt #: 305 total cpu time spent up to now is 139.5 secs Computing kpt #: 306 total cpu time spent up to now is 139.9 secs Computing kpt #: 307 total cpu time spent up to now is 140.3 secs Computing kpt #: 308 total cpu time spent up to now is 140.8 secs Computing kpt #: 309 total cpu time spent up to now is 141.2 secs Computing kpt #: 310 total cpu time spent up to now is 141.5 secs Computing kpt #: 311 total cpu time spent up to now is 141.9 secs Computing kpt #: 312 total cpu time spent up to now is 142.3 secs Computing kpt #: 313 total cpu time spent up to now is 142.7 secs Computing kpt #: 314 total cpu time spent up to now is 143.1 secs Computing kpt #: 315 total cpu time spent up to now is 143.5 secs Computing kpt #: 316 total cpu time spent up to now is 143.9 secs Computing kpt #: 317 total cpu time spent up to now is 144.3 secs Computing kpt #: 318 total cpu time spent up to now is 144.7 secs Computing kpt #: 319 total cpu time spent up to now is 145.1 secs Computing kpt #: 320 total cpu time spent up to now is 145.5 secs Computing kpt #: 321 total cpu time spent up to now is 145.9 secs Computing kpt #: 322 total cpu time spent up to now is 146.3 secs Computing kpt #: 323 total cpu time spent up to now is 146.7 secs Computing kpt #: 324 total cpu time spent up to now is 147.1 secs Computing kpt #: 325 total cpu time spent up to now is 147.5 secs Computing kpt #: 326 total cpu time spent up to now is 147.9 secs Computing kpt #: 327 total cpu time spent up to now is 148.3 secs Computing kpt #: 328 total cpu time spent up to now is 148.7 secs Computing kpt #: 329 total cpu time spent up to now is 149.1 secs Computing kpt #: 330 total cpu time spent up to now is 149.5 secs Computing kpt #: 331 total cpu time spent up to now is 149.9 secs Computing kpt #: 332 total cpu time spent up to now is 150.3 secs Computing kpt #: 333 total cpu time spent up to now is 150.7 secs Computing kpt #: 334 total cpu time spent up to now is 151.0 secs Computing kpt #: 335 total cpu time spent up to now is 151.4 secs Computing kpt #: 336 total cpu time spent up to now is 151.8 secs Computing kpt #: 337 total cpu time spent up to now is 152.2 secs Computing kpt #: 338 total cpu time spent up to now is 152.5 secs Computing kpt #: 339 total cpu time spent up to now is 152.9 secs Computing kpt #: 340 total cpu time spent up to now is 153.3 secs Computing kpt #: 341 total cpu time spent up to now is 153.8 secs Computing kpt #: 342 total cpu time spent up to now is 154.2 secs Computing kpt #: 343 total cpu time spent up to now is 154.5 secs Computing kpt #: 344 total cpu time spent up to now is 154.9 secs Computing kpt #: 345 total cpu time spent up to now is 155.3 secs Computing kpt #: 346 total cpu time spent up to now is 155.7 secs Computing kpt #: 347 total cpu time spent up to now is 156.1 secs Computing kpt #: 348 total cpu time spent up to now is 156.5 secs Computing kpt #: 349 total cpu time spent up to now is 156.9 secs Computing kpt #: 350 total cpu time spent up to now is 157.3 secs Computing kpt #: 351 total cpu time spent up to now is 157.8 secs Computing kpt #: 352 total cpu time spent up to now is 158.2 secs Computing kpt #: 353 total cpu time spent up to now is 158.6 secs Computing kpt #: 354 total cpu time spent up to now is 159.1 secs Computing kpt #: 355 total cpu time spent up to now is 159.5 secs Computing kpt #: 356 total cpu time spent up to now is 160.0 secs Computing kpt #: 357 total cpu time spent up to now is 160.4 secs Computing kpt #: 358 total cpu time spent up to now is 160.8 secs Computing kpt #: 359 total cpu time spent up to now is 161.2 secs Computing kpt #: 360 total cpu time spent up to now is 161.6 secs Computing kpt #: 361 total cpu time spent up to now is 162.1 secs Computing kpt #: 362 total cpu time spent up to now is 162.5 secs Computing kpt #: 363 total cpu time spent up to now is 163.0 secs Computing kpt #: 364 total cpu time spent up to now is 163.4 secs Computing kpt #: 365 total cpu time spent up to now is 163.8 secs Computing kpt #: 366 total cpu time spent up to now is 164.2 secs Computing kpt #: 367 total cpu time spent up to now is 164.7 secs Computing kpt #: 368 total cpu time spent up to now is 165.1 secs Computing kpt #: 369 total cpu time spent up to now is 165.6 secs Computing kpt #: 370 total cpu time spent up to now is 166.0 secs Computing kpt #: 371 total cpu time spent up to now is 166.4 secs Computing kpt #: 372 total cpu time spent up to now is 166.8 secs Computing kpt #: 373 total cpu time spent up to now is 167.2 secs Computing kpt #: 374 total cpu time spent up to now is 167.6 secs Computing kpt #: 375 total cpu time spent up to now is 168.1 secs Computing kpt #: 376 total cpu time spent up to now is 168.5 secs Computing kpt #: 377 total cpu time spent up to now is 168.9 secs Computing kpt #: 378 total cpu time spent up to now is 169.4 secs Computing kpt #: 379 total cpu time spent up to now is 169.8 secs Computing kpt #: 380 total cpu time spent up to now is 170.2 secs Computing kpt #: 381 total cpu time spent up to now is 170.7 secs Computing kpt #: 382 total cpu time spent up to now is 171.3 secs Computing kpt #: 383 total cpu time spent up to now is 171.8 secs Computing kpt #: 384 total cpu time spent up to now is 172.4 secs Computing kpt #: 385 total cpu time spent up to now is 172.9 secs Computing kpt #: 386 total cpu time spent up to now is 173.5 secs Computing kpt #: 387 total cpu time spent up to now is 174.0 secs Computing kpt #: 388 total cpu time spent up to now is 174.6 secs Computing kpt #: 389 total cpu time spent up to now is 175.2 secs Computing kpt #: 390 total cpu time spent up to now is 175.7 secs Computing kpt #: 391 total cpu time spent up to now is 176.3 secs Computing kpt #: 392 total cpu time spent up to now is 176.8 secs Computing kpt #: 393 total cpu time spent up to now is 177.3 secs Computing kpt #: 394 total cpu time spent up to now is 177.9 secs Computing kpt #: 395 total cpu time spent up to now is 178.4 secs Computing kpt #: 396 total cpu time spent up to now is 178.9 secs Computing kpt #: 397 total cpu time spent up to now is 179.5 secs Computing kpt #: 398 total cpu time spent up to now is 180.0 secs Computing kpt #: 399 total cpu time spent up to now is 180.5 secs Computing kpt #: 400 total cpu time spent up to now is 181.1 secs Computing kpt #: 401 total cpu time spent up to now is 181.7 secs Computing kpt #: 402 total cpu time spent up to now is 182.2 secs Computing kpt #: 403 total cpu time spent up to now is 182.7 secs Computing kpt #: 404 total cpu time spent up to now is 183.2 secs Computing kpt #: 405 total cpu time spent up to now is 183.7 secs Computing kpt #: 406 total cpu time spent up to now is 184.2 secs Computing kpt #: 407 total cpu time spent up to now is 184.7 secs Computing kpt #: 408 total cpu time spent up to now is 185.2 secs Computing kpt #: 409 total cpu time spent up to now is 185.7 secs Computing kpt #: 410 total cpu time spent up to now is 186.2 secs Computing kpt #: 411 total cpu time spent up to now is 186.6 secs ethr = 2.17E-08, avg # of iterations = 15.4 total cpu time spent up to now is 186.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3791 PWs) bands (ev): -80.9618 -80.9618 -80.9599 -80.9599 -46.6558 -46.6558 -46.6462 -46.6462 -44.9380 -44.9380 -44.9336 -44.9336 -44.9097 -44.9097 -44.8906 -44.8906 -9.1008 -9.1008 -8.5231 -8.5231 4.1207 4.1207 5.2910 5.2910 5.2930 5.2930 5.3116 5.3116 5.5092 5.5092 5.5137 5.5137 9.5833 9.5833 9.5873 9.5873 9.9565 9.9565 10.1108 10.1108 10.1314 10.1314 11.4172 11.4172 11.4409 11.4409 11.5428 11.5428 12.1025 12.1025 12.3053 12.3053 12.3491 12.3491 16.8209 16.8209 k = 0.0088 0.0051-0.0000 ( 3797 PWs) bands (ev): -80.9621 -80.9621 -80.9600 -80.9600 -46.6559 -46.6558 -46.6462 -46.6462 -44.9380 -44.9380 -44.9337 -44.9337 -44.9098 -44.9096 -44.8907 -44.8907 -9.1004 -9.1004 -8.5231 -8.5227 4.1211 4.1216 5.2899 5.2900 5.2925 5.2926 5.3117 5.3122 5.5088 5.5089 5.5134 5.5135 9.5823 9.5825 9.5853 9.5880 9.9485 9.9637 10.1087 10.1099 10.1254 10.1399 11.4193 11.4194 11.4392 11.4393 11.5407 11.5414 12.0999 12.1040 12.3047 12.3047 12.3477 12.3492 16.8234 16.8246 k = 0.0175 0.0101-0.0000 ( 3805 PWs) bands (ev): -80.9625 -80.9625 -80.9601 -80.9601 -46.6559 -46.6558 -46.6464 -46.6464 -44.9381 -44.9381 -44.9338 -44.9338 -44.9098 -44.9096 -44.8908 -44.8908 -9.0993 -9.0993 -8.5228 -8.5220 4.1229 4.1239 5.2856 5.2859 5.2926 5.2930 5.3126 5.3136 5.5073 5.5079 5.5132 5.5133 9.5799 9.5807 9.5825 9.5881 9.9402 9.9704 10.1017 10.1083 10.1242 10.1491 11.4247 11.4258 11.4354 11.4369 11.5366 11.5378 12.0967 12.1047 12.3033 12.3034 12.3455 12.3485 16.8321 16.8346 k = 0.0263 0.0152-0.0000 ( 3809 PWs) bands (ev): -80.9625 -80.9625 -80.9602 -80.9602 -46.6561 -46.6558 -46.6464 -46.6464 -44.9382 -44.9382 -44.9339 -44.9339 -44.9099 -44.9096 -44.8908 -44.8908 -9.0974 -9.0974 -8.5222 -8.5210 4.1262 4.1276 5.2785 5.2790 5.2935 5.2940 5.3141 5.3154 5.5042 5.5056 5.5136 5.5142 9.5762 9.5780 9.5798 9.5884 9.9311 9.9765 10.0911 10.1066 10.1260 10.1579 11.4253 11.4292 11.4378 11.4425 11.5317 11.5334 12.0933 12.1051 12.3015 12.3017 12.3430 12.3474 16.8470 16.8507 k = 0.0351 0.0203-0.0000 ( 3813 PWs) bands (ev): -80.9626 -80.9626 -80.9604 -80.9604 -46.6562 -46.6558 -46.6465 -46.6465 -44.9383 -44.9382 -44.9340 -44.9340 -44.9100 -44.9096 -44.8909 -44.8909 -9.0948 -9.0948 -8.5212 -8.5196 4.1307 4.1327 5.2690 5.2695 5.2948 5.2956 5.3160 5.3176 5.4997 5.5018 5.5147 5.5158 9.5715 9.5735 9.5773 9.5884 9.9217 9.9819 10.0801 10.1048 10.1286 10.1667 11.4187 11.4218 11.4524 11.4569 11.5259 11.5279 12.0896 12.1049 12.2990 12.2996 12.3399 12.3458 16.8680 16.8730 k = 0.0439 0.0253-0.0000 ( 3817 PWs) bands (ev): -80.9626 -80.9626 -80.9606 -80.9606 -46.6563 -46.6558 -46.6466 -46.6466 -44.9384 -44.9384 -44.9341 -44.9341 -44.9101 -44.9095 -44.8909 -44.8909 -9.0915 -9.0915 -8.5199 -8.5180 4.1367 4.1392 5.2570 5.2576 5.2966 5.2975 5.3182 5.3202 5.4938 5.4966 5.5165 5.5180 9.5652 9.5675 9.5749 9.5883 9.9120 9.9866 10.0691 10.1039 10.1321 10.1755 11.4086 11.4115 11.4695 11.4741 11.5206 11.5228 12.0855 12.1041 12.2959 12.2970 12.3362 12.3434 16.8951 16.9013 k = 0.0526 0.0304-0.0000 ( 3817 PWs) bands (ev): -80.9626 -80.9626 -80.9606 -80.9606 -46.6564 -46.6558 -46.6466 -46.6466 -44.9385 -44.9385 -44.9342 -44.9342 -44.9101 -44.9094 -44.8910 -44.8910 -9.0875 -9.0875 -8.5183 -8.5160 4.1441 4.1470 5.2428 5.2435 5.2988 5.2999 5.3207 5.3231 5.4868 5.4902 5.5189 5.5207 9.5579 9.5608 9.5725 9.5882 9.9024 9.9902 10.0591 10.1034 10.1361 10.1844 11.3962 11.3987 11.4828 11.4867 11.5220 11.5252 12.0814 12.1028 12.2925 12.2945 12.3324 12.3410 16.9281 16.9354 k = 0.0614 0.0355-0.0000 ( 3825 PWs) bands (ev): -80.9628 -80.9628 -80.9608 -80.9608 -46.6566 -46.6559 -46.6468 -46.6468 -44.9387 -44.9387 -44.9344 -44.9344 -44.9102 -44.9094 -44.8911 -44.8911 -9.0827 -9.0827 -8.5163 -8.5136 4.1528 4.1562 5.2265 5.2273 5.3011 5.3025 5.3235 5.3262 5.4785 5.4825 5.5217 5.5239 9.5489 9.5526 9.5694 9.5872 9.8921 9.9913 10.0502 10.1027 10.1400 10.1929 11.3806 11.3825 11.4824 11.4846 11.5386 11.5435 12.0771 12.1007 12.2879 12.2914 12.3278 12.3379 16.9668 16.9753 k = 0.0702 0.0405-0.0000 ( 3829 PWs) bands (ev): -80.9630 -80.9630 -80.9608 -80.9608 -46.6567 -46.6559 -46.6469 -46.6469 -44.9388 -44.9388 -44.9346 -44.9346 -44.9102 -44.9093 -44.8912 -44.8912 -9.0772 -9.0772 -8.5141 -8.5110 4.1628 4.1667 5.2080 5.2089 5.3041 5.3057 5.3266 5.3297 5.4692 5.4738 5.5250 5.5275 9.5384 9.5429 9.5668 9.5868 9.8816 9.9896 10.0436 10.1027 10.1445 10.2011 11.3623 11.3635 11.4739 11.4749 11.5659 11.5717 12.0731 12.0984 12.2834 12.2887 12.3238 12.3351 17.0112 17.0207 k = 0.0789 0.0456-0.0000 ( 3829 PWs) bands (ev): -80.9631 -80.9631 -80.9607 -80.9607 -46.6567 -46.6559 -46.6471 -46.6471 -44.9389 -44.9389 -44.9348 -44.9348 -44.9103 -44.9092 -44.8913 -44.8913 -9.0711 -9.0711 -8.5115 -8.5081 4.1741 4.1784 5.1878 5.1887 5.3077 5.3094 5.3299 5.3333 5.4589 5.4642 5.5287 5.5316 9.5273 9.5328 9.5646 9.5867 9.8710 9.9840 10.0408 10.1033 10.1494 10.2094 11.3413 11.3417 11.4627 11.4628 11.5971 11.6035 12.0692 12.0954 12.2791 12.2866 12.3211 12.3335 17.0609 17.0715 k = 0.0877 0.0506-0.0000 ( 3821 PWs) bands (ev): -80.9628 -80.9628 -80.9605 -80.9605 -46.6568 -46.6558 -46.6471 -46.6471 -44.9390 -44.9390 -44.9349 -44.9349 -44.9102 -44.9091 -44.8913 -44.8913 -9.0643 -9.0642 -8.5087 -8.5049 4.1866 4.1914 5.1659 5.1669 5.3115 5.3135 5.3333 5.3371 5.4480 5.4539 5.5330 5.5361 9.5161 9.5230 9.5625 9.5866 9.8606 9.9748 10.0417 10.1044 10.1550 10.2181 11.3183 11.3187 11.4497 11.4511 11.6300 11.6368 12.0663 12.0925 12.2742 12.2841 12.3207 12.3338 17.1159 17.1275 k = 0.0965 0.0557-0.0000 ( 3821 PWs) bands (ev): -80.9629 -80.9629 -80.9603 -80.9603 -46.6568 -46.6558 -46.6473 -46.6473 -44.9392 -44.9392 -44.9352 -44.9352 -44.9102 -44.9089 -44.8914 -44.8914 -9.0568 -9.0567 -8.5056 -8.5015 4.2004 4.2056 5.1420 5.1431 5.3156 5.3179 5.3366 5.3407 5.4366 5.4431 5.5376 5.5410 9.5009 9.5094 9.5603 9.5863 9.8505 9.9634 10.0453 10.1058 10.1613 10.2276 11.2915 11.2929 11.4351 11.4378 11.6623 11.6693 12.0635 12.0888 12.2683 12.2801 12.3227 12.3354 17.1760 17.1885 k = 0.1053 0.0608-0.0000 ( 3817 PWs) bands (ev): -80.9627 -80.9627 -80.9602 -80.9602 -46.6569 -46.6558 -46.6474 -46.6474 -44.9394 -44.9394 -44.9354 -44.9354 -44.9102 -44.9089 -44.8915 -44.8915 -9.0487 -9.0486 -8.5022 -8.4978 4.2153 4.2209 5.1170 5.1181 5.3200 5.3226 5.3394 5.3437 5.4254 5.4323 5.5426 5.5463 9.4861 9.4964 9.5581 9.5859 9.8395 9.9502 10.0483 10.1070 10.1669 10.2356 11.2644 11.2667 11.4203 11.4242 11.6929 11.6998 12.0611 12.0848 12.2615 12.2745 12.3319 12.3430 17.2406 17.2541 k = 0.1140 0.0658-0.0000 ( 3823 PWs) bands (ev): -80.9629 -80.9629 -80.9604 -80.9604 -46.6571 -46.6559 -46.6476 -46.6476 -44.9396 -44.9396 -44.9356 -44.9356 -44.9103 -44.9088 -44.8917 -44.8917 -9.0399 -9.0398 -8.4986 -8.4938 4.2313 4.2373 5.0906 5.0919 5.3246 5.3275 5.3413 5.3453 5.4149 5.4219 5.5479 5.5519 9.4696 9.4819 9.5557 9.5852 9.8275 9.9352 10.0513 10.1079 10.1720 10.2428 11.2340 11.2371 11.4036 11.4087 11.7198 11.7263 12.0580 12.0797 12.2530 12.2667 12.3486 12.3573 17.3097 17.3239 k = 0.1228 0.0709-0.0000 ( 3833 PWs) bands (ev): -80.9632 -80.9632 -80.9606 -80.9606 -46.6573 -46.6560 -46.6479 -46.6479 -44.9399 -44.9398 -44.9360 -44.9360 -44.9103 -44.9088 -44.8919 -44.8919 -9.0306 -9.0305 -8.4947 -8.4896 4.2483 4.2548 5.0631 5.0644 5.3291 5.3327 5.3413 5.3441 5.4066 5.4131 5.5535 5.5577 9.4519 9.4663 9.5527 9.5840 9.8158 9.9200 10.0544 10.1083 10.1776 10.2504 11.2016 11.2055 11.3853 11.3918 11.7413 11.7474 12.0537 12.0732 12.2429 12.2569 12.3741 12.3804 17.3830 17.3980 k = 0.1316 0.0760-0.0000 ( 3835 PWs) bands (ev): -80.9632 -80.9632 -80.9606 -80.9606 -46.6574 -46.6561 -46.6481 -46.6481 -44.9401 -44.9401 -44.9363 -44.9363 -44.9103 -44.9087 -44.8921 -44.8920 -9.0207 -9.0205 -8.4907 -8.4852 4.2664 4.2732 5.0349 5.0362 5.3321 5.3379 5.3389 5.3399 5.4021 5.4071 5.5596 5.5640 9.4337 9.4504 9.5512 9.5840 9.8037 9.9038 10.0583 10.1100 10.1836 10.2577 11.1681 11.1728 11.3678 11.3756 11.7568 11.7627 12.0475 12.0656 12.2322 12.2467 12.4098 12.4143 17.4602 17.4759 k = 0.1404 0.0810-0.0000 ( 3831 PWs) bands (ev): -80.9630 -80.9630 -80.9605 -80.9605 -46.6575 -46.6561 -46.6483 -46.6482 -44.9404 -44.9403 -44.9365 -44.9365 -44.9103 -44.9087 -44.8922 -44.8921 -9.0102 -9.0100 -8.4864 -8.4806 4.2854 4.2925 5.0059 5.0074 5.3270 5.3282 5.3428 5.3444 5.4020 5.4049 5.5662 5.5709 9.4148 9.4340 9.5501 9.5844 9.7921 9.8879 10.0624 10.1120 10.1901 10.2654 11.1333 11.1388 11.3510 11.3601 11.7656 11.7719 12.0394 12.0572 12.2205 12.2355 12.4557 12.4590 17.5412 17.5575 k = 0.1491 0.0861-0.0000 ( 3831 PWs) bands (ev): -80.9632 -80.9632 -80.9603 -80.9603 -46.6576 -46.6561 -46.6485 -46.6485 -44.9406 -44.9405 -44.9369 -44.9369 -44.9102 -44.9085 -44.8924 -44.8923 -8.9992 -8.9989 -8.4819 -8.4759 4.3052 4.3126 4.9765 4.9781 5.3142 5.3158 5.3482 5.3506 5.4049 5.4059 5.5730 5.5778 9.3951 9.4168 9.5495 9.5851 9.7807 9.8720 10.0672 10.1149 10.1975 10.2735 11.0956 11.1020 11.3320 11.3424 11.7674 11.7750 12.0280 12.0468 12.2077 12.2235 12.5112 12.5140 17.6256 17.6423 k = 0.1579 0.0912-0.0000 ( 3841 PWs) bands (ev): -80.9632 -80.9632 -80.9608 -80.9608 -46.6579 -46.6563 -46.6488 -46.6487 -44.9410 -44.9409 -44.9372 -44.9372 -44.9103 -44.9085 -44.8925 -44.8925 -8.9877 -8.9874 -8.4773 -8.4710 4.3256 4.3333 4.9468 4.9485 5.2979 5.3013 5.3540 5.3568 5.4095 5.4101 5.5800 5.5850 9.3746 9.3989 9.5484 9.5853 9.7677 9.8543 10.0697 10.1154 10.2035 10.2803 11.0590 11.0661 11.3122 11.3238 11.7624 11.7724 12.0142 12.0356 12.1926 12.2091 12.5755 12.5784 17.7128 17.7298 k = 0.1667 0.0962-0.0000 ( 3841 PWs) bands (ev): -80.9631 -80.9631 -80.9608 -80.9608 -46.6580 -46.6564 -46.6490 -46.6489 -44.9413 -44.9412 -44.9375 -44.9375 -44.9103 -44.9084 -44.8927 -44.8926 -8.9757 -8.9754 -8.4725 -8.4659 4.3467 4.3546 4.9171 4.9189 5.2799 5.2847 5.3604 5.3634 5.4149 5.4166 5.5873 5.5925 9.3537 9.3806 9.5486 9.5866 9.7558 9.8376 10.0735 10.1175 10.2107 10.2877 11.0213 11.0292 11.2920 11.3048 11.7521 11.7655 11.9985 12.0237 12.1778 12.1951 12.6477 12.6510 17.8027 17.8198 k = 0.1754 0.1013-0.0000 ( 3839 PWs) bands (ev): -80.9630 -80.9630 -80.9607 -80.9607 -46.6582 -46.6565 -46.6492 -46.6491 -44.9415 -44.9414 -44.9379 -44.9378 -44.9102 -44.9083 -44.8929 -44.8928 -8.9632 -8.9629 -8.4676 -8.4608 4.3681 4.3762 4.8877 4.8897 5.2609 5.2667 5.3670 5.3702 5.4215 5.4239 5.5949 5.6002 9.3329 9.3624 9.5493 9.5884 9.7439 9.8209 10.0772 10.1197 10.2183 10.2953 10.9832 10.9918 11.2713 11.2852 11.7371 11.7548 11.9814 12.0112 12.1622 12.1803 12.7267 12.7306 17.8947 17.9115 k = 0.1842 0.1064-0.0000 ( 3839 PWs) bands (ev): -80.9631 -80.9631 -80.9605 -80.9605 -46.6582 -46.6565 -46.6495 -46.6493 -44.9418 -44.9417 -44.9382 -44.9382 -44.9102 -44.9082 -44.8931 -44.8930 -8.9504 -8.9500 -8.4625 -8.4555 4.3898 4.3979 4.8588 4.8609 5.2410 5.2477 5.3737 5.3772 5.4288 5.4318 5.6027 5.6081 9.3114 9.3436 9.5507 9.5906 9.7322 9.8042 10.0802 10.1213 10.2261 10.3029 10.9450 10.9546 11.2495 11.2646 11.7171 11.7398 11.9628 11.9980 12.1459 12.1649 12.8117 12.8162 17.9879 18.0040 k = 0.1930 0.1114-0.0000 ( 3841 PWs) bands (ev): -80.9633 -80.9633 -80.9604 -80.9604 -46.6584 -46.6566 -46.6498 -46.6496 -44.9421 -44.9419 -44.9386 -44.9386 -44.9101 -44.9081 -44.8933 -44.8931 -8.9372 -8.9367 -8.4574 -8.4502 4.4113 4.4194 4.8306 4.8330 5.2206 5.2281 5.3807 5.3843 5.4366 5.4401 5.6105 5.6161 9.2896 9.3245 9.5525 9.5931 9.7209 9.7877 10.0837 10.1235 10.2346 10.3106 10.9060 10.9166 11.2262 11.2426 11.6930 11.7211 11.9430 11.9840 12.1286 12.1484 12.9017 12.9069 18.0810 18.0955 k = 0.2018 0.1165-0.0000 ( 3837 PWs) bands (ev): -80.9631 -80.9631 -80.9602 -80.9602 -46.6584 -46.6566 -46.6500 -46.6498 -44.9423 -44.9422 -44.9390 -44.9390 -44.9101 -44.9080 -44.8935 -44.8933 -8.9236 -8.9230 -8.4523 -8.4448 4.4324 4.4404 4.8037 4.8064 5.1998 5.2079 5.3877 5.3916 5.4449 5.4489 5.6187 5.6244 9.2687 9.3060 9.5551 9.5963 9.7093 9.7711 10.0870 10.1259 10.2431 10.3178 10.8670 10.8787 11.2039 11.2213 11.6661 11.6998 11.9234 11.9703 12.1109 12.1314 12.9963 13.0022 18.1712 18.1823 k = 0.2105 0.1215-0.0000 ( 3837 PWs) bands (ev): -80.9631 -80.9631 -80.9602 -80.9602 -46.6586 -46.6567 -46.6503 -46.6501 -44.9427 -44.9425 -44.9394 -44.9394 -44.9100 -44.9079 -44.8937 -44.8935 -8.9097 -8.9090 -8.4471 -8.4394 4.4524 4.4601 4.7785 4.7816 5.1787 5.1875 5.3949 5.3989 5.4535 5.4579 5.6271 5.6329 9.2473 9.2872 9.5584 9.5997 9.6980 9.7544 10.0902 10.1283 10.2515 10.3246 10.8280 10.8411 11.1809 11.1994 11.6351 11.6744 11.9032 11.9560 12.0924 12.1136 13.0949 13.1014 18.2518 18.2573 k = 0.2193 0.1266-0.0000 ( 3829 PWs) bands (ev): -80.9629 -80.9629 -80.9598 -80.9598 -46.6586 -46.6566 -46.6505 -46.6503 -44.9429 -44.9427 -44.9397 -44.9397 -44.9099 -44.9077 -44.8939 -44.8937 -8.8955 -8.8948 -8.4418 -8.4340 4.4707 4.4779 4.7558 4.7595 5.1577 5.1670 5.4022 5.4063 5.4624 5.4671 5.6357 5.6415 9.2267 9.2691 9.5627 9.6038 9.6876 9.7384 10.0936 10.1310 10.2611 10.3318 10.7898 10.8047 11.1581 11.1777 11.6016 11.6461 11.8834 11.9416 12.0739 12.0956 13.1970 13.2041 18.3124 18.3126 k = 0.2281 0.1317-0.0000 ( 3833 PWs) bands (ev): -80.9630 -80.9630 -80.9599 -80.9599 -46.6587 -46.6567 -46.6508 -46.6506 -44.9432 -44.9430 -44.9402 -44.9402 -44.9098 -44.9076 -44.8941 -44.8939 -8.8811 -8.8803 -8.4366 -8.4286 4.4861 4.4924 4.7363 4.7410 5.1365 5.1465 5.4095 5.4137 5.4713 5.4764 5.6443 5.6502 9.2057 9.2504 9.5672 9.6075 9.6774 9.7220 10.0966 10.1333 10.2699 10.3377 10.7508 10.7678 11.1339 11.1545 11.5641 11.6135 11.8633 11.9266 12.0542 12.0764 13.3022 13.3100 18.3485 18.3510 k = 0.2368 0.1367-0.0000 ( 3843 PWs) bands (ev): -80.9630 -80.9630 -80.9604 -80.9604 -46.6590 -46.6570 -46.6511 -46.6508 -44.9437 -44.9434 -44.9406 -44.9406 -44.9099 -44.9076 -44.8944 -44.8941 -8.8664 -8.8655 -8.4314 -8.4232 4.4975 4.5026 4.7215 4.7272 5.1157 5.1262 5.4167 5.4210 5.4805 5.4858 5.6531 5.6590 9.1855 9.2326 9.5719 9.6099 9.6674 9.7046 10.0988 10.1351 10.2776 10.3417 10.7118 10.7313 11.1095 11.1309 11.5241 11.5779 11.8438 11.9115 12.0335 12.0560 13.4103 13.4187 18.3737 18.3764 k = 0.2456 0.1418-0.0000 ( 3849 PWs) bands (ev): -80.9630 -80.9630 -80.9607 -80.9607 -46.6593 -46.6572 -46.6514 -46.6511 -44.9441 -44.9439 -44.9409 -44.9409 -44.9098 -44.9076 -44.8946 -44.8943 -8.8516 -8.8506 -8.4263 -8.4180 4.5032 4.5069 4.7126 4.7195 5.0953 5.1065 5.4239 5.4284 5.4898 5.4953 5.6620 5.6679 9.1655 9.2150 9.5776 9.6111 9.6611 9.6887 10.1016 10.1375 10.2861 10.3457 10.6735 10.6962 11.0848 11.1072 11.4812 11.5388 11.8247 11.8962 12.0128 12.0356 13.5209 13.5298 18.3940 18.3963 k = 0.2544 0.1469-0.0000 ( 3857 PWs) bands (ev): -80.9632 -80.9632 -80.9609 -80.9609 -46.6594 -46.6574 -46.6517 -46.6514 -44.9445 -44.9442 -44.9414 -44.9414 -44.9098 -44.9075 -44.8948 -44.8945 -8.8366 -8.8355 -8.4212 -8.4128 4.5026 4.5050 4.7101 4.7181 5.0758 5.0876 5.4311 5.4356 5.4991 5.5048 5.6708 5.6766 9.1468 9.1984 9.5835 9.6092 9.6586 9.6738 10.1040 10.1396 10.2951 10.3489 10.6362 10.6632 11.0582 11.0814 11.4366 11.4973 11.8053 11.8801 11.9914 12.0144 13.6338 13.6433 18.4117 18.4136 k = 0.2632 0.1519-0.0000 ( 3845 PWs) bands (ev): -80.9629 -80.9629 -80.9604 -80.9604 -46.6594 -46.6574 -46.6519 -46.6516 -44.9447 -44.9445 -44.9417 -44.9417 -44.9096 -44.9073 -44.8950 -44.8946 -8.8216 -8.8204 -8.4162 -8.4077 4.4963 4.4975 4.7133 4.7221 5.0576 5.0701 5.4383 5.4429 5.5087 5.5146 5.6798 5.6856 9.1308 9.1844 9.5900 9.6047 9.6607 9.6609 10.1070 10.1422 10.3056 10.3521 10.6017 10.6344 11.0333 11.0572 11.3915 11.4548 11.7882 11.8656 11.9703 11.9933 13.7490 13.7590 18.4283 18.4299 k = 0.2719 0.1570-0.0000 ( 3839 PWs) bands (ev): -80.9628 -80.9628 -80.9601 -80.9601 -46.6595 -46.6574 -46.6521 -46.6518 -44.9450 -44.9447 -44.9421 -44.9421 -44.9094 -44.9071 -44.8952 -44.8948 -8.8064 -8.8051 -8.4113 -8.4027 4.4853 4.4857 4.7204 4.7294 5.0411 5.0543 5.4454 5.4500 5.5181 5.5242 5.6888 5.6946 9.1156 9.1709 9.5955 9.5977 9.6495 9.6665 10.1109 10.1459 10.3156 10.3527 10.5663 10.6063 11.0082 11.0327 11.3441 11.4096 11.7703 11.8498 11.9487 11.9717 13.8659 13.8763 18.4440 18.4453 k = 0.2807 0.1621-0.0000 ( 3829 PWs) bands (ev): -80.9624 -80.9624 -80.9598 -80.9598 -46.6595 -46.6574 -46.6523 -46.6520 -44.9452 -44.9450 -44.9424 -44.9424 -44.9093 -44.9070 -44.8954 -44.8950 -8.7913 -8.7899 -8.4066 -8.3980 4.4713 4.4714 4.7291 4.7379 5.0268 5.0409 5.4524 5.4571 5.5277 5.5338 5.6980 5.7037 9.1021 9.1591 9.5892 9.5984 9.6427 9.6751 10.1139 10.1486 10.3249 10.3505 10.5323 10.5817 10.9839 11.0089 11.2957 11.3630 11.7529 11.8342 11.9275 11.9505 13.9845 13.9954 18.4592 18.4603 k = 0.2895 0.1671-0.0000 ( 3829 PWs) bands (ev): -80.9623 -80.9623 -80.9598 -80.9598 -46.6596 -46.6575 -46.6526 -46.6522 -44.9456 -44.9453 -44.9428 -44.9428 -44.9092 -44.9069 -44.8956 -44.8952 -8.7761 -8.7746 -8.4020 -8.3933 4.4553 4.4558 4.7372 4.7457 5.0156 5.0305 5.4592 5.4639 5.5370 5.5433 5.7069 5.7125 9.0897 9.1484 9.5798 9.5945 9.6424 9.6843 10.1165 10.1509 10.3331 10.3446 10.4992 10.5604 10.9584 10.9836 11.2452 11.3140 11.7354 11.8180 11.9052 11.9280 14.1046 14.1159 18.4737 18.4746 k = 0.2982 0.1722-0.0000 ( 3825 PWs) bands (ev): -80.9621 -80.9621 -80.9597 -80.9597 -46.6597 -46.6576 -46.6528 -46.6524 -44.9459 -44.9455 -44.9432 -44.9432 -44.9090 -44.9068 -44.8958 -44.8953 -8.7611 -8.7594 -8.3976 -8.3889 4.4388 4.4395 4.7432 4.7511 5.0084 5.0241 5.4659 5.4706 5.5463 5.5526 5.7159 5.7214 9.0795 9.1397 9.5702 9.5857 9.6484 9.6948 10.1199 10.1538 10.3353 10.3401 10.4682 10.5433 10.9335 10.9588 11.1939 11.2639 11.7183 11.8019 11.8831 11.9055 14.2261 14.2378 18.4879 18.4887 k = 0.3070 0.1773-0.0000 ( 3827 PWs) bands (ev): -80.9617 -80.9617 -80.9601 -80.9601 -46.6598 -46.6577 -46.6530 -46.6526 -44.9462 -44.9459 -44.9435 -44.9435 -44.9090 -44.9067 -44.8960 -44.8955 -8.7461 -8.7443 -8.3934 -8.3847 4.4222 4.4232 4.7455 4.7528 5.0057 5.0221 5.4723 5.4770 5.5555 5.5618 5.7248 5.7302 9.0707 9.1326 9.5598 9.5739 9.6572 9.7057 10.1225 10.1558 10.3221 10.3434 10.4413 10.5301 10.9085 10.9336 11.1415 11.2123 11.7012 11.7854 11.8605 11.8824 14.3488 14.3608 18.5015 18.5023 k = 0.3158 0.1823-0.0000 ( 3823 PWs) bands (ev): -80.9615 -80.9615 -80.9600 -80.9600 -46.6599 -46.6578 -46.6533 -46.6528 -44.9465 -44.9462 -44.9439 -44.9438 -44.9088 -44.9066 -44.8962 -44.8956 -8.7312 -8.7294 -8.3894 -8.3808 4.4062 4.4074 4.7436 4.7504 5.0079 5.0248 5.4786 5.4832 5.5646 5.5709 5.7335 5.7387 9.0643 9.1275 9.5508 9.5626 9.6683 9.7178 10.1252 10.1577 10.3065 10.3425 10.4200 10.5207 10.8832 10.9076 11.0890 11.1602 11.6851 11.7697 11.8382 11.8595 14.4726 14.4850 18.5150 18.5157 k = 0.3246 0.1874-0.0000 ( 3825 PWs) bands (ev): -80.9615 -80.9615 -80.9600 -80.9600 -46.6600 -46.6579 -46.6536 -46.6531 -44.9468 -44.9465 -44.9443 -44.9442 -44.9087 -44.9065 -44.8964 -44.8959 -8.7166 -8.7146 -8.3857 -8.3771 4.3908 4.3921 4.7374 4.7440 5.0146 5.0317 5.4845 5.4891 5.5734 5.5797 5.7421 5.7472 9.0601 9.1246 9.5413 9.5505 9.6801 9.7300 10.1276 10.1589 10.2884 10.3319 10.4087 10.5138 10.8577 10.8809 11.0363 11.1074 11.6684 11.7529 11.8157 11.8363 14.5973 14.6100 18.5281 18.5287 k = 0.3333 0.1925-0.0000 ( 3813 PWs) bands (ev): -80.9611 -80.9611 -80.9596 -80.9596 -46.6599 -46.6579 -46.6537 -46.6532 -44.9470 -44.9466 -44.9446 -44.9445 -44.9084 -44.9063 -44.8966 -44.8960 -8.7022 -8.7001 -8.3822 -8.3737 4.3763 4.3777 4.7276 4.7340 5.0251 5.0421 5.4904 5.4950 5.5822 5.5884 5.7506 5.7555 9.0585 9.1239 9.5333 9.5400 9.6942 9.7443 10.1302 10.1597 10.2704 10.3140 10.4076 10.5100 10.8333 10.8544 10.9849 11.0552 11.6526 11.7367 11.7944 11.8143 14.7229 14.7360 18.5412 18.5419 k = 0.3421 0.1975-0.0000 ( 3805 PWs) bands (ev): -80.9610 -80.9610 -80.9592 -80.9592 -46.6599 -46.6578 -46.6540 -46.6534 -44.9472 -44.9468 -44.9449 -44.9448 -44.9082 -44.9061 -44.8968 -44.8962 -8.6880 -8.6858 -8.3789 -8.3705 4.3628 4.3644 4.7148 4.7211 5.0383 5.0551 5.4961 5.5005 5.5906 5.5968 5.7589 5.7636 9.0591 9.1254 9.5249 9.5291 9.7092 9.7592 10.1330 10.1597 10.2522 10.2913 10.4104 10.5059 10.8092 10.8265 10.9348 11.0031 11.6367 11.7200 11.7735 11.7928 14.8492 14.8625 18.5536 18.5544 k = 0.3509 0.2026-0.0000 ( 3801 PWs) bands (ev): -80.9608 -80.9608 -80.9591 -80.9591 -46.6599 -46.6579 -46.6542 -46.6536 -44.9474 -44.9470 -44.9452 -44.9451 -44.9081 -44.9060 -44.8970 -44.8964 -8.6741 -8.6718 -8.3759 -8.3677 4.3504 4.3522 4.7000 4.7063 5.0534 5.0698 5.5014 5.5057 5.5989 5.6049 5.7669 5.7715 9.0618 9.1290 9.5173 9.5190 9.7238 9.7736 10.1343 10.1565 10.2358 10.2681 10.4145 10.5017 10.7850 10.7962 10.8876 10.9518 11.6212 11.7033 11.7525 11.7710 14.9762 14.9897 18.5652 18.5662 k = 0.3596 0.2076-0.0000 ( 3797 PWs) bands (ev): -80.9606 -80.9606 -80.9590 -80.9590 -46.6599 -46.6579 -46.6544 -46.6538 -44.9476 -44.9473 -44.9455 -44.9454 -44.9079 -44.9059 -44.8972 -44.8966 -8.6606 -8.6583 -8.3732 -8.3651 4.3392 4.3411 4.6837 4.6900 5.0696 5.0854 5.5064 5.5106 5.6069 5.6127 5.7747 5.7791 9.0669 9.1348 9.5090 9.5097 9.7389 9.7883 10.1350 10.1500 10.2230 10.2457 10.4170 10.4950 10.7625 10.7639 10.8457 10.9026 11.6060 11.6865 11.7320 11.7498 15.1035 15.1173 18.5760 18.5772 k = 0.3684 0.2127-0.0000 ( 3801 PWs) bands (ev): -80.9607 -80.9607 -80.9591 -80.9591 -46.6600 -46.6581 -46.6546 -46.6540 -44.9479 -44.9475 -44.9459 -44.9458 -44.9078 -44.9058 -44.8974 -44.8968 -8.6475 -8.6451 -8.3708 -8.3629 4.3292 4.3312 4.6664 4.6727 5.0863 5.1015 5.5111 5.5151 5.6145 5.6202 5.7822 5.7863 9.0740 9.1425 9.4994 9.5022 9.7542 9.8030 10.1335 10.1392 10.2143 10.2254 10.4167 10.4852 10.7279 10.7390 10.8089 10.8563 11.5904 11.6688 11.7119 11.7290 15.2313 15.2453 18.5855 18.5871 k = 0.3772 0.2178-0.0000 ( 3803 PWs) bands (ev): -80.9607 -80.9607 -80.9591 -80.9591 -46.6600 -46.6582 -46.6548 -46.6542 -44.9481 -44.9477 -44.9462 -44.9461 -44.9076 -44.9057 -44.8976 -44.8970 -8.6348 -8.6323 -8.3687 -8.3610 4.3204 4.3225 4.6487 4.6549 5.1031 5.1176 5.5156 5.5194 5.6218 5.6273 5.7893 5.7933 9.0840 9.1529 9.4904 9.4954 9.7694 9.8176 10.1250 10.1295 10.2084 10.2095 10.4121 10.4711 10.6923 10.7165 10.7776 10.8146 11.5757 11.6515 11.6925 11.7091 15.3594 15.3735 18.5930 18.5952 k = 0.3860 0.2228-0.0000 ( 3801 PWs) bands (ev): -80.9606 -80.9606 -80.9590 -80.9590 -46.6600 -46.6582 -46.6550 -46.6544 -44.9482 -44.9479 -44.9465 -44.9464 -44.9075 -44.9056 -44.8978 -44.8972 -8.6227 -8.6201 -8.3668 -8.3594 4.3129 4.3151 4.6307 4.6370 5.1195 5.1333 5.5198 5.5234 5.6288 5.6340 5.7963 5.7999 9.0964 9.1657 9.4819 9.4890 9.7859 9.8333 10.1086 10.1220 10.1959 10.2074 10.4013 10.4514 10.6606 10.6961 10.7507 10.7784 11.5619 11.6344 11.6747 11.6908 15.4876 15.5019 18.5952 18.5986 k = 0.3947 0.2279-0.0000 ( 3805 PWs) bands (ev): -80.9608 -80.9608 -80.9590 -80.9590 -46.6600 -46.6583 -46.6553 -46.6547 -44.9484 -44.9481 -44.9468 -44.9467 -44.9073 -44.9055 -44.8980 -44.8973 -8.6111 -8.6085 -8.3652 -8.3581 4.3066 4.3090 4.6129 4.6190 5.1354 5.1484 5.5236 5.5270 5.6354 5.6403 5.8027 5.8061 9.1112 9.1806 9.4742 9.4833 9.8013 9.8478 10.0917 10.1102 10.1884 10.2065 10.3825 10.4256 10.6352 10.6747 10.7250 10.7485 11.5484 11.6171 11.6573 11.6730 15.6161 15.6305 18.5791 18.5832 k = 0.4035 0.2330-0.0000 ( 3805 PWs) bands (ev): -80.9608 -80.9608 -80.9590 -80.9590 -46.6600 -46.6584 -46.6554 -46.6549 -44.9486 -44.9483 -44.9471 -44.9470 -44.9071 -44.9055 -44.8981 -44.8975 -8.6000 -8.5975 -8.3639 -8.3571 4.3015 4.3039 4.5954 4.6014 5.1506 5.1627 5.5271 5.5303 5.6416 5.6462 5.8088 5.8120 9.1285 9.1979 9.4670 9.4780 9.8163 9.8616 10.0757 10.0963 10.1846 10.2063 10.3557 10.3941 10.6187 10.6552 10.7022 10.7260 11.5356 11.6000 11.6410 11.6564 15.7446 15.7591 18.5107 18.5113 k = 0.4123 0.2380-0.0000 ( 3817 PWs) bands (ev): -80.9611 -80.9611 -80.9594 -80.9594 -46.6601 -46.6587 -46.6556 -46.6551 -44.9488 -44.9485 -44.9474 -44.9473 -44.9071 -44.9056 -44.8984 -44.8978 -8.5896 -8.5871 -8.3628 -8.3564 4.2975 4.2999 4.5783 4.5841 5.1648 5.1759 5.5303 5.5333 5.6474 5.6516 5.8144 5.8173 9.1466 9.2158 9.4590 9.4718 9.8308 9.8748 10.0604 10.0813 10.1822 10.2058 10.3217 10.3569 10.6075 10.6364 10.6808 10.7073 11.5231 11.5827 11.6255 11.6405 15.8730 15.8874 18.4002 18.4045 k = 0.4211 0.2431-0.0000 ( 3821 PWs) bands (ev): -80.9610 -80.9610 -80.9596 -80.9596 -46.6602 -46.6588 -46.6558 -46.6553 -44.9490 -44.9487 -44.9476 -44.9475 -44.9070 -44.9056 -44.8985 -44.8979 -8.5799 -8.5774 -8.3620 -8.3560 4.2946 4.2971 4.5620 4.5676 5.1780 5.1882 5.5333 5.5360 5.6527 5.6566 5.8196 5.8222 9.1674 9.2360 9.4529 9.4674 9.8441 9.8866 10.0462 10.0664 10.1800 10.2046 10.2855 10.3178 10.6027 10.6190 10.6620 10.6951 11.5120 11.5663 11.6115 11.6261 16.0013 16.0157 18.2811 18.2873 k = 0.4298 0.2482-0.0000 ( 3829 PWs) bands (ev): -80.9614 -80.9614 -80.9596 -80.9596 -46.6601 -46.6589 -46.6560 -46.6556 -44.9491 -44.9488 -44.9479 -44.9478 -44.9068 -44.9055 -44.8987 -44.8982 -8.5710 -8.5686 -8.3613 -8.3558 4.2927 4.2951 4.5466 4.5519 5.1901 5.1992 5.5358 5.5382 5.6575 5.6610 5.8242 5.8266 9.1897 9.2571 9.4478 9.4637 9.8570 9.8976 10.0325 10.0510 10.1747 10.2007 10.2508 10.2789 10.6000 10.6017 10.6451 10.6865 11.5016 11.5505 11.5987 11.6127 16.1294 16.1438 18.1595 18.1670 k = 0.4386 0.2532-0.0000 ( 3817 PWs) bands (ev): -80.9611 -80.9611 -80.9592 -80.9592 -46.6599 -46.6589 -46.6560 -46.6557 -44.9491 -44.9488 -44.9480 -44.9479 -44.9066 -44.9055 -44.8988 -44.8983 -8.5628 -8.5606 -8.3608 -8.3558 4.2918 4.2942 4.5323 4.5372 5.2011 5.2092 5.5383 5.5404 5.6620 5.6651 5.8285 5.8306 9.2140 9.2795 9.4438 9.4610 9.8705 9.9089 10.0226 10.0390 10.1634 10.1915 10.2254 10.2473 10.5875 10.5974 10.6345 10.6813 11.4935 11.5366 11.5886 11.6017 16.2574 16.2716 18.0372 18.0456 k = 0.4474 0.2583-0.0000 ( 3813 PWs) bands (ev): -80.9610 -80.9610 -80.9590 -80.9590 -46.6598 -46.6590 -46.6561 -46.6558 -44.9491 -44.9489 -44.9481 -44.9481 -44.9064 -44.9054 -44.8988 -44.8984 -8.5556 -8.5535 -8.3604 -8.3560 4.2915 4.2938 4.5193 4.5238 5.2107 5.2177 5.5403 5.5422 5.6659 5.6686 5.8323 5.8341 9.2384 9.3011 9.4408 9.4589 9.8813 9.9172 10.0127 10.0264 10.1410 10.1689 10.2132 10.2298 10.5750 10.5907 10.6304 10.6769 11.4864 11.5235 11.5797 11.5916 16.3848 16.3989 17.9141 17.9233 k = 0.4561 0.2634-0.0000 ( 3809 PWs) bands (ev): -80.9608 -80.9608 -80.9589 -80.9589 -46.6598 -46.6591 -46.6560 -46.6558 -44.9492 -44.9490 -44.9482 -44.9482 -44.9062 -44.9054 -44.8988 -44.8985 -8.5492 -8.5475 -8.3601 -8.3563 4.2919 4.2940 4.5078 4.5117 5.2190 5.2249 5.5422 5.5437 5.6692 5.6715 5.8356 5.8371 9.2624 9.3208 9.4391 9.4575 9.8902 9.9231 10.0049 10.0152 10.1145 10.1379 10.2094 10.2233 10.5646 10.5812 10.6316 10.6732 11.4805 11.5116 11.5722 11.5827 16.5117 16.5256 17.7911 17.8009 k = 0.4649 0.2684-0.0000 ( 3815 PWs) bands (ev): -80.9609 -80.9609 -80.9592 -80.9592 -46.6598 -46.6592 -46.6562 -46.6560 -44.9493 -44.9492 -44.9484 -44.9483 -44.9061 -44.9055 -44.8989 -44.8986 -8.5439 -8.5424 -8.3599 -8.3568 4.2926 4.2944 4.4979 4.5012 5.2259 5.2306 5.5436 5.5449 5.6720 5.6739 5.8382 5.8394 9.2850 9.3374 9.4380 9.4558 9.8963 9.9251 9.9977 10.0045 10.0896 10.1076 10.2085 10.2199 10.5555 10.5705 10.6343 10.6687 11.4758 11.5008 11.5661 11.5748 16.6376 16.6512 17.6682 17.6785 k = 0.4737 0.2735-0.0000 ( 3815 PWs) bands (ev): -80.9608 -80.9608 -80.9592 -80.9592 -46.6597 -46.6593 -46.6562 -46.6560 -44.9493 -44.9492 -44.9484 -44.9484 -44.9060 -44.9055 -44.8989 -44.8987 -8.5397 -8.5385 -8.3596 -8.3572 4.2936 4.2950 4.4901 4.4927 5.2314 5.2350 5.5448 5.5458 5.6743 5.6757 5.8404 5.8413 9.3064 9.3494 9.4393 9.4546 9.9007 9.9244 9.9925 9.9957 10.0707 10.0823 10.2091 10.2180 10.5492 10.5612 10.6387 10.6650 11.4729 11.4917 11.5617 11.5685 16.7621 16.7753 17.5462 17.5569 k = 0.4825 0.2785-0.0000 ( 3814 PWs) bands (ev): -80.9608 -80.9608 -80.9591 -80.9591 -46.6596 -46.6593 -46.6562 -46.6561 -44.9493 -44.9492 -44.9485 -44.9485 -44.9059 -44.9055 -44.8990 -44.8988 -8.5365 -8.5357 -8.3594 -8.3578 4.2946 4.2956 4.4843 4.4861 5.2356 5.2380 5.5458 5.5464 5.6760 5.6769 5.8420 5.8426 9.3244 9.3554 9.4417 9.4533 9.9038 9.9210 9.9887 9.9896 10.0583 10.0646 10.2111 10.2171 10.5457 10.5541 10.6431 10.6608 11.4717 11.4843 11.5590 11.5636 16.8835 16.8960 17.4269 17.4378 k = 0.4912 0.2836-0.0000 ( 3806 PWs) bands (ev): -80.9607 -80.9607 -80.9587 -80.9587 -46.6594 -46.6593 -46.6562 -46.6561 -44.9492 -44.9492 -44.9485 -44.9485 -44.9057 -44.9055 -44.8990 -44.8989 -8.5345 -8.5341 -8.3591 -8.3582 4.2954 4.2959 4.4812 4.4821 5.2384 5.2396 5.5464 5.5467 5.6771 5.6775 5.8430 5.8433 9.3402 9.3567 9.4459 9.4524 9.9071 9.9163 9.9857 9.9860 10.0519 10.0541 10.2128 10.2159 10.5445 10.5488 10.6482 10.6572 11.4730 11.4793 11.5586 11.5610 16.9959 17.0062 17.3177 17.3272 k = 0.5000 0.2887-0.0000 ( 3814 PWs) bands (ev): -80.9607 -80.9607 -80.9593 -80.9593 -46.6595 -46.6595 -46.6562 -46.6562 -44.9493 -44.9493 -44.9485 -44.9485 -44.9057 -44.9057 -44.8989 -44.8989 -8.5337 -8.5337 -8.3587 -8.3587 4.2959 4.2959 4.4804 4.4804 5.2398 5.2398 5.5466 5.5466 5.6776 5.6776 5.8434 5.8434 9.3505 9.3505 9.4493 9.4493 9.9099 9.9099 9.9850 9.9850 10.0498 10.0498 10.2130 10.2130 10.5446 10.5446 10.6527 10.6527 11.4746 11.4746 11.5585 11.5585 17.0623 17.0623 17.2616 17.2616 k = 0.5000 0.2887-0.0000 ( 3814 PWs) bands (ev): -80.9607 -80.9607 -80.9593 -80.9593 -46.6595 -46.6595 -46.6562 -46.6562 -44.9493 -44.9493 -44.9485 -44.9485 -44.9057 -44.9057 -44.8989 -44.8989 -8.5337 -8.5337 -8.3587 -8.3587 4.2959 4.2959 4.4804 4.4804 5.2398 5.2398 5.5466 5.5466 5.6776 5.6776 5.8434 5.8434 9.3505 9.3505 9.4493 9.4493 9.9099 9.9099 9.9850 9.9850 10.0498 10.0498 10.2130 10.2130 10.5446 10.5446 10.6527 10.6527 11.4746 11.4746 11.5585 11.5585 17.0623 17.0623 17.2616 17.2616 k = 0.4949 0.2974-0.0000 ( 3800 PWs) bands (ev): -80.9607 -80.9607 -80.9584 -80.9584 -46.6593 -46.6592 -46.6562 -46.6561 -44.9492 -44.9491 -44.9485 -44.9485 -44.9056 -44.9055 -44.8989 -44.8989 -8.5336 -8.5335 -8.3588 -8.3586 4.2966 4.2968 4.4810 4.4811 5.2398 5.2402 5.5459 5.5460 5.6773 5.6778 5.8424 5.8432 9.3481 9.3543 9.4476 9.4522 9.9075 9.9138 9.9845 9.9855 10.0478 10.0497 10.2103 10.2192 10.5413 10.5504 10.6541 10.6567 11.4579 11.4910 11.5424 11.5748 17.0649 17.0651 17.2639 17.2640 k = 0.4899 0.3062-0.0000 ( 3804 PWs) bands (ev): -80.9606 -80.9606 -80.9587 -80.9587 -46.6595 -46.6593 -46.6562 -46.6561 -44.9493 -44.9492 -44.9485 -44.9484 -44.9057 -44.9055 -44.8989 -44.8989 -8.5332 -8.5329 -8.3589 -8.3584 4.2990 4.2994 4.4827 4.4831 5.2400 5.2409 5.5437 5.5439 5.6770 5.6780 5.8399 5.8415 9.3450 9.3573 9.4444 9.4537 9.9013 9.9140 9.9834 9.9856 10.0413 10.0450 10.2066 10.2232 10.5370 10.5549 10.6571 10.6622 11.4392 11.5022 11.5267 11.5885 17.0727 17.0732 17.2705 17.2705 k = 0.4848 0.3149-0.0000 ( 3808 PWs) bands (ev): -80.9607 -80.9607 -80.9589 -80.9589 -46.6596 -46.6593 -46.6562 -46.6562 -44.9495 -44.9493 -44.9486 -44.9484 -44.9057 -44.9054 -44.8990 -44.8989 -8.5324 -8.5320 -8.3590 -8.3583 4.3030 4.3036 4.4858 4.4863 5.2405 5.2418 5.5400 5.5402 5.6765 5.6780 5.8361 5.8385 9.3424 9.3609 9.4408 9.4549 9.8925 9.9117 9.9808 9.9854 10.0317 10.0375 10.2046 10.2276 10.5342 10.5600 10.6623 10.6701 11.4191 11.4965 11.5251 11.6006 17.0857 17.0866 17.2811 17.2812 k = 0.4798 0.3237-0.0000 ( 3806 PWs) bands (ev): -80.9606 -80.9606 -80.9589 -80.9589 -46.6597 -46.6592 -46.6562 -46.6561 -44.9495 -44.9493 -44.9485 -44.9483 -44.9058 -44.9054 -44.8990 -44.8989 -8.5312 -8.5307 -8.3591 -8.3582 4.3087 4.3095 4.4902 4.4909 5.2414 5.2432 5.5348 5.5350 5.6759 5.6779 5.8310 5.8342 9.3402 9.3646 9.4367 9.4557 9.8813 9.9066 9.9783 9.9858 10.0214 10.0296 10.2039 10.2319 10.5325 10.5655 10.6706 10.6812 11.3980 11.4774 11.5343 11.6112 17.1039 17.1051 17.2962 17.2963 k = 0.4747 0.3324-0.0000 ( 3802 PWs) bands (ev): -80.9602 -80.9602 -80.9590 -80.9590 -46.6597 -46.6592 -46.6562 -46.6561 -44.9496 -44.9494 -44.9484 -44.9482 -44.9058 -44.9053 -44.8990 -44.8989 -8.5298 -8.5291 -8.3593 -8.3581 4.3160 4.3170 4.4959 4.4967 5.2426 5.2448 5.5283 5.5286 5.6754 5.6779 5.8246 5.8285 9.3381 9.3685 9.4323 9.4565 9.8665 9.8972 9.9737 9.9868 10.0105 10.0239 10.2045 10.2357 10.5315 10.5706 10.6811 10.6945 11.3763 11.4558 11.5439 11.6203 17.1274 17.1288 17.3154 17.3156 k = 0.4697 0.3412-0.0000 ( 3794 PWs) bands (ev): -80.9600 -80.9600 -80.9587 -80.9587 -46.6597 -46.6591 -46.6561 -46.6560 -44.9497 -44.9494 -44.9484 -44.9482 -44.9058 -44.9052 -44.8990 -44.8988 -8.5280 -8.5272 -8.3594 -8.3580 4.3249 4.3261 4.5028 4.5037 5.2441 5.2467 5.5205 5.5209 5.6746 5.6776 5.8168 5.8215 9.3364 9.3725 9.4273 9.4568 9.8482 9.8832 9.9675 9.9860 10.0028 10.0223 10.2063 10.2399 10.5318 10.5765 10.6928 10.7088 11.3542 11.4333 11.5519 11.6273 17.1558 17.1575 17.3388 17.3391 k = 0.4646 0.3499-0.0000 ( 3790 PWs) bands (ev): -80.9599 -80.9599 -80.9586 -80.9586 -46.6597 -46.6590 -46.6561 -46.6560 -44.9497 -44.9494 -44.9483 -44.9481 -44.9058 -44.9051 -44.8991 -44.8989 -8.5259 -8.5249 -8.3596 -8.3579 4.3354 4.3368 4.5109 4.5120 5.2459 5.2489 5.5113 5.5117 5.6737 5.6771 5.8078 5.8132 9.3348 9.3764 9.4215 9.4567 9.8254 9.8636 9.9588 9.9786 10.0027 10.0248 10.2084 10.2430 10.5331 10.5824 10.7056 10.7239 11.3314 11.4097 11.5578 11.6318 17.1889 17.1909 17.3656 17.3660 k = 0.4596 0.3587-0.0000 ( 3798 PWs) bands (ev): -80.9600 -80.9600 -80.9590 -80.9590 -46.6599 -46.6590 -46.6562 -46.6561 -44.9499 -44.9496 -44.9483 -44.9481 -44.9060 -44.9051 -44.8992 -44.8989 -8.5235 -8.5224 -8.3597 -8.3579 4.3473 4.3490 4.5201 4.5214 5.2480 5.2514 5.5008 5.5012 5.6725 5.6764 5.7973 5.8035 9.3326 9.3796 9.4139 9.4552 9.7981 9.8391 9.9484 9.9662 10.0076 10.0300 10.2102 10.2449 10.5340 10.5873 10.7188 10.7394 11.3075 11.3847 11.5610 11.6334 17.2267 17.2290 17.3957 17.3963 k = 0.4545 0.3674-0.0000 ( 3794 PWs) bands (ev): -80.9598 -80.9598 -80.9590 -80.9590 -46.6600 -46.6590 -46.6562 -46.6561 -44.9500 -44.9496 -44.9482 -44.9480 -44.9060 -44.9051 -44.8993 -44.8990 -8.5207 -8.5195 -8.3599 -8.3579 4.3608 4.3627 4.5306 4.5320 5.2503 5.2541 5.4891 5.4896 5.6712 5.6756 5.7858 5.7927 9.3311 9.3831 9.4063 9.4541 9.7692 9.8128 9.9375 9.9531 10.0165 10.0391 10.2135 10.2475 10.5363 10.5931 10.7329 10.7556 11.2838 11.3596 11.5631 11.6336 17.2690 17.2716 17.4293 17.4301 k = 0.4495 0.3762-0.0000 ( 3790 PWs) bands (ev): -80.9598 -80.9598 -80.9587 -80.9587 -46.6600 -46.6589 -46.6563 -46.6561 -44.9500 -44.9497 -44.9482 -44.9480 -44.9060 -44.9050 -44.8994 -44.8991 -8.5177 -8.5163 -8.3602 -8.3579 4.3758 4.3778 4.5422 4.5437 5.2528 5.2570 5.4762 5.4768 5.6697 5.6747 5.7730 5.7806 9.3294 9.3863 9.3984 9.4530 9.7384 9.7848 9.9255 9.9393 10.0268 10.0499 10.2174 10.2503 10.5393 10.5994 10.7475 10.7719 11.2596 11.3338 11.5633 11.6317 17.3156 17.3185 17.4661 17.4672 k = 0.4444 0.3849-0.0000 ( 3788 PWs) bands (ev): -80.9597 -80.9597 -80.9586 -80.9586 -46.6600 -46.6588 -46.6563 -46.6562 -44.9501 -44.9498 -44.9481 -44.9479 -44.9059 -44.9048 -44.8995 -44.8991 -8.5144 -8.5129 -8.3604 -8.3580 4.3921 4.3943 4.5549 4.5565 5.2554 5.2601 5.4623 5.4629 5.6681 5.6735 5.7591 5.7674 9.3275 9.3889 9.3892 9.4510 9.7058 9.7557 9.9125 9.9246 10.0390 10.0624 10.2221 10.2532 10.5424 10.6053 10.7622 10.7882 11.2353 11.3077 11.5614 11.6275 17.3663 17.3696 17.5055 17.5069 k = 0.4394 0.3936-0.0000 ( 3788 PWs) bands (ev): -80.9597 -80.9597 -80.9586 -80.9586 -46.6600 -46.6588 -46.6564 -46.6562 -44.9502 -44.9499 -44.9481 -44.9479 -44.9060 -44.9048 -44.8996 -44.8993 -8.5108 -8.5091 -8.3608 -8.3581 4.4097 4.4121 4.5686 4.5704 5.2582 5.2632 5.4473 5.4479 5.6662 5.6720 5.7441 5.7531 9.3251 9.3795 9.3910 9.4488 9.6730 9.7266 9.8987 9.9092 10.0530 10.0761 10.2268 10.2546 10.5467 10.6116 10.7769 10.8045 11.2107 11.2809 11.5571 11.6207 17.4209 17.4245 17.5474 17.5491 k = 0.4343 0.4024-0.0000 ( 3788 PWs) bands (ev): -80.9598 -80.9598 -80.9585 -80.9585 -46.6601 -46.6587 -46.6565 -46.6563 -44.9503 -44.9500 -44.9481 -44.9479 -44.9060 -44.9047 -44.8997 -44.8994 -8.5070 -8.5052 -8.3612 -8.3584 4.4286 4.4312 4.5833 4.5852 5.2610 5.2664 5.4315 5.4321 5.6641 5.6704 5.7280 5.7377 9.3219 9.3691 9.3919 9.4459 9.6400 9.6978 9.8838 9.8928 10.0692 10.0910 10.2328 10.2571 10.5499 10.6170 10.7912 10.8203 11.1862 11.2542 11.5515 11.6124 17.4791 17.4831 17.5914 17.5935 k = 0.4293 0.4111-0.0000 ( 3786 PWs) bands (ev): -80.9599 -80.9599 -80.9584 -80.9584 -46.6601 -46.6586 -46.6565 -46.6563 -44.9504 -44.9501 -44.9481 -44.9479 -44.9059 -44.9045 -44.8999 -44.8995 -8.5030 -8.5009 -8.3617 -8.3587 4.4487 4.4515 4.5990 4.6010 5.2637 5.2695 5.4149 5.4155 5.6619 5.6687 5.7112 5.7214 9.3174 9.3593 9.3917 9.4429 9.6081 9.6700 9.8679 9.8756 10.0869 10.1066 10.2400 10.2597 10.5534 10.6223 10.8057 10.8363 11.1623 11.2277 11.5443 11.6022 17.5407 17.5451 17.6372 17.6398 k = 0.4242 0.4199-0.0000 ( 3792 PWs) bands (ev): -80.9599 -80.9599 -80.9586 -80.9586 -46.6602 -46.6587 -46.6566 -46.6564 -44.9506 -44.9503 -44.9481 -44.9480 -44.9059 -44.9045 -44.9000 -44.8996 -8.4987 -8.4965 -8.3622 -8.3591 4.4698 4.4729 4.6156 4.6177 5.2663 5.2725 5.3975 5.3981 5.6592 5.6666 5.6936 5.7044 9.3099 9.3503 9.3891 9.4392 9.5773 9.6427 9.8515 9.8579 10.1052 10.1216 10.2484 10.2618 10.5569 10.6267 10.8199 10.8520 11.1381 11.2005 11.5345 11.5890 17.6055 17.6104 17.6844 17.6875 k = 0.4192 0.4286-0.0000 ( 3790 PWs) bands (ev): -80.9599 -80.9599 -80.9585 -80.9585 -46.6603 -46.6586 -46.6567 -46.6565 -44.9507 -44.9504 -44.9481 -44.9480 -44.9059 -44.9044 -44.9001 -44.8997 -8.4942 -8.4919 -8.3629 -8.3596 4.4920 4.4953 4.6330 4.6352 5.2687 5.2752 5.3795 5.3801 5.6562 5.6643 5.6757 5.6868 9.2992 9.3439 9.3834 9.4359 9.5507 9.6182 9.8345 9.8398 10.1266 10.1377 10.2590 10.2641 10.5609 10.6313 10.8341 10.8677 11.1149 11.1741 11.5232 11.5743 17.6729 17.6785 17.7331 17.7370 k = 0.4141 0.4374-0.0000 ( 3798 PWs) bands (ev): -80.9599 -80.9599 -80.9590 -80.9590 -46.6604 -46.6587 -46.6568 -46.6566 -44.9509 -44.9506 -44.9481 -44.9480 -44.9060 -44.9044 -44.9003 -44.8998 -8.4895 -8.4870 -8.3637 -8.3602 4.5151 4.5186 4.6512 4.6534 5.2705 5.2774 5.3609 5.3615 5.6512 5.6590 5.6616 5.6690 9.2849 9.3393 9.3730 9.4328 9.5280 9.5952 9.8165 9.8207 10.1486 10.1519 10.2645 10.2708 10.5643 10.6343 10.8474 10.8827 11.0919 11.1474 11.5096 11.5569 17.7427 17.7494 17.7828 17.7879 k = 0.4091 0.4461-0.0000 ( 3794 PWs) bands (ev): -80.9595 -80.9595 -80.9592 -80.9592 -46.6605 -46.6587 -46.6567 -46.6566 -44.9509 -44.9507 -44.9481 -44.9480 -44.9059 -44.9043 -44.9004 -44.8999 -8.4847 -8.4820 -8.3646 -8.3610 4.5391 4.5428 4.6701 4.6724 5.2717 5.2790 5.3419 5.3426 5.6366 5.6502 5.6518 5.6595 9.2688 9.3368 9.3584 9.4313 9.5110 9.5753 9.7982 9.8013 10.1665 10.1728 10.2673 10.2866 10.5689 10.6384 10.8608 10.8980 11.0701 11.1216 11.4947 11.5378 17.8134 17.8227 17.8337 17.8416 k = 0.4040 0.4549-0.0000 ( 3794 PWs) bands (ev): -80.9597 -80.9597 -80.9590 -80.9590 -46.6605 -46.6586 -46.6569 -46.6567 -44.9511 -44.9508 -44.9481 -44.9481 -44.9058 -44.9041 -44.9006 -44.9000 -8.4797 -8.4768 -8.3657 -8.3619 4.5637 4.5676 4.6897 4.6920 5.2720 5.2796 5.3225 5.3232 5.6186 5.6324 5.6478 5.6563 9.2514 9.3350 9.3395 9.4300 9.4977 9.5564 9.7794 9.7815 10.1795 10.1982 10.2704 10.3047 10.5729 10.6418 10.8736 10.9131 11.0485 11.0955 11.4784 11.5171 17.8795 17.8849 17.8982 17.9023 k = 0.3990 0.4636-0.0000 ( 3790 PWs) bands (ev): -80.9595 -80.9595 -80.9589 -80.9589 -46.6605 -46.6586 -46.6569 -46.6567 -44.9511 -44.9509 -44.9481 -44.9480 -44.9058 -44.9040 -44.9007 -44.9001 -8.4746 -8.4715 -8.3669 -8.3630 4.5890 4.5931 4.7097 4.7121 5.2708 5.2788 5.3031 5.3039 5.6009 5.6151 5.6441 5.6531 9.2342 9.3188 9.3338 9.4293 9.4882 9.5395 9.7607 9.7619 10.1914 10.2253 10.2728 10.3257 10.5769 10.6445 10.8859 10.9280 11.0282 11.0701 11.4614 11.4954 17.9366 17.9368 17.9747 17.9756 k = 0.3939 0.4724-0.0000 ( 3798 PWs) bands (ev): -80.9598 -80.9598 -80.9592 -80.9592 -46.6607 -46.6586 -46.6571 -46.6569 -44.9513 -44.9510 -44.9482 -44.9481 -44.9058 -44.9039 -44.9009 -44.9003 -8.4694 -8.4661 -8.3683 -8.3643 4.6147 4.6189 4.7301 4.7325 5.2673 5.2756 5.2843 5.2850 5.5843 5.5988 5.6400 5.6494 9.2160 9.2958 9.3324 9.4282 9.4811 9.5237 9.7415 9.7418 10.2015 10.2524 10.2748 10.3482 10.5802 10.6460 10.8959 10.9412 11.0093 11.0450 11.4416 11.4705 17.9886 17.9902 18.0522 18.0547 k = 0.3889 0.4811-0.0000 ( 3810 PWs) bands (ev): -80.9601 -80.9601 -80.9596 -80.9596 -46.6608 -46.6587 -46.6572 -46.6571 -44.9515 -44.9512 -44.9483 -44.9482 -44.9058 -44.9039 -44.9011 -44.9005 -8.4641 -8.4606 -8.3699 -8.3658 4.6406 4.6450 4.7508 4.7532 5.2580 5.2618 5.2700 5.2741 5.5691 5.5839 5.6356 5.6455 9.1983 9.2724 9.3309 9.4267 9.4761 9.5089 9.7214 9.7221 10.2099 10.2756 10.2802 10.3720 10.5835 10.6470 10.9025 10.9514 10.9938 11.0229 11.4209 11.4442 18.0402 18.0427 18.1320 18.1353 k = 0.3838 0.4899-0.0000 ( 3806 PWs) bands (ev): -80.9600 -80.9600 -80.9595 -80.9595 -46.6608 -46.6586 -46.6573 -46.6571 -44.9515 -44.9513 -44.9483 -44.9482 -44.9057 -44.9037 -44.9013 -44.9006 -8.4587 -8.4550 -8.3716 -8.3675 4.6668 4.6713 4.7718 4.7741 5.2410 5.2427 5.2605 5.2672 5.5562 5.5712 5.6310 5.6413 9.1823 9.2503 9.3304 9.4259 9.4736 9.4965 9.7029 9.7044 10.2186 10.2777 10.3101 10.3991 10.5875 10.6482 10.9036 10.9533 10.9863 11.0112 11.4002 11.4176 18.0919 18.0950 18.2135 18.2172 k = 0.3788 0.4986-0.0000 ( 3810 PWs) bands (ev): -80.9601 -80.9601 -80.9596 -80.9596 -46.6609 -46.6586 -46.6574 -46.6572 -44.9516 -44.9514 -44.9483 -44.9483 -44.9057 -44.9036 -44.9014 -44.9008 -8.4533 -8.4494 -8.3736 -8.3694 4.6928 4.6975 4.7927 4.7950 5.2221 5.2234 5.2506 5.2580 5.5457 5.5610 5.6260 5.6367 9.1675 9.2294 9.3295 9.4248 9.4720 9.4851 9.6835 9.6860 10.2263 10.2793 10.3407 10.4273 10.5907 10.6482 10.8955 10.9395 10.9868 11.0139 11.3782 11.3893 18.1432 18.1467 18.2961 18.3001 k = 0.3737 0.5074-0.0000 ( 3810 PWs) bands (ev): -80.9601 -80.9601 -80.9596 -80.9596 -46.6609 -46.6586 -46.6575 -46.6573 -44.9517 -44.9515 -44.9483 -44.9483 -44.9056 -44.9035 -44.9016 -44.9010 -8.4479 -8.4437 -8.3758 -8.3716 4.7186 4.7233 4.8135 4.8157 5.2033 5.2046 5.2386 5.2463 5.5380 5.5534 5.6207 5.6318 9.1545 9.2101 9.3290 9.4238 9.4720 9.4751 9.6653 9.6686 10.2337 10.2807 10.3719 10.4566 10.5946 10.6484 10.8811 10.9171 10.9944 11.0256 11.3560 11.3603 18.1939 18.1978 18.3796 18.3837 k = 0.3687 0.5161-0.0000 ( 3802 PWs) bands (ev): -80.9597 -80.9597 -80.9596 -80.9596 -46.6609 -46.6585 -46.6574 -46.6573 -44.9517 -44.9515 -44.9483 -44.9483 -44.9055 -44.9033 -44.9017 -44.9010 -8.4425 -8.4380 -8.3783 -8.3741 4.7439 4.7486 4.8339 4.8360 5.1851 5.1866 5.2243 5.2322 5.5332 5.5487 5.6153 5.6268 9.1436 9.1928 9.3289 9.4230 9.4666 9.4733 9.6490 9.6531 10.2408 10.2820 10.4038 10.4869 10.5990 10.6486 10.8635 10.8921 11.0061 11.0406 11.3320 11.3349 18.2439 18.2480 18.4637 18.4680 k = 0.3636 0.5249-0.0000 ( 3792 PWs) bands (ev): -80.9593 -80.9593 -80.9593 -80.9593 -46.6608 -46.6584 -46.6574 -46.6573 -44.9516 -44.9515 -44.9482 -44.9482 -44.9054 -44.9032 -44.9018 -44.9012 -8.4371 -8.4324 -8.3810 -8.3768 4.7682 4.7729 4.8536 4.8554 5.1678 5.1696 5.2081 5.2161 5.5312 5.5466 5.6093 5.6212 9.1350 9.1780 9.3289 9.4229 9.4597 9.4756 9.6335 9.6382 10.2481 10.2834 10.4364 10.5179 10.6046 10.6493 10.8440 10.8660 11.0201 11.0568 11.3019 11.3126 18.2930 18.2972 18.5483 18.5526 k = 0.3586 0.5336-0.0000 ( 3796 PWs) bands (ev): -80.9596 -80.9596 -80.9593 -80.9593 -46.6608 -46.6584 -46.6575 -46.6574 -44.9517 -44.9516 -44.9483 -44.9483 -44.9054 -44.9030 -44.9019 -44.9013 -8.4318 -8.4268 -8.3839 -8.3798 4.7913 4.7958 4.8720 4.8736 5.1517 5.1541 5.1907 5.1985 5.5317 5.5471 5.6028 5.6151 9.1276 9.1637 9.3276 9.4224 9.4526 9.4770 9.6188 9.6242 10.2545 10.2844 10.4672 10.5472 10.6084 10.6485 10.8219 10.8376 11.0353 11.0738 11.2714 11.2906 18.3401 18.3443 18.6330 18.6374 k = 0.3535 0.5424-0.0000 ( 3788 PWs) bands (ev): -80.9593 -80.9593 -80.9591 -80.9591 -46.6608 -46.6583 -46.6575 -46.6574 -44.9517 -44.9516 -44.9482 -44.9482 -44.9053 -44.9028 -44.9020 -44.9014 -8.4266 -8.4212 -8.3871 -8.3832 4.8125 4.8166 4.8888 4.8902 5.1377 5.1408 5.1732 5.1804 5.5344 5.5497 5.5961 5.6088 9.1232 9.1525 9.3269 9.4230 9.4473 9.4792 9.6065 9.6121 10.2603 10.2843 10.4987 10.5760 10.6141 10.6496 10.8003 10.8104 11.0519 11.0912 11.2421 11.2701 18.3853 18.3894 18.7179 18.7222 k = 0.3485 0.5511-0.0000 ( 3786 PWs) bands (ev): -80.9592 -80.9592 -80.9591 -80.9591 -46.6608 -46.6582 -46.6575 -46.6574 -44.9517 -44.9517 -44.9482 -44.9482 -44.9052 -44.9026 -44.9021 -44.9016 -8.4217 -8.4157 -8.3905 -8.3868 4.8310 4.8346 4.9031 4.9041 5.1260 5.1301 5.1566 5.1629 5.5390 5.5540 5.5890 5.6020 9.1210 9.1433 9.3257 9.4241 9.4424 9.4806 9.5962 9.6016 10.2655 10.2835 10.5283 10.5990 10.6196 10.6537 10.7779 10.7829 11.0687 11.1081 11.2131 11.2509 18.4272 18.4310 18.7824 18.7827 k = 0.3434 0.5599-0.0000 ( 3782 PWs) bands (ev): -80.9591 -80.9591 -80.9589 -80.9589 -46.6608 -46.6582 -46.6575 -46.6574 -44.9517 -44.9517 -44.9482 -44.9482 -44.9051 -44.9025 -44.9022 -44.9017 -8.4170 -8.4104 -8.3940 -8.3908 4.8459 4.8486 4.9141 4.9148 5.1173 5.1229 5.1429 5.1475 5.5449 5.5598 5.5816 5.5949 9.1210 9.1359 9.3247 9.4261 9.4384 9.4814 9.5890 9.5934 10.2702 10.2824 10.5559 10.6105 10.6259 10.6674 10.7562 10.7571 11.0857 11.1241 11.1855 11.2340 18.4639 18.4670 18.7842 18.7843 k = 0.3384 0.5686-0.0000 ( 3782 PWs) bands (ev): -80.9591 -80.9591 -80.9590 -80.9590 -46.6608 -46.6582 -46.6575 -46.6575 -44.9517 -44.9517 -44.9482 -44.9482 -44.9051 -44.9023 -44.9022 -44.9018 -8.4132 -8.4052 -8.3971 -8.3951 4.8560 4.8575 4.9210 4.9213 5.1119 5.1194 5.1338 5.1359 5.5514 5.5661 5.5743 5.5879 9.1224 9.1299 9.3238 9.4286 9.4347 9.4815 9.5850 9.5877 10.2742 10.2803 10.5793 10.6085 10.6321 10.6892 10.7339 10.7364 11.1016 11.1374 11.1606 11.2215 18.4916 18.4936 18.7851 18.7852 k = 0.3333 0.5774-0.0000 ( 3786 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6608 -46.6582 -46.6575 -46.6575 -44.9517 -44.9517 -44.9482 -44.9482 -44.9052 -44.9023 -44.9023 -44.9019 -8.4115 -8.4013 -8.3987 -8.3987 4.8601 4.8601 4.9232 4.9232 5.1101 5.1187 5.1310 5.1310 5.5554 5.5701 5.5701 5.5837 9.1255 9.1255 9.3229 9.4310 9.4310 9.4808 9.5847 9.5847 10.2776 10.2776 10.5972 10.5972 10.6350 10.7060 10.7224 10.7224 11.1102 11.1451 11.1451 11.2163 18.5039 18.5039 18.7853 18.7853 k = 0.3333 0.5774-0.0000 ( 3786 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6608 -46.6582 -46.6575 -46.6575 -44.9517 -44.9517 -44.9482 -44.9482 -44.9052 -44.9023 -44.9023 -44.9019 -8.4115 -8.4013 -8.3987 -8.3987 4.8601 4.8601 4.9232 4.9232 5.1101 5.1187 5.1310 5.1310 5.5554 5.5701 5.5701 5.5837 9.1255 9.1255 9.3229 9.4310 9.4310 9.4808 9.5847 9.5847 10.2776 10.2776 10.5972 10.5972 10.6350 10.7060 10.7224 10.7224 11.1102 11.1451 11.1451 11.2163 18.5039 18.5039 18.7853 18.7853 k = 0.3283 0.5686-0.0000 ( 3784 PWs) bands (ev): -80.9592 -80.9592 -80.9590 -80.9590 -46.6608 -46.6582 -46.6575 -46.6575 -44.9517 -44.9517 -44.9482 -44.9482 -44.9051 -44.9023 -44.9023 -44.9019 -8.4133 -8.4053 -8.3973 -8.3949 4.8558 4.8575 4.9212 4.9213 5.1121 5.1196 5.1345 5.1346 5.5508 5.5656 5.5749 5.5884 9.1223 9.1298 9.3237 9.4286 9.4340 9.4818 9.5847 9.5879 10.2742 10.2803 10.5786 10.6084 10.6311 10.6971 10.7205 10.7425 11.1008 11.1467 11.1520 11.2214 18.4872 18.4902 18.7850 18.7850 k = 0.3232 0.5599-0.0000 ( 3788 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6608 -46.6582 -46.6576 -46.6574 -44.9518 -44.9517 -44.9483 -44.9483 -44.9052 -44.9025 -44.9023 -44.9017 -8.4175 -8.4107 -8.3940 -8.3902 4.8453 4.8486 4.9157 4.9158 5.1183 5.1239 5.1433 5.1438 5.5419 5.5569 5.5839 5.5971 9.1200 9.1345 9.3251 9.4265 9.4349 9.4853 9.5875 9.5941 10.2699 10.2821 10.5531 10.6021 10.6292 10.6888 10.7292 10.7649 11.0851 11.1437 11.1688 11.2338 18.4345 18.4408 18.7838 18.7838 k = 0.3182 0.5511-0.0000 ( 3790 PWs) bands (ev): -80.9593 -80.9593 -80.9592 -80.9592 -46.6608 -46.6583 -46.6576 -46.6574 -44.9517 -44.9517 -44.9483 -44.9482 -44.9053 -44.9026 -44.9022 -44.9015 -8.4228 -8.4166 -8.3902 -8.3857 4.8296 4.8342 4.9077 4.9078 5.1283 5.1322 5.1553 5.1565 5.5318 5.5469 5.5942 5.6070 9.1188 9.1396 9.3278 9.4258 9.4336 9.4932 9.5932 9.6030 10.2650 10.2833 10.5229 10.5786 10.6361 10.6847 10.7421 10.7845 11.0727 11.1412 11.1881 11.2505 18.3487 18.3574 18.7818 18.7820 k = 0.3131 0.5424-0.0000 ( 3789 PWs) bands (ev): -80.9594 -80.9594 -80.9591 -80.9591 -46.6608 -46.6583 -46.6575 -46.6573 -44.9517 -44.9516 -44.9482 -44.9482 -44.9053 -44.9028 -44.9021 -44.9013 -8.4288 -8.4229 -8.3864 -8.3814 4.8103 4.8158 4.8983 4.8983 5.1410 5.1438 5.1695 5.1711 5.5207 5.5362 5.6051 5.6174 9.1182 9.1444 9.3318 9.4276 9.4305 9.5063 9.6021 9.6144 10.2596 10.2838 10.4900 10.5501 10.6446 10.6842 10.7540 10.8000 11.0657 11.1420 11.2082 11.2693 18.2400 18.2502 18.7795 18.7797 k = 0.3081 0.5336-0.0000 ( 3797 PWs) bands (ev): -80.9595 -80.9595 -80.9595 -80.9595 -46.6609 -46.6584 -46.6576 -46.6573 -44.9517 -44.9516 -44.9482 -44.9482 -44.9055 -44.9030 -44.9021 -44.9012 -8.4353 -8.4296 -8.3828 -8.3773 4.7885 4.7947 4.8878 4.8881 5.1556 5.1576 5.1850 5.1869 5.5090 5.5247 5.6162 5.6280 9.1176 9.1477 9.3357 9.4262 9.4323 9.5223 9.6129 9.6273 10.2523 10.2829 10.4546 10.5188 10.6520 10.6845 10.7618 10.8104 11.0653 11.1473 11.2287 11.2887 18.1175 18.1286 18.7762 18.7766 k = 0.3030 0.5249-0.0000 ( 3803 PWs) bands (ev): -80.9597 -80.9597 -80.9596 -80.9596 -46.6609 -46.6584 -46.6576 -46.6572 -44.9517 -44.9516 -44.9483 -44.9482 -44.9056 -44.9031 -44.9020 -44.9010 -8.4422 -8.4368 -8.3793 -8.3735 4.7653 4.7719 4.8770 4.8774 5.1712 5.1727 5.2011 5.2033 5.4967 5.5125 5.6276 5.6387 9.1177 9.1504 9.3393 9.4217 9.4418 9.5426 9.6252 9.6409 10.2449 10.2817 10.4181 10.4862 10.6590 10.6864 10.7649 10.8158 11.0722 11.1579 11.2500 11.3093 17.9869 17.9987 18.7723 18.7728 k = 0.2980 0.5161-0.0000 ( 3801 PWs) bands (ev): -80.9597 -80.9597 -80.9595 -80.9595 -46.6609 -46.6584 -46.6575 -46.6571 -44.9516 -44.9515 -44.9482 -44.9482 -44.9057 -44.9032 -44.9018 -44.9008 -8.4497 -8.4444 -8.3760 -8.3700 4.7414 4.7483 4.8663 4.8669 5.1873 5.1886 5.2175 5.2200 5.4838 5.4998 5.6390 5.6494 9.1180 9.1519 9.3421 9.4177 9.4576 9.5667 9.6413 9.6578 10.2368 10.2798 10.3817 10.4536 10.6666 10.6908 10.7640 10.8167 11.0866 11.1743 11.2717 11.3304 17.8513 17.8635 18.7681 18.7686 k = 0.2929 0.5074-0.0000 ( 3793 PWs) bands (ev): -80.9595 -80.9595 -80.9592 -80.9592 -46.6608 -46.6584 -46.6574 -46.6569 -44.9515 -44.9513 -44.9481 -44.9481 -44.9057 -44.9033 -44.9016 -44.9006 -8.4576 -8.4524 -8.3730 -8.3667 4.7174 4.7244 4.8558 4.8567 5.2035 5.2049 5.2338 5.2365 5.4703 5.4865 5.6503 5.6600 9.1188 9.1527 9.3432 9.4139 9.4799 9.5949 9.6598 9.6767 10.2283 10.2777 10.3450 10.4211 10.6741 10.6973 10.7603 10.8136 11.1066 11.1953 11.2943 11.3523 17.7124 17.7249 18.7633 18.7639 k = 0.2879 0.4986-0.0000 ( 3789 PWs) bands (ev): -80.9595 -80.9595 -80.9590 -80.9590 -46.6607 -46.6583 -46.6573 -46.6568 -44.9513 -44.9512 -44.9480 -44.9479 -44.9058 -44.9034 -44.9014 -44.9004 -8.4659 -8.4609 -8.3703 -8.3637 4.6937 4.7007 4.8458 4.8469 5.2195 5.2209 5.2496 5.2527 5.4564 5.4725 5.6613 5.6703 9.1194 9.1524 9.3431 9.4106 9.5074 9.6260 9.6805 9.6973 10.2176 10.2738 10.3085 10.3892 10.6792 10.7047 10.7556 10.8069 11.1309 11.2200 11.3165 11.3738 17.5710 17.5837 18.7578 18.7584 k = 0.2828 0.4899-0.0000 ( 3789 PWs) bands (ev): -80.9596 -80.9596 -80.9589 -80.9589 -46.6607 -46.6583 -46.6572 -46.6566 -44.9512 -44.9511 -44.9479 -44.9479 -44.9060 -44.9036 -44.9012 -44.9002 -8.4747 -8.4698 -8.3679 -8.3611 4.6706 4.6775 4.8362 4.8375 5.2352 5.2368 5.2649 5.2683 5.4419 5.4580 5.6720 5.6802 9.1197 9.1511 9.3419 9.4078 9.5389 9.6592 9.7028 9.7194 10.2055 10.2696 10.2718 10.3578 10.6803 10.7124 10.7532 10.7983 11.1574 11.2467 11.3392 11.3956 17.4279 17.4409 18.7512 18.7519 k = 0.2778 0.4811-0.0000 ( 3787 PWs) bands (ev): -80.9596 -80.9596 -80.9588 -80.9588 -46.6607 -46.6583 -46.6571 -46.6565 -44.9511 -44.9509 -44.9478 -44.9477 -44.9061 -44.9037 -44.9010 -44.9000 -8.4839 -8.4792 -8.3658 -8.3588 4.6483 4.6551 4.8273 4.8289 5.2504 5.2523 5.2793 5.2833 5.4271 5.4431 5.6823 5.6896 9.1201 9.1494 9.3404 9.4056 9.5742 9.6943 9.7277 9.7444 10.1914 10.2354 10.2653 10.3288 10.6766 10.7208 10.7548 10.7886 11.1864 11.2758 11.3621 11.4176 17.2838 17.2969 18.7440 18.7447 k = 0.2727 0.4724-0.0000 ( 3789 PWs) bands (ev): -80.9597 -80.9597 -80.9588 -80.9588 -46.6607 -46.6583 -46.6570 -46.6564 -44.9509 -44.9507 -44.9477 -44.9477 -44.9063 -44.9039 -44.9008 -44.8998 -8.4936 -8.4890 -8.3640 -8.3568 4.6271 4.6337 4.8191 4.8209 5.2649 5.2672 5.2926 5.2973 5.4122 5.4277 5.6920 5.6984 9.1204 9.1473 9.3386 9.4040 9.6121 9.7298 9.7541 9.7721 10.1749 10.2001 10.2603 10.3026 10.6683 10.7287 10.7605 10.7787 11.2162 11.3057 11.3849 11.4392 17.1387 17.1519 18.7361 18.7368 k = 0.2677 0.4636-0.0000 ( 3799 PWs) bands (ev): -80.9602 -80.9602 -80.9590 -80.9590 -46.6607 -46.6583 -46.6570 -46.6563 -44.9509 -44.9506 -44.9477 -44.9476 -44.9065 -44.9041 -44.9006 -44.8996 -8.5037 -8.4992 -8.3625 -8.3551 4.6071 4.6135 4.8115 4.8136 5.2787 5.2814 5.3041 5.3100 5.3977 5.4123 5.7010 5.7066 9.1202 9.1447 9.3366 9.4029 9.6513 9.7634 9.7824 9.8040 10.1546 10.1649 10.2543 10.2791 10.6567 10.7345 10.7696 10.7712 11.2457 11.3355 11.4077 11.4606 16.9929 17.0062 18.7274 18.7281 k = 0.2626 0.4549-0.0000 ( 3805 PWs) bands (ev): -80.9606 -80.9606 -80.9590 -80.9590 -46.6607 -46.6583 -46.6569 -46.6563 -44.9507 -44.9505 -44.9476 -44.9476 -44.9066 -44.9042 -44.9005 -44.8995 -8.5142 -8.5099 -8.3614 -8.3538 4.5884 4.5946 4.8048 4.8071 5.2918 5.2950 5.3128 5.3207 5.3849 5.3976 5.7094 5.7140 9.1201 9.1420 9.3350 9.4026 9.6925 9.7949 9.8131 9.8419 10.1315 10.1326 10.2485 10.2598 10.6435 10.7335 10.7716 10.7814 11.2759 11.3663 11.4301 11.4815 16.8469 16.8602 18.7182 18.7189 k = 0.2576 0.4461-0.0000 ( 3805 PWs) bands (ev): -80.9606 -80.9606 -80.9590 -80.9590 -46.6607 -46.6583 -46.6568 -46.6561 -44.9505 -44.9503 -44.9475 -44.9474 -44.9068 -44.9043 -44.9002 -44.8992 -8.5251 -8.5209 -8.3607 -8.3529 4.5712 4.5772 4.7988 4.8014 5.3038 5.3081 5.3166 5.3277 5.3761 5.3853 5.7172 5.7209 9.1208 9.1402 9.3335 9.4029 9.7344 9.8241 9.8465 9.8848 10.1010 10.1097 10.2426 10.2445 10.6291 10.7248 10.7803 10.7948 11.3070 11.3981 11.4538 11.5034 16.7009 16.7142 18.7085 18.7093 k = 0.2525 0.4374-0.0000 ( 3801 PWs) bands (ev): -80.9606 -80.9606 -80.9588 -80.9588 -46.6606 -46.6582 -46.6566 -46.6559 -44.9503 -44.9501 -44.9473 -44.9472 -44.9068 -44.9044 -44.9000 -44.8990 -8.5365 -8.5324 -8.3602 -8.3523 4.5556 4.5613 4.7937 4.7965 5.3091 5.3187 5.3204 5.3277 5.3739 5.3789 5.7242 5.7271 9.1218 9.1387 9.3330 9.4045 9.7754 9.8515 9.8824 9.9304 10.0739 10.0877 10.2323 10.2368 10.6148 10.7135 10.7933 10.8097 11.3382 11.4302 11.4779 11.5255 16.5550 16.5682 18.6986 18.6993 k = 0.2475 0.4286-0.0000 ( 3799 PWs) bands (ev): -80.9607 -80.9607 -80.9587 -80.9587 -46.6605 -46.6582 -46.6564 -46.6557 -44.9501 -44.9499 -44.9471 -44.9471 -44.9070 -44.9045 -44.8997 -44.8988 -8.5482 -8.5443 -8.3601 -8.3521 4.5417 4.5470 4.7893 4.7923 5.2990 5.3188 5.3285 5.3320 5.3774 5.3801 5.7303 5.7323 9.1231 9.1378 9.3323 9.4061 9.8134 9.8766 9.9200 9.9758 10.0523 10.0701 10.2223 10.2305 10.5999 10.7007 10.8080 10.8256 11.3696 11.4630 11.5016 11.5469 16.4092 16.4224 18.6882 18.6889 k = 0.2424 0.4199-0.0000 ( 3803 PWs) bands (ev): -80.9608 -80.9608 -80.9589 -80.9589 -46.6606 -46.6582 -46.6562 -46.6556 -44.9499 -44.9496 -44.9470 -44.9469 -44.9072 -44.9047 -44.8995 -44.8986 -8.5603 -8.5566 -8.3604 -8.3522 4.5295 4.5345 4.7853 4.7886 5.2840 5.3044 5.3386 5.3429 5.3835 5.3856 5.7356 5.7368 9.1246 9.1371 9.3309 9.4075 9.8461 9.8975 9.9557 10.0108 10.0418 10.0682 10.2140 10.2238 10.5838 10.6865 10.8247 10.8430 11.3999 11.4948 11.5256 11.5681 16.2636 16.2767 18.6770 18.6776 k = 0.2374 0.4111-0.0000 ( 3799 PWs) bands (ev): -80.9606 -80.9606 -80.9589 -80.9589 -46.6605 -46.6582 -46.6560 -46.6553 -44.9496 -44.9494 -44.9467 -44.9466 -44.9073 -44.9049 -44.8992 -44.8983 -8.5728 -8.5693 -8.3610 -8.3527 4.5190 4.5238 4.7819 4.7854 5.2670 5.2875 5.3482 5.3530 5.3905 5.3925 5.7402 5.7405 9.1266 9.1369 9.3305 9.4100 9.8695 9.9101 9.9814 10.0229 10.0558 10.1002 10.2095 10.2180 10.5687 10.6731 10.8431 10.8619 11.4300 11.5267 11.5501 11.5896 16.1185 16.1315 18.6656 18.6662 k = 0.2323 0.4024-0.0000 ( 3807 PWs) bands (ev): -80.9608 -80.9608 -80.9592 -80.9592 -46.6606 -46.6582 -46.6558 -46.6552 -44.9494 -44.9492 -44.9465 -44.9465 -44.9076 -44.9051 -44.8990 -44.8981 -8.5857 -8.5823 -8.3620 -8.3535 4.5104 4.5149 4.7789 4.7826 5.2491 5.2697 5.3571 5.3624 5.3974 5.3995 5.7432 5.7437 9.1285 9.1369 9.3298 9.4125 9.8775 9.9096 10.0000 10.0326 10.0934 10.1425 10.2094 10.2105 10.5531 10.6594 10.8617 10.8810 11.4591 11.5579 11.5744 11.6104 15.9738 15.9866 18.6536 18.6543 k = 0.2273 0.3936-0.0000 ( 3807 PWs) bands (ev): -80.9609 -80.9609 -80.9592 -80.9592 -46.6605 -46.6581 -46.6556 -46.6549 -44.9492 -44.9489 -44.9463 -44.9462 -44.9077 -44.9052 -44.8987 -44.8979 -8.5989 -8.5956 -8.3633 -8.3547 4.5037 4.5078 4.7762 4.7801 5.2310 5.2515 5.3653 5.3711 5.4039 5.4062 5.7451 5.7463 9.1314 9.1379 9.3298 9.4157 9.8726 9.8993 10.0246 10.0503 10.1418 10.1726 10.2048 10.2291 10.5383 10.6464 10.8826 10.9024 11.4876 11.5890 11.5990 11.6313 15.8297 15.8424 18.6414 18.6420 k = 0.2222 0.3849-0.0000 ( 3799 PWs) bands (ev): -80.9608 -80.9608 -80.9588 -80.9588 -46.6603 -46.6580 -46.6553 -46.6547 -44.9489 -44.9486 -44.9460 -44.9460 -44.9078 -44.9053 -44.8984 -44.8976 -8.6124 -8.6093 -8.3649 -8.3562 4.4989 4.5027 4.7735 4.7777 5.2130 5.2334 5.3728 5.3791 5.4098 5.4123 5.7462 5.7481 9.1351 9.1399 9.3307 9.4199 9.8608 9.8841 10.0552 10.0720 10.1841 10.1937 10.2010 10.2729 10.5245 10.6345 10.9060 10.9264 11.5158 11.6200 11.6243 11.6524 15.6865 15.6990 18.6293 18.6298 k = 0.2172 0.3762-0.0000 ( 3797 PWs) bands (ev): -80.9607 -80.9607 -80.9589 -80.9589 -46.6603 -46.6579 -46.6550 -46.6544 -44.9486 -44.9483 -44.9458 -44.9457 -44.9079 -44.9054 -44.8981 -44.8973 -8.6263 -8.6233 -8.3668 -8.3581 4.4960 4.4996 4.7706 4.7751 5.1955 5.2158 5.3797 5.3864 5.4150 5.4175 5.7464 5.7490 9.1391 9.1424 9.3313 9.4239 9.8459 9.8667 10.0883 10.0922 10.1931 10.1960 10.2487 10.3242 10.5107 10.6228 10.9300 10.9510 11.5428 11.6494 11.6499 11.6731 15.5440 15.5564 18.6165 18.6170 k = 0.2121 0.3674-0.0000 ( 3797 PWs) bands (ev): -80.9607 -80.9607 -80.9589 -80.9589 -46.6602 -46.6579 -46.6548 -46.6542 -44.9483 -44.9480 -44.9455 -44.9454 -44.9080 -44.9055 -44.8979 -44.8971 -8.6404 -8.6375 -8.3691 -8.3603 4.4950 4.4983 4.7673 4.7721 5.1789 5.1990 5.3858 5.3930 5.4194 5.4221 5.7458 5.7490 9.1436 9.1455 9.3321 9.4280 9.8310 9.8498 10.1072 10.1219 10.1921 10.2073 10.3032 10.3767 10.4973 10.6116 10.9555 10.9773 11.5690 11.6745 11.6796 11.6931 15.4024 15.4145 18.6034 18.6039 k = 0.2071 0.3587-0.0000 ( 3803 PWs) bands (ev): -80.9610 -80.9610 -80.9591 -80.9591 -46.6602 -46.6579 -46.6546 -46.6540 -44.9481 -44.9478 -44.9453 -44.9452 -44.9082 -44.9057 -44.8976 -44.8969 -8.6547 -8.6520 -8.3717 -8.3628 4.4960 4.4990 4.7633 4.7684 5.1634 5.1833 5.3910 5.3986 5.4230 5.4258 5.7443 5.7481 9.1484 9.1491 9.3330 9.4321 9.8164 9.8334 10.1154 10.1523 10.1913 10.2280 10.3572 10.4290 10.4846 10.6015 10.9821 11.0050 11.5937 11.6989 11.7084 11.7121 15.2617 15.2736 18.5898 18.5903 k = 0.2020 0.3499-0.0000 ( 3807 PWs) bands (ev): -80.9612 -80.9612 -80.9591 -80.9591 -46.6602 -46.6578 -46.6544 -46.6538 -44.9478 -44.9475 -44.9450 -44.9449 -44.9083 -44.9058 -44.8974 -44.8967 -8.6693 -8.6668 -8.3746 -8.3656 4.4989 4.5015 4.7582 4.7636 5.1495 5.1691 5.3957 5.4037 5.4258 5.4287 5.7420 5.7464 9.1534 9.1540 9.3346 9.4367 9.8032 9.8186 10.1187 10.1684 10.2046 10.2533 10.4112 10.4724 10.4817 10.5925 11.0106 11.0348 11.6178 11.7239 11.7297 11.7381 15.1219 15.1336 18.5763 18.5766 k = 0.1970 0.3412-0.0000 ( 3807 PWs) bands (ev): -80.9611 -80.9611 -80.9594 -80.9594 -46.6601 -46.6578 -46.6541 -46.6535 -44.9475 -44.9472 -44.9446 -44.9445 -44.9085 -44.9060 -44.8971 -44.8964 -8.6841 -8.6817 -8.3777 -8.3687 4.5037 4.5061 4.7517 4.7575 5.1376 5.1568 5.3998 5.4081 5.4280 5.4309 5.7389 5.7439 9.1585 9.1600 9.3364 9.4414 9.7918 9.8057 10.1192 10.1686 10.2341 10.2817 10.4629 10.4633 10.5322 10.5867 11.0407 11.0662 11.6415 11.7486 11.7495 11.7668 14.9835 14.9949 18.5626 18.5628 k = 0.1919 0.3324-0.0000 ( 3805 PWs) bands (ev): -80.9610 -80.9610 -80.9594 -80.9594 -46.6600 -46.6577 -46.6538 -46.6532 -44.9472 -44.9469 -44.9443 -44.9442 -44.9086 -44.9061 -44.8968 -44.8962 -8.6991 -8.6968 -8.3811 -8.3721 4.5104 4.5125 4.7436 4.7498 5.1279 5.1467 5.4032 5.4119 5.4294 5.4323 5.7352 5.7406 9.1644 9.1669 9.3392 9.4469 9.7816 9.7945 10.1185 10.1657 10.2656 10.3087 10.4576 10.5099 10.5813 10.5864 11.0730 11.1001 11.6647 11.7672 11.7752 11.7952 14.8464 14.8575 18.5488 18.5490 k = 0.1869 0.3237-0.0000 ( 3805 PWs) bands (ev): -80.9610 -80.9610 -80.9595 -80.9595 -46.6600 -46.6577 -46.6535 -46.6530 -44.9469 -44.9466 -44.9439 -44.9439 -44.9088 -44.9063 -44.8965 -44.8959 -8.7142 -8.7121 -8.3848 -8.3758 4.5190 4.5209 4.7336 4.7403 5.1207 5.1391 5.4059 5.4150 5.4301 5.4330 5.7307 5.7366 9.1717 9.1750 9.3420 9.4520 9.7722 9.7843 10.1170 10.1622 10.2956 10.3311 10.4578 10.5437 10.6000 10.6286 11.1079 11.1368 11.6867 11.7853 11.8004 11.8225 14.7105 14.7213 18.5347 18.5347 k = 0.1818 0.3149-0.0000 ( 3805 PWs) bands (ev): -80.9611 -80.9611 -80.9594 -80.9594 -46.6598 -46.6575 -46.6532 -46.6527 -44.9465 -44.9462 -44.9436 -44.9435 -44.9089 -44.9064 -44.8963 -44.8957 -8.7294 -8.7275 -8.3887 -8.3797 4.5295 4.5311 4.7215 4.7287 5.1163 5.1341 5.4079 5.4174 5.4301 5.4329 5.7256 5.7318 9.1790 9.1830 9.3460 9.4581 9.7643 9.7758 10.1151 10.1587 10.3226 10.3452 10.4688 10.5592 10.6347 10.6735 11.1440 11.1748 11.7076 11.8023 11.8253 11.8491 14.5761 14.5866 18.5204 18.5205 k = 0.1768 0.3062-0.0000 ( 3809 PWs) bands (ev): -80.9613 -80.9613 -80.9596 -80.9596 -46.6598 -46.6575 -46.6530 -46.6525 -44.9462 -44.9459 -44.9432 -44.9432 -44.9090 -44.9066 -44.8961 -44.8955 -8.7448 -8.7430 -8.3929 -8.3839 4.5418 4.5431 4.7074 4.7150 5.1145 5.1318 5.4094 5.4191 5.4294 5.4322 5.7197 5.7263 9.1875 9.1921 9.3500 9.4637 9.7576 9.7689 10.1121 10.1544 10.3449 10.3488 10.4905 10.5696 10.6760 10.7152 11.1821 11.2148 11.7281 11.8194 11.8500 11.8751 14.4431 14.4533 18.5060 18.5062 k = 0.1717 0.2974-0.0000 ( 3805 PWs) bands (ev): -80.9613 -80.9613 -80.9593 -80.9593 -46.6596 -46.6573 -46.6527 -46.6523 -44.9458 -44.9455 -44.9429 -44.9428 -44.9091 -44.9067 -44.8958 -44.8953 -8.7602 -8.7585 -8.3972 -8.3883 4.5558 4.5569 4.6912 4.6992 5.1155 5.1322 5.4102 5.4203 5.4282 5.4309 5.7135 5.7204 9.1971 9.2022 9.3553 9.4703 9.7522 9.7637 10.1100 10.1512 10.3458 10.3610 10.5201 10.5847 10.7191 10.7562 11.2227 11.2571 11.7481 11.8361 11.8745 11.9006 14.3119 14.3217 18.4915 18.4918 k = 0.1667 0.2887-0.0000 ( 3805 PWs) bands (ev): -80.9614 -80.9614 -80.9593 -80.9593 -46.6595 -46.6573 -46.6524 -46.6520 -44.9455 -44.9452 -44.9425 -44.9425 -44.9092 -44.9068 -44.8956 -44.8951 -8.7756 -8.7740 -8.4017 -8.3928 4.5715 4.5724 4.6731 4.6816 5.1190 5.1351 5.4104 5.4207 5.4264 5.4290 5.7067 5.7138 9.2071 9.2125 9.3610 9.4768 9.7479 9.7601 10.1078 10.1480 10.3390 10.3709 10.5537 10.6049 10.7612 10.7954 11.2635 11.2995 11.7674 11.8521 11.8985 11.9254 14.1825 14.1919 18.4765 18.4770 k = 0.1616 0.2799-0.0000 ( 3801 PWs) bands (ev): -80.9614 -80.9614 -80.9591 -80.9591 -46.6593 -46.6571 -46.6521 -46.6517 -44.9451 -44.9448 -44.9421 -44.9421 -44.9093 -44.9068 -44.8953 -44.8949 -8.7910 -8.7896 -8.4064 -8.3976 4.5889 4.5896 4.6534 4.6623 5.1248 5.1404 5.4100 5.4204 5.4242 5.4268 5.6995 5.7068 9.2179 9.2237 9.3679 9.4840 9.7448 9.7582 10.1060 10.1454 10.3311 10.3760 10.5896 10.6306 10.8019 10.8329 11.3057 11.3430 11.7862 11.8677 11.9224 11.9497 14.0550 14.0640 18.4614 18.4621 k = 0.1566 0.2712-0.0000 ( 3803 PWs) bands (ev): -80.9615 -80.9615 -80.9592 -80.9592 -46.6592 -46.6570 -46.6518 -46.6515 -44.9448 -44.9445 -44.9418 -44.9417 -44.9094 -44.9070 -44.8951 -44.8947 -8.8064 -8.8051 -8.4112 -8.4025 4.6077 4.6083 4.6324 4.6415 5.1327 5.1478 5.4089 5.4192 5.4215 5.4243 5.6918 5.6993 9.2292 9.2351 9.3746 9.4904 9.7426 9.7577 10.1038 10.1425 10.3216 10.3763 10.6267 10.6600 10.8410 10.8687 11.3479 11.3863 11.8043 11.8828 11.9453 11.9728 13.9294 13.9381 18.4457 18.4467 k = 0.1515 0.2624-0.0000 ( 3803 PWs) bands (ev): -80.9616 -80.9616 -80.9592 -80.9592 -46.6591 -46.6569 -46.6516 -46.6513 -44.9444 -44.9442 -44.9414 -44.9414 -44.9095 -44.9071 -44.8948 -44.8945 -8.8217 -8.8205 -8.4162 -8.4075 4.6099 4.6193 4.6283 4.6286 5.1425 5.1570 5.4071 5.4169 5.4186 5.4220 5.6838 5.6915 9.2408 9.2468 9.3827 9.4977 9.7412 9.7585 10.1018 10.1399 10.3118 10.3737 10.6647 10.6928 10.8790 10.9036 11.3900 11.4290 11.8219 11.8972 11.9683 11.9960 13.8061 13.8143 18.4295 18.4308 k = 0.1465 0.2537-0.0000 ( 3811 PWs) bands (ev): -80.9619 -80.9619 -80.9595 -80.9595 -46.6590 -46.6569 -46.6514 -46.6511 -44.9441 -44.9439 -44.9411 -44.9411 -44.9096 -44.9072 -44.8946 -44.8943 -8.8370 -8.8358 -8.4212 -8.4127 4.5869 4.5964 4.6499 4.6500 5.1537 5.1678 5.4046 5.4134 5.4155 5.4197 5.6754 5.6832 9.2530 9.2591 9.3907 9.5045 9.7408 9.7608 10.0990 10.1367 10.3014 10.3687 10.7016 10.7259 10.9140 10.9355 11.4317 11.4710 11.8392 11.9112 11.9905 12.0180 13.6851 13.6928 18.4125 18.4142 k = 0.1414 0.2449-0.0000 ( 3819 PWs) bands (ev): -80.9622 -80.9622 -80.9598 -80.9598 -46.6590 -46.6569 -46.6511 -46.6509 -44.9439 -44.9437 -44.9407 -44.9407 -44.9097 -44.9074 -44.8945 -44.8941 -8.8520 -8.8510 -8.4264 -8.4180 4.5631 4.5727 4.6729 4.6730 5.1664 5.1800 5.4014 5.4092 5.4121 5.4172 5.6669 5.6747 9.2656 9.2717 9.3987 9.5106 9.7410 9.7643 10.0966 10.1341 10.2904 10.3619 10.7396 10.7611 10.9491 10.9678 11.4731 11.5121 11.8553 11.9238 12.0117 12.0390 13.5665 13.5738 18.3941 18.3963 k = 0.1364 0.2362-0.0000 ( 3825 PWs) bands (ev): -80.9625 -80.9625 -80.9599 -80.9599 -46.6589 -46.6568 -46.6509 -46.6507 -44.9436 -44.9434 -44.9404 -44.9404 -44.9098 -44.9075 -44.8943 -44.8940 -8.8670 -8.8660 -8.4316 -8.4233 4.5389 4.5485 4.6970 4.6973 5.1801 5.1933 5.3976 5.4046 5.4087 5.4145 5.6582 5.6660 9.2789 9.2849 9.4080 9.5174 9.7420 9.7691 10.0937 10.1311 10.2801 10.3547 10.7773 10.7969 10.9823 10.9984 11.5134 11.5517 11.8720 11.9370 12.0327 12.0596 13.4507 13.4575 18.3735 18.3760 k = 0.1313 0.2274-0.0000 ( 3817 PWs) bands (ev): -80.9623 -80.9623 -80.9597 -80.9597 -46.6587 -46.6567 -46.6506 -46.6504 -44.9432 -44.9430 -44.9400 -44.9399 -44.9099 -44.9076 -44.8940 -44.8938 -8.8817 -8.8808 -8.4368 -8.4287 4.5144 4.5240 4.7224 4.7228 5.1950 5.2077 5.3934 5.3996 5.4051 5.4115 5.6496 5.6574 9.2934 9.2992 9.4187 9.5251 9.7443 9.7757 10.0916 10.1290 10.2710 10.3478 10.8153 10.8336 11.0163 11.0300 11.5534 11.5904 11.8891 11.9501 12.0542 12.0806 13.3379 13.3441 18.3484 18.3509 k = 0.1263 0.2187-0.0000 ( 3821 PWs) bands (ev): -80.9624 -80.9624 -80.9599 -80.9599 -46.6586 -46.6566 -46.6503 -46.6502 -44.9429 -44.9427 -44.9396 -44.9396 -44.9100 -44.9077 -44.8938 -44.8936 -8.8961 -8.8954 -8.4420 -8.4341 4.4898 4.4994 4.7487 4.7491 5.2105 5.2229 5.3886 5.3943 5.4014 5.4082 5.6408 5.6485 9.3076 9.3133 9.4284 9.5313 9.7470 9.7832 10.0890 10.1266 10.2611 10.3396 10.8526 10.8699 11.0481 11.0597 11.5908 11.6259 11.9057 11.9626 12.0739 12.0997 13.2283 13.2339 18.3132 18.3139 k = 0.1212 0.2099-0.0000 ( 3821 PWs) bands (ev): -80.9625 -80.9625 -80.9599 -80.9599 -46.6585 -46.6566 -46.6501 -46.6499 -44.9426 -44.9424 -44.9392 -44.9392 -44.9100 -44.9078 -44.8936 -44.8934 -8.9103 -8.9097 -8.4473 -8.4396 4.4653 4.4747 4.7759 4.7764 5.2266 5.2386 5.3835 5.3888 5.3975 5.4045 5.6321 5.6396 9.3224 9.3278 9.4387 9.5375 9.7505 9.7921 10.0866 10.1246 10.2520 10.3317 10.8899 10.9065 11.0795 11.0891 11.6262 11.6589 11.9224 11.9747 12.0933 12.1183 13.1222 13.1272 18.2555 18.2600 k = 0.1162 0.2012-0.0000 ( 3821 PWs) bands (ev): -80.9625 -80.9625 -80.9599 -80.9599 -46.6584 -46.6565 -46.6498 -46.6497 -44.9422 -44.9421 -44.9388 -44.9388 -44.9101 -44.9079 -44.8934 -44.8932 -8.9242 -8.9237 -8.4525 -8.4450 4.4410 4.4502 4.8038 4.8045 5.2432 5.2549 5.3783 5.3831 5.3934 5.4005 5.6234 5.6308 9.3374 9.3425 9.4491 9.5434 9.7548 9.8020 10.0840 10.1227 10.2432 10.3237 10.9268 10.9428 11.1101 11.1179 11.6591 11.6888 11.9392 11.9866 12.1120 12.1361 13.0200 13.0243 18.1754 18.1859 k = 0.1111 0.1925-0.0000 ( 3833 PWs) bands (ev): -80.9629 -80.9629 -80.9604 -80.9604 -46.6583 -46.6565 -46.6497 -46.6495 -44.9420 -44.9419 -44.9385 -44.9385 -44.9102 -44.9081 -44.8932 -44.8931 -8.9378 -8.9373 -8.4577 -8.4504 4.4169 4.4260 4.8322 4.8330 5.2601 5.2713 5.3726 5.3771 5.3891 5.3961 5.6146 5.6218 9.3517 9.3564 9.4582 9.5477 9.7595 9.8126 10.0808 10.1204 10.2338 10.3146 10.9629 10.9783 11.1394 11.1457 11.6876 11.7140 11.9551 11.9976 12.1290 12.1521 12.9219 12.9257 18.0843 18.0985 k = 0.1061 0.1837-0.0000 ( 3829 PWs) bands (ev): -80.9627 -80.9627 -80.9604 -80.9604 -46.6582 -46.6564 -46.6493 -46.6492 -44.9417 -44.9416 -44.9381 -44.9381 -44.9102 -44.9082 -44.8930 -44.8929 -8.9510 -8.9506 -8.4628 -8.4557 4.3934 4.4022 4.8613 4.8621 5.2773 5.2882 5.3671 5.3713 5.3847 5.3916 5.6062 5.6132 9.3671 9.3714 9.4686 9.5530 9.7651 9.8244 10.0781 10.1186 10.2257 10.3066 11.0001 11.0151 11.1689 11.1738 11.7140 11.7367 11.9720 12.0093 12.1463 12.1685 12.8288 12.8319 17.9900 18.0060 k = 0.1010 0.1750-0.0000 ( 3829 PWs) bands (ev): -80.9629 -80.9629 -80.9602 -80.9602 -46.6580 -46.6563 -46.6492 -46.6490 -44.9414 -44.9413 -44.9378 -44.9378 -44.9102 -44.9083 -44.8929 -44.8927 -8.9638 -8.9635 -8.4678 -8.4610 4.3703 4.3789 4.8907 4.8916 5.2944 5.3049 5.3617 5.3655 5.3801 5.3869 5.5979 5.6047 9.3820 9.3859 9.4788 9.5578 9.7717 9.8373 10.0753 10.1171 10.2179 10.2986 11.0348 11.0494 11.1973 11.2010 11.7357 11.7548 11.9883 12.0205 12.1631 12.1842 12.7410 12.7435 17.8956 17.9125 k = 0.0960 0.1662-0.0000 ( 3837 PWs) bands (ev): -80.9631 -80.9631 -80.9606 -80.9606 -46.6580 -46.6564 -46.6490 -46.6489 -44.9412 -44.9411 -44.9375 -44.9375 -44.9103 -44.9084 -44.8927 -44.8926 -8.9763 -8.9759 -8.4727 -8.4662 4.3479 4.3562 4.9202 4.9212 5.3113 5.3216 5.3561 5.3595 5.3754 5.3820 5.5898 5.5963 9.3971 9.4006 9.4880 9.5615 9.7782 9.8501 10.0711 10.1143 10.2097 10.2900 11.0688 11.0830 11.2244 11.2269 11.7528 11.7685 12.0034 12.0310 12.1780 12.1981 12.6593 12.6613 17.8026 17.8197 k = 0.0909 0.1575-0.0000 ( 3831 PWs) bands (ev): -80.9628 -80.9628 -80.9606 -80.9606 -46.6579 -46.6563 -46.6486 -46.6486 -44.9409 -44.9408 -44.9371 -44.9371 -44.9103 -44.9085 -44.8925 -44.8924 -8.9882 -8.9879 -8.4775 -8.4712 4.3262 4.3341 4.9498 4.9508 5.3280 5.3381 5.3509 5.3538 5.3706 5.3770 5.5823 5.5885 9.4127 9.4158 9.4975 9.5656 9.7857 9.8639 10.0680 10.1128 10.2025 10.2820 11.1033 11.1170 11.2527 11.2542 11.7653 11.7782 12.0178 12.0415 12.1929 12.2120 12.5848 12.5864 17.7119 17.7290 k = 0.0859 0.1487-0.0000 ( 3827 PWs) bands (ev): -80.9628 -80.9628 -80.9605 -80.9605 -46.6577 -46.6562 -46.6484 -46.6483 -44.9406 -44.9405 -44.9368 -44.9367 -44.9103 -44.9085 -44.8923 -44.8922 -8.9997 -8.9994 -8.4821 -8.4761 4.3053 4.3129 4.9793 4.9803 5.3407 5.3475 5.3494 5.3550 5.3659 5.3720 5.5749 5.5808 9.4278 9.4304 9.5067 9.5692 9.7946 9.8791 10.0648 10.1114 10.1961 10.2747 11.1359 11.1491 11.2787 11.2793 11.7714 11.7822 12.0306 12.0515 12.2069 12.2250 12.5184 12.5200 17.6242 17.6409 k = 0.0808 0.1400-0.0000 ( 3831 PWs) bands (ev): -80.9631 -80.9631 -80.9605 -80.9605 -46.6575 -46.6561 -46.6483 -46.6482 -44.9404 -44.9403 -44.9365 -44.9365 -44.9103 -44.9086 -44.8922 -44.8921 -9.0106 -9.0104 -8.4866 -8.4808 4.2852 4.2925 5.0084 5.0095 5.3383 5.3421 5.3609 5.3628 5.3668 5.3707 5.5678 5.5733 9.4424 9.4446 9.5147 9.5718 9.8030 9.8934 10.0612 10.1099 10.1894 10.2667 11.1670 11.1797 11.3035 11.3037 11.7706 11.7801 12.0405 12.0600 12.2195 12.2366 12.4610 12.4631 17.5395 17.5558 k = 0.0758 0.1312-0.0000 ( 3835 PWs) bands (ev): -80.9633 -80.9633 -80.9606 -80.9606 -46.6574 -46.6561 -46.6481 -46.6481 -44.9401 -44.9401 -44.9363 -44.9363 -44.9103 -44.9087 -44.8921 -44.8920 -9.0211 -9.0209 -8.4908 -8.4854 4.2661 4.2730 5.0370 5.0380 5.3334 5.3367 5.3562 5.3617 5.3780 5.3858 5.5610 5.5662 9.4567 9.4584 9.5227 9.5746 9.8119 9.9078 10.0576 10.1085 10.1829 10.2587 11.1962 11.2084 11.3267 11.3277 11.7624 11.7714 12.0483 12.0677 12.2313 12.2477 12.4135 12.4170 17.4583 17.4740 k = 0.0707 0.1225-0.0000 ( 3839 PWs) bands (ev): -80.9631 -80.9631 -80.9610 -80.9610 -46.6574 -46.6561 -46.6479 -46.6479 -44.9400 -44.9400 -44.9360 -44.9359 -44.9104 -44.9089 -44.8919 -44.8919 -9.0309 -9.0308 -8.4949 -8.4898 4.2479 4.2544 5.0648 5.0658 5.3285 5.3314 5.3514 5.3566 5.3932 5.4007 5.5546 5.5594 9.4703 9.4716 9.5302 9.5772 9.8216 9.9225 10.0528 10.1056 10.1761 10.2506 11.2257 11.2371 11.3492 11.3508 11.7470 11.7562 12.0538 12.0742 12.2421 12.2579 12.3760 12.3814 17.3809 17.3959 k = 0.0657 0.1137-0.0000 ( 3839 PWs) bands (ev): -80.9632 -80.9632 -80.9610 -80.9610 -46.6573 -46.6561 -46.6477 -46.6477 -44.9398 -44.9397 -44.9357 -44.9357 -44.9104 -44.9089 -44.8918 -44.8917 -9.0402 -9.0402 -8.4987 -8.4939 4.2308 4.2369 5.0919 5.0929 5.3238 5.3264 5.3468 5.3516 5.4078 5.4148 5.5486 5.5531 9.4839 9.4848 9.5371 9.5794 9.8314 9.9366 10.0492 10.1044 10.1701 10.2426 11.2532 11.2639 11.3708 11.3731 11.7254 11.7347 12.0577 12.0800 12.2516 12.2668 12.3490 12.3571 17.3076 17.3219 k = 0.0606 0.1050-0.0000 ( 3835 PWs) bands (ev): -80.9632 -80.9632 -80.9608 -80.9608 -46.6571 -46.6560 -46.6476 -46.6475 -44.9395 -44.9395 -44.9355 -44.9354 -44.9103 -44.9090 -44.8916 -44.8916 -9.0489 -9.0489 -8.5023 -8.4979 4.2148 4.2205 5.1181 5.1191 5.3193 5.3217 5.3423 5.3468 5.4218 5.4283 5.5430 5.5472 9.4975 9.4980 9.5435 9.5815 9.8417 9.9507 10.0460 10.1034 10.1645 10.2348 11.2793 11.2890 11.3916 11.3943 11.6986 11.7079 12.0607 12.0849 12.2599 12.2745 12.3320 12.3428 17.2386 17.2520 k = 0.0556 0.0962-0.0000 ( 3839 PWs) bands (ev): -80.9634 -80.9634 -80.9609 -80.9609 -46.6570 -46.6560 -46.6475 -46.6475 -44.9393 -44.9393 -44.9353 -44.9353 -44.9104 -44.9091 -44.8915 -44.8915 -9.0570 -9.0570 -8.5057 -8.5016 4.1999 4.2052 5.1430 5.1440 5.3150 5.3172 5.3380 5.3421 5.4348 5.4409 5.5377 5.5415 9.5100 9.5101 9.5495 9.5832 9.8512 9.9631 10.0424 10.1022 10.1583 10.2258 11.3030 11.3119 11.4102 11.4133 11.6678 11.6769 12.0631 12.0887 12.2672 12.2804 12.3228 12.3354 17.1740 17.1866 k = 0.0505 0.0875-0.0000 ( 3829 PWs) bands (ev): -80.9630 -80.9630 -80.9607 -80.9607 -46.6568 -46.6559 -46.6472 -46.6472 -44.9391 -44.9391 -44.9350 -44.9350 -44.9103 -44.9092 -44.8914 -44.8913 -9.0645 -9.0644 -8.5088 -8.5050 4.1863 4.1911 5.1665 5.1674 5.3111 5.3131 5.3340 5.3378 5.4473 5.4528 5.5331 5.5365 9.5224 9.5226 9.5548 9.5847 9.8622 9.9750 10.0414 10.1021 10.1538 10.2186 11.3264 11.3344 11.4292 11.4327 11.6351 11.6438 12.0664 12.0928 12.2735 12.2845 12.3201 12.3331 17.1144 17.1260 k = 0.0455 0.0787-0.0000 ( 3825 PWs) bands (ev): -80.9629 -80.9629 -80.9607 -80.9607 -46.6567 -46.6559 -46.6470 -46.6470 -44.9389 -44.9389 -44.9347 -44.9347 -44.9103 -44.9092 -44.8912 -44.8912 -9.0713 -9.0712 -8.5116 -8.5082 4.1738 4.1781 5.1885 5.1893 5.3075 5.3092 5.3302 5.3336 5.4587 5.4637 5.5289 5.5319 9.5333 9.5338 9.5596 9.5860 9.8727 9.9839 10.0420 10.1018 10.1489 10.2104 11.3475 11.3545 11.4462 11.4498 11.6021 11.6102 12.0696 12.0958 12.2791 12.2873 12.3213 12.3336 17.0597 17.0703 k = 0.0404 0.0700-0.0000 ( 3825 PWs) bands (ev): -80.9628 -80.9628 -80.9608 -80.9608 -46.6567 -46.6559 -46.6469 -46.6469 -44.9388 -44.9388 -44.9345 -44.9345 -44.9103 -44.9093 -44.8911 -44.8911 -9.0774 -9.0774 -8.5141 -8.5111 4.1625 4.1664 5.2086 5.2094 5.3041 5.3057 5.3267 5.3298 5.4692 5.4736 5.5251 5.5278 9.5426 9.5434 9.5637 9.5867 9.8826 9.9893 10.0445 10.1016 10.1438 10.2016 11.3666 11.3727 11.4615 11.4650 11.5707 11.5779 12.0733 12.0986 12.2837 12.2894 12.3242 12.3353 17.0101 17.0197 k = 0.0354 0.0612-0.0000 ( 3823 PWs) bands (ev): -80.9627 -80.9627 -80.9608 -80.9608 -46.6566 -46.6559 -46.6468 -46.6468 -44.9387 -44.9386 -44.9344 -44.9344 -44.9102 -44.9094 -44.8911 -44.8910 -9.0828 -9.0828 -8.5164 -8.5137 4.1526 4.1560 5.2268 5.2275 5.3012 5.3025 5.3235 5.3262 5.4785 5.4824 5.5218 5.5241 9.5513 9.5523 9.5675 9.5874 9.8926 9.9913 10.0507 10.1028 10.1399 10.1929 11.3829 11.3882 11.4729 11.4757 11.5436 11.5495 12.0772 12.1009 12.2881 12.2918 12.3280 12.3379 16.9660 16.9745 k = 0.0303 0.0525-0.0000 ( 3819 PWs) bands (ev): -80.9627 -80.9627 -80.9606 -80.9606 -46.6564 -46.6558 -46.6467 -46.6467 -44.9385 -44.9385 -44.9342 -44.9342 -44.9101 -44.9094 -44.8910 -44.8910 -9.0875 -9.0875 -8.5183 -8.5160 4.1440 4.1469 5.2432 5.2438 5.2986 5.2998 5.3207 5.3230 5.4868 5.4901 5.5189 5.5209 9.5595 9.5607 9.5709 9.5879 9.9027 9.9900 10.0596 10.1032 10.1358 10.1844 11.3973 11.4018 11.4778 11.4782 11.5261 11.5290 12.0814 12.1027 12.2922 12.2946 12.3324 12.3409 16.9275 16.9348 k = 0.0253 0.0437-0.0000 ( 3819 PWs) bands (ev): -80.9627 -80.9627 -80.9606 -80.9606 -46.6563 -46.6558 -46.6466 -46.6466 -44.9384 -44.9384 -44.9341 -44.9341 -44.9101 -44.9095 -44.8909 -44.8909 -9.0916 -9.0916 -8.5199 -8.5180 4.1366 4.1391 5.2572 5.2578 5.2964 5.2974 5.3181 5.3201 5.4938 5.4965 5.5166 5.5181 9.5661 9.5674 9.5739 9.5881 9.9122 9.9864 10.0695 10.1037 10.1319 10.1754 11.4091 11.4130 11.4675 11.4702 11.5227 11.5231 12.0854 12.1040 12.2957 12.2970 12.3361 12.3434 16.8946 16.9008 k = 0.0202 0.0350-0.0000 ( 3815 PWs) bands (ev): -80.9627 -80.9627 -80.9604 -80.9604 -46.6562 -46.6558 -46.6465 -46.6465 -44.9383 -44.9383 -44.9340 -44.9340 -44.9100 -44.9096 -44.8909 -44.8909 -9.0949 -9.0949 -8.5212 -8.5197 4.1307 4.1327 5.2690 5.2696 5.2948 5.2955 5.3159 5.3176 5.4996 5.5017 5.5148 5.5159 9.5718 9.5732 9.5769 9.5883 9.9218 9.9818 10.0803 10.1047 10.1284 10.1666 11.4188 11.4224 11.4516 11.4554 11.5262 11.5278 12.0895 12.1048 12.2990 12.2995 12.3399 12.3457 16.8677 16.8727 k = 0.0152 0.0262-0.0000 ( 3811 PWs) bands (ev): -80.9626 -80.9626 -80.9603 -80.9603 -46.6561 -46.6558 -46.6465 -46.6465 -44.9382 -44.9382 -44.9339 -44.9339 -44.9099 -44.9096 -44.8908 -44.8908 -9.0975 -9.0974 -8.5222 -8.5210 4.1261 4.1276 5.2785 5.2790 5.2935 5.2940 5.3141 5.3154 5.5041 5.5055 5.5136 5.5143 9.5765 9.5778 9.5796 9.5883 9.9311 9.9764 10.0911 10.1065 10.1260 10.1577 11.4253 11.4294 11.4373 11.4418 11.5316 11.5332 12.0932 12.1050 12.3014 12.3016 12.3429 12.3473 16.8468 16.8506 k = 0.0101 0.0175-0.0000 ( 3803 PWs) bands (ev): -80.9624 -80.9624 -80.9600 -80.9600 -46.6559 -46.6557 -46.6463 -46.6463 -44.9381 -44.9381 -44.9338 -44.9338 -44.9098 -44.9096 -44.8907 -44.8907 -9.0993 -9.0993 -8.5228 -8.5220 4.1229 4.1239 5.2856 5.2859 5.2927 5.2930 5.3126 5.3136 5.5072 5.5079 5.5133 5.5134 9.5800 9.5808 9.5827 9.5883 9.9402 9.9705 10.1017 10.1084 10.1243 10.1491 11.4248 11.4258 11.4356 11.4371 11.5369 11.5380 12.0968 12.1048 12.3034 12.3035 12.3456 12.3486 16.8320 16.8346 k = 0.0051 0.0087-0.0000 ( 3795 PWs) bands (ev): -80.9620 -80.9620 -80.9599 -80.9599 -46.6558 -46.6557 -46.6462 -46.6462 -44.9380 -44.9380 -44.9337 -44.9337 -44.9098 -44.9096 -44.8907 -44.8907 -9.1004 -9.1004 -8.5231 -8.5227 4.1211 4.1216 5.2899 5.2901 5.2926 5.2926 5.3118 5.3123 5.5089 5.5090 5.5134 5.5136 9.5824 9.5826 9.5855 9.5880 9.9486 9.9638 10.1088 10.1100 10.1254 10.1399 11.4193 11.4194 11.4395 11.4396 11.5410 11.5416 12.1000 12.1040 12.3048 12.3048 12.3478 12.3493 16.8234 16.8246 k = 0.0000 0.0000 0.0000 ( 3791 PWs) bands (ev): -80.9618 -80.9618 -80.9599 -80.9599 -46.6558 -46.6558 -46.6462 -46.6462 -44.9380 -44.9380 -44.9336 -44.9336 -44.9097 -44.9097 -44.8906 -44.8906 -9.1008 -9.1008 -8.5231 -8.5231 4.1207 4.1207 5.2910 5.2910 5.2930 5.2930 5.3116 5.3116 5.5092 5.5092 5.5137 5.5137 9.5833 9.5833 9.5873 9.5873 9.9565 9.9565 10.1108 10.1108 10.1314 10.1314 11.4172 11.4172 11.4409 11.4409 11.5428 11.5428 12.1025 12.1025 12.3053 12.3053 12.3491 12.3491 16.8209 16.8209 k = 0.0000 0.0000 0.0000 ( 3791 PWs) bands (ev): -80.9618 -80.9618 -80.9599 -80.9599 -46.6558 -46.6558 -46.6462 -46.6462 -44.9380 -44.9380 -44.9336 -44.9336 -44.9097 -44.9097 -44.8906 -44.8906 -9.1008 -9.1008 -8.5231 -8.5231 4.1207 4.1207 5.2910 5.2910 5.2930 5.2930 5.3116 5.3116 5.5092 5.5092 5.5137 5.5137 9.5833 9.5833 9.5873 9.5873 9.9565 9.9565 10.1108 10.1108 10.1314 10.1314 11.4172 11.4172 11.4409 11.4409 11.5428 11.5428 12.1025 12.1025 12.3053 12.3053 12.3491 12.3491 16.8209 16.8209 k = 0.0000 0.0000 0.0102 ( 3791 PWs) bands (ev): -80.9618 -80.9618 -80.9599 -80.9599 -46.6558 -46.6558 -46.6462 -46.6462 -44.9380 -44.9380 -44.9336 -44.9336 -44.9097 -44.9097 -44.8907 -44.8907 -9.1004 -9.1004 -8.5235 -8.5235 4.1209 4.1209 5.2911 5.2911 5.2931 5.2931 5.3101 5.3101 5.5090 5.5090 5.5135 5.5135 9.5837 9.5837 9.5877 9.5877 9.9573 9.9573 10.1106 10.1106 10.1322 10.1322 11.4187 11.4187 11.4414 11.4414 11.5432 11.5432 12.1033 12.1033 12.3047 12.3047 12.3485 12.3485 16.8105 16.8105 k = 0.0000 0.0000 0.0204 ( 3797 PWs) bands (ev): -80.9619 -80.9619 -80.9601 -80.9601 -46.6558 -46.6558 -46.6462 -46.6462 -44.9380 -44.9380 -44.9336 -44.9336 -44.9097 -44.9097 -44.8907 -44.8907 -9.0992 -9.0992 -8.5247 -8.5247 4.1218 4.1218 5.2914 5.2914 5.2934 5.2934 5.3053 5.3053 5.5084 5.5084 5.5129 5.5129 9.5851 9.5851 9.5889 9.5889 9.9582 9.9582 10.1100 10.1100 10.1331 10.1331 11.4229 11.4229 11.4429 11.4429 11.5444 11.5444 12.1052 12.1052 12.3029 12.3029 12.3467 12.3467 16.7800 16.7800 k = 0.0000 0.0000 0.0306 ( 3827 PWs) bands (ev): -80.9629 -80.9629 -80.9609 -80.9609 -46.6560 -46.6560 -46.6465 -46.6465 -44.9381 -44.9381 -44.9339 -44.9339 -44.9099 -44.9099 -44.8910 -44.8910 -9.0973 -9.0973 -8.5267 -8.5267 4.1231 4.1231 5.2915 5.2915 5.2935 5.2935 5.2975 5.2975 5.5070 5.5070 5.5114 5.5114 9.5855 9.5855 9.5892 9.5892 9.9599 9.9599 10.1062 10.1062 10.1356 10.1356 11.4297 11.4297 11.4428 11.4428 11.5439 11.5439 12.1088 12.1088 12.2981 12.2981 12.3421 12.3421 16.7319 16.7319 k = 0.0000 0.0000 0.0408 ( 3827 PWs) bands (ev): -80.9629 -80.9629 -80.9610 -80.9610 -46.6560 -46.6560 -46.6466 -46.6466 -44.9381 -44.9381 -44.9339 -44.9339 -44.9098 -44.9098 -44.8911 -44.8911 -9.0946 -9.0946 -8.5295 -8.5295 4.1252 4.1252 5.2868 5.2868 5.2922 5.2922 5.2943 5.2943 5.5055 5.5055 5.5100 5.5100 9.5886 9.5886 9.5921 9.5921 9.9644 9.9644 10.1047 10.1047 10.1416 10.1416 11.4388 11.4388 11.4462 11.4462 11.5468 11.5468 12.1156 12.1156 12.2937 12.2937 12.3380 12.3380 16.6694 16.6694 k = 0.0000 0.0000 0.0510 ( 3827 PWs) bands (ev): -80.9629 -80.9629 -80.9610 -80.9610 -46.6559 -46.6559 -46.6466 -46.6466 -44.9381 -44.9381 -44.9340 -44.9340 -44.9097 -44.9097 -44.8912 -44.8912 -9.0911 -9.0911 -8.5331 -8.5331 4.1279 4.1279 5.2734 5.2734 5.2931 5.2931 5.2952 5.2952 5.5037 5.5037 5.5081 5.5081 9.5926 9.5926 9.5959 9.5959 9.9695 9.9695 10.1029 10.1029 10.1499 10.1499 11.4497 11.4497 11.4507 11.4507 11.5505 11.5505 12.1250 12.1250 12.2882 12.2882 12.3327 12.3327 16.5953 16.5953 k = 0.0000 0.0000 0.0613 ( 3838 PWs) bands (ev): -80.9629 -80.9629 -80.9616 -80.9616 -46.6560 -46.6560 -46.6467 -46.6467 -44.9381 -44.9381 -44.9340 -44.9340 -44.9098 -44.9098 -44.8913 -44.8913 -9.0868 -9.0868 -8.5374 -8.5374 4.1311 4.1311 5.2574 5.2574 5.2942 5.2942 5.2962 5.2962 5.5015 5.5015 5.5059 5.5059 9.5972 9.5972 9.6002 9.6002 9.9727 9.9727 10.0988 10.0988 10.1583 10.1583 11.4560 11.4560 11.4617 11.4617 11.5550 11.5550 12.1376 12.1376 12.2812 12.2812 12.3262 12.3262 16.5118 16.5118 k = 0.0000 0.0000 0.0715 ( 3838 PWs) bands (ev): -80.9629 -80.9629 -80.9617 -80.9617 -46.6560 -46.6560 -46.6468 -46.6468 -44.9381 -44.9381 -44.9340 -44.9340 -44.9096 -44.9096 -44.8915 -44.8915 -9.0819 -9.0819 -8.5425 -8.5425 4.1352 4.1352 5.2386 5.2386 5.2955 5.2955 5.2975 5.2975 5.4989 5.4989 5.5032 5.5032 9.6028 9.6028 9.6055 9.6055 9.9779 9.9779 10.0960 10.0960 10.1720 10.1720 11.4625 11.4625 11.4740 11.4740 11.5604 11.5604 12.1536 12.1536 12.2732 12.2732 12.3189 12.3189 16.4217 16.4217 k = 0.0000 0.0000 0.0817 ( 3838 PWs) bands (ev): -80.9628 -80.9628 -80.9617 -80.9617 -46.6559 -46.6559 -46.6469 -46.6469 -44.9380 -44.9380 -44.9341 -44.9341 -44.9094 -44.9094 -44.8917 -44.8917 -9.0761 -9.0761 -8.5484 -8.5484 4.1399 4.1399 5.2174 5.2174 5.2970 5.2970 5.2990 5.2990 5.4959 5.4959 5.5003 5.5003 9.6093 9.6093 9.6116 9.6116 9.9824 9.9824 10.0927 10.0927 10.1889 10.1889 11.4699 11.4699 11.4859 11.4859 11.5667 11.5667 12.1736 12.1736 12.2641 12.2641 12.3108 12.3108 16.3262 16.3262 k = 0.0000 0.0000 0.0919 ( 3820 PWs) bands (ev): -80.9625 -80.9625 -80.9610 -80.9610 -46.6556 -46.6556 -46.6469 -46.6469 -44.9379 -44.9379 -44.9341 -44.9341 -44.9090 -44.9090 -44.8918 -44.8918 -9.0697 -9.0697 -8.5549 -8.5549 4.1455 4.1455 5.1940 5.1940 5.2988 5.2988 5.3009 5.3009 5.4927 5.4927 5.4970 5.4970 9.6176 9.6176 9.6194 9.6194 9.9886 9.9886 10.0916 10.0916 10.2107 10.2107 11.4789 11.4789 11.4967 11.4967 11.5743 11.5743 12.1982 12.1982 12.2546 12.2546 12.3030 12.3030 16.2267 16.2267 k = 0.0000 0.0000 0.1021 ( 3820 PWs) bands (ev): -80.9624 -80.9624 -80.9610 -80.9610 -46.6555 -46.6555 -46.6470 -46.6470 -44.9378 -44.9378 -44.9341 -44.9341 -44.9088 -44.9088 -44.8920 -44.8920 -9.0626 -9.0626 -8.5622 -8.5622 4.1519 4.1519 5.1685 5.1685 5.3007 5.3007 5.3028 5.3028 5.4891 5.4891 5.4933 5.4933 9.6257 9.6257 9.6270 9.6270 9.9912 9.9912 10.0872 10.0872 10.2342 10.2342 11.4883 11.4883 11.5052 11.5052 11.5824 11.5824 12.2257 12.2257 12.2432 12.2432 12.2957 12.2957 16.1236 16.1236 k = 0.0000 0.0000 0.1123 ( 3820 PWs) bands (ev): -80.9624 -80.9624 -80.9611 -80.9611 -46.6553 -46.6553 -46.6471 -46.6471 -44.9378 -44.9378 -44.9342 -44.9342 -44.9085 -44.9085 -44.8923 -44.8923 -9.0548 -9.0548 -8.5702 -8.5702 4.1591 4.1591 5.1410 5.1410 5.3028 5.3028 5.3050 5.3050 5.4852 5.4852 5.4894 5.4894 9.6344 9.6344 9.6352 9.6352 9.9927 9.9927 10.0823 10.0823 10.2608 10.2608 11.4988 11.4988 11.5111 11.5111 11.5913 11.5913 12.2307 12.2307 12.2491 12.2491 12.2975 12.2975 16.0179 16.0179 k = 0.0000 0.0000 0.1225 ( 3796 PWs) bands (ev): -80.9616 -80.9616 -80.9604 -80.9604 -46.6550 -46.6550 -46.6471 -46.6471 -44.9376 -44.9376 -44.9342 -44.9342 -44.9080 -44.9080 -44.8923 -44.8923 -9.0463 -9.0463 -8.5788 -8.5788 4.1672 4.1672 5.1124 5.1124 5.3053 5.3053 5.3075 5.3075 5.4810 5.4810 5.4852 5.4852 9.6452 9.6452 9.6453 9.6453 9.9952 9.9952 10.0790 10.0790 10.2917 10.2917 11.5109 11.5109 11.5159 11.5159 11.6017 11.6017 12.2184 12.2184 12.2528 12.2528 12.3271 12.3271 15.9103 15.9103 k = 0.0000 0.0000 0.1327 ( 3796 PWs) bands (ev): -80.9616 -80.9616 -80.9604 -80.9604 -46.6548 -46.6548 -46.6472 -46.6472 -44.9375 -44.9375 -44.9342 -44.9342 -44.9077 -44.9077 -44.8926 -44.8926 -9.0372 -9.0372 -8.5881 -8.5881 4.1763 4.1763 5.0817 5.0817 5.3079 5.3079 5.3100 5.3100 5.4765 5.4765 5.4806 5.4806 9.6548 9.6548 9.6553 9.6553 9.9945 9.9945 10.0729 10.0729 10.3241 10.3241 11.5153 11.5153 11.5233 11.5233 11.6125 11.6125 12.2039 12.2039 12.2430 12.2430 12.3723 12.3723 15.8008 15.8008 k = 0.0000 0.0000 0.1429 ( 3808 PWs) bands (ev): -80.9621 -80.9621 -80.9607 -80.9607 -46.6547 -46.6547 -46.6475 -46.6475 -44.9375 -44.9375 -44.9344 -44.9344 -44.9074 -44.9074 -44.8931 -44.8931 -9.0275 -9.0275 -8.5980 -8.5980 4.1863 4.1863 5.0497 5.0497 5.3104 5.3104 5.3126 5.3126 5.4716 5.4716 5.4757 5.4757 9.6634 9.6634 9.6648 9.6648 9.9918 9.9918 10.0653 10.0653 10.3589 10.3589 11.5111 11.5111 11.5358 11.5358 11.6231 11.6231 12.1878 12.1878 12.2290 12.2290 12.4262 12.4262 15.6899 15.6899 k = 0.0000 0.0000 0.1531 ( 3820 PWs) bands (ev): -80.9628 -80.9628 -80.9607 -80.9607 -46.6546 -46.6546 -46.6479 -46.6479 -44.9375 -44.9375 -44.9347 -44.9347 -44.9071 -44.9071 -44.8936 -44.8936 -9.0172 -9.0172 -8.6085 -8.6085 4.1974 4.1974 5.0166 5.0166 5.3132 5.3132 5.3155 5.3155 5.4665 5.4665 5.4705 5.4705 9.6723 9.6723 9.6745 9.6745 9.9890 9.9890 10.0579 10.0579 10.3961 10.3961 11.5032 11.5032 11.5490 11.5490 11.6344 11.6344 12.1704 12.1704 12.2131 12.2131 12.4868 12.4868 15.5779 15.5779 k = 0.0000 0.0000 0.1634 ( 3832 PWs) bands (ev): -80.9630 -80.9630 -80.9613 -80.9613 -46.6545 -46.6545 -46.6482 -46.6482 -44.9375 -44.9375 -44.9348 -44.9348 -44.9068 -44.9068 -44.8940 -44.8940 -9.0063 -9.0063 -8.6195 -8.6195 4.2095 4.2095 4.9826 4.9826 5.3161 5.3161 5.3184 5.3184 5.4612 5.4612 5.4651 5.4651 9.6824 9.6824 9.6855 9.6855 9.9845 9.9845 10.0492 10.0492 10.4344 10.4344 11.4918 11.4918 11.5639 11.5639 11.6474 11.6474 12.1520 12.1520 12.1957 12.1957 12.5533 12.5533 15.4649 15.4649 k = 0.0000 0.0000 0.1736 ( 3832 PWs) bands (ev): -80.9629 -80.9629 -80.9614 -80.9614 -46.6544 -46.6544 -46.6484 -46.6484 -44.9375 -44.9375 -44.9349 -44.9349 -44.9064 -44.9064 -44.8943 -44.8943 -8.9949 -8.9949 -8.6311 -8.6311 4.2227 4.2227 4.9480 4.9480 5.3194 5.3194 5.3218 5.3218 5.4558 5.4558 5.4597 5.4597 9.6938 9.6938 9.6979 9.6979 9.9800 9.9800 10.0408 10.0408 10.4754 10.4754 11.4772 11.4772 11.5800 11.5800 11.6616 11.6616 12.1339 12.1339 12.1784 12.1784 12.6254 12.6254 15.3513 15.3513 k = 0.0000 0.0000 0.1838 ( 3838 PWs) bands (ev): -80.9632 -80.9632 -80.9614 -80.9614 -46.6542 -46.6542 -46.6487 -46.6487 -44.9374 -44.9374 -44.9350 -44.9350 -44.9060 -44.9060 -44.8949 -44.8949 -8.9830 -8.9830 -8.6432 -8.6432 4.2372 4.2372 4.9123 4.9123 5.3230 5.3230 5.3254 5.3254 5.4503 5.4503 5.4541 5.4541 9.7054 9.7054 9.7105 9.7105 9.9747 9.9747 10.0318 10.0318 10.5178 10.5178 11.4566 11.4566 11.5971 11.5971 11.6767 11.6767 12.1149 12.1149 12.1603 12.1603 12.7019 12.7019 15.2372 15.2372 k = 0.0000 0.0000 0.1940 ( 3832 PWs) bands (ev): -80.9632 -80.9632 -80.9611 -80.9611 -46.6538 -46.6538 -46.6489 -46.6489 -44.9372 -44.9372 -44.9351 -44.9351 -44.9056 -44.9056 -44.8953 -44.8953 -8.9706 -8.9706 -8.6558 -8.6558 4.2528 4.2528 4.8767 4.8767 5.3269 5.3269 5.3293 5.3293 5.4447 5.4447 5.4484 5.4484 9.7178 9.7178 9.7241 9.7241 9.9692 9.9692 10.0228 10.0228 10.5619 10.5619 11.4358 11.4358 11.6151 11.6151 11.6927 11.6927 12.0959 12.0959 12.1422 12.1422 12.7833 12.7833 15.1228 15.1228 k = 0.0000 0.0000 0.2042 ( 3832 PWs) bands (ev): -80.9632 -80.9632 -80.9611 -80.9611 -46.6536 -46.6536 -46.6491 -46.6491 -44.9371 -44.9371 -44.9352 -44.9352 -44.9051 -44.9051 -44.8958 -44.8958 -8.9578 -8.9578 -8.6687 -8.6687 4.2696 4.2696 4.8411 4.8411 5.3308 5.3308 5.3333 5.3333 5.4389 5.4389 5.4426 5.4426 9.7303 9.7303 9.7377 9.7377 9.9624 9.9624 10.0127 10.0127 10.6066 10.6066 11.4122 11.4122 11.6337 11.6337 11.7094 11.7094 12.0756 12.0756 12.1228 12.1228 12.8687 12.8687 15.0080 15.0080 k = 0.0000 0.0000 0.2144 ( 3820 PWs) bands (ev): -80.9629 -80.9629 -80.9606 -80.9606 -46.6532 -46.6532 -46.6493 -46.6493 -44.9370 -44.9370 -44.9353 -44.9353 -44.9045 -44.9045 -44.8961 -44.8961 -8.9446 -8.9446 -8.6821 -8.6821 4.2877 4.2877 4.8055 4.8055 5.3350 5.3350 5.3375 5.3375 5.4331 5.4331 5.4367 5.4367 9.7435 9.7435 9.7521 9.7521 9.9564 9.9564 10.0034 10.0034 10.6548 10.6548 11.3868 11.3868 11.6533 11.6533 11.7270 11.7270 12.0550 12.0550 12.1029 12.1029 12.9578 12.9578 14.8932 14.8932 k = 0.0000 0.0000 0.2246 ( 3820 PWs) bands (ev): -80.9629 -80.9629 -80.9607 -80.9607 -46.6530 -46.6530 -46.6495 -46.6495 -44.9369 -44.9369 -44.9354 -44.9354 -44.9040 -44.9040 -44.8966 -44.8966 -8.9310 -8.9310 -8.6958 -8.6958 4.3070 4.3070 4.7699 4.7699 5.3393 5.3393 5.3419 5.3419 5.4272 5.4272 5.4307 5.4307 9.7563 9.7563 9.7664 9.7664 9.9482 9.9482 9.9921 9.9921 10.7008 10.7008 11.3583 11.3583 11.6734 11.6734 11.7452 11.7452 12.0335 12.0335 12.0824 12.0824 13.0502 13.0502 14.7784 14.7784 k = 0.0000 0.0000 0.2348 ( 3820 PWs) bands (ev): -80.9628 -80.9628 -80.9607 -80.9607 -46.6528 -46.6528 -46.6497 -46.6497 -44.9368 -44.9368 -44.9355 -44.9355 -44.9036 -44.9036 -44.8971 -44.8971 -8.9171 -8.9171 -8.7099 -8.7099 4.3276 4.3276 4.7346 4.7346 5.3439 5.3439 5.3465 5.3465 5.4213 5.4213 5.4247 5.4247 9.7694 9.7694 9.7808 9.7808 9.9394 9.9394 9.9803 9.9803 10.7472 10.7472 11.3276 11.3276 11.6941 11.6941 11.7640 11.7640 12.0116 12.0116 12.0615 12.0615 13.1455 13.1455 14.6636 14.6636 k = 0.0000 0.0000 0.2450 ( 3820 PWs) bands (ev): -80.9628 -80.9628 -80.9608 -80.9608 -46.6525 -46.6525 -46.6500 -46.6500 -44.9367 -44.9367 -44.9356 -44.9356 -44.9031 -44.9031 -44.8975 -44.8975 -8.9029 -8.9029 -8.7242 -8.7242 4.3494 4.3494 4.6998 4.6998 5.3486 5.3486 5.3512 5.3512 5.4153 5.4153 5.4187 5.4187 9.7825 9.7825 9.7954 9.7954 9.9299 9.9299 9.9681 9.9681 10.7938 10.7938 11.2948 11.2948 11.7154 11.7154 11.7834 11.7834 11.9893 11.9893 12.0402 12.0402 13.2434 13.2434 14.5491 14.5491 k = 0.0000 0.0000 0.2552 ( 3802 PWs) bands (ev): -80.9618 -80.9618 -80.9607 -80.9607 -46.6523 -46.6523 -46.6499 -46.6499 -44.9365 -44.9365 -44.9355 -44.9355 -44.9026 -44.9026 -44.8978 -44.8978 -8.8884 -8.8884 -8.7387 -8.7387 4.3725 4.3725 4.6656 4.6656 5.3536 5.3536 5.3563 5.3563 5.4095 5.4095 5.4128 5.4128 9.7985 9.7985 9.8129 9.8129 9.9211 9.9211 9.9566 9.9566 10.8405 10.8405 11.2602 11.2602 11.7380 11.7380 11.8042 11.8042 11.9678 11.9678 12.0196 12.0196 13.3439 13.3439 14.4350 14.4350 k = 0.0000 0.0000 0.2655 ( 3808 PWs) bands (ev): -80.9619 -80.9619 -80.9610 -80.9610 -46.6521 -46.6521 -46.6502 -46.6502 -44.9364 -44.9364 -44.9356 -44.9356 -44.9022 -44.9022 -44.8983 -44.8983 -8.8738 -8.8738 -8.7535 -8.7535 4.3967 4.3967 4.6318 4.6318 5.3586 5.3586 5.3613 5.3613 5.4035 5.4035 5.4068 5.4068 9.8116 9.8116 9.8277 9.8277 9.9103 9.9103 9.9432 9.9432 10.8844 10.8844 11.2228 11.2228 11.7601 11.7601 11.8246 11.8246 11.9447 11.9447 11.9977 11.9977 13.4464 13.4464 14.3213 14.3213 k = 0.0000 0.0000 0.2757 ( 3808 PWs) bands (ev): -80.9618 -80.9618 -80.9610 -80.9610 -46.6518 -46.6518 -46.6505 -46.6505 -44.9363 -44.9363 -44.9357 -44.9357 -44.9017 -44.9017 -44.8988 -44.8988 -8.8589 -8.8589 -8.7684 -8.7684 4.4223 4.4223 4.5989 4.5989 5.3638 5.3638 5.3666 5.3666 5.3976 5.3976 5.4008 5.4008 9.8246 9.8246 9.8425 9.8425 9.8993 9.8993 9.9298 9.9298 10.9302 10.9302 11.1846 11.1846 11.7827 11.7827 11.8455 11.8455 11.9216 11.9216 11.9758 11.9758 13.5509 13.5509 14.2083 14.2083 k = 0.0000 0.0000 0.2859 ( 3796 PWs) bands (ev): -80.9612 -80.9612 -80.9609 -80.9609 -46.6515 -46.6515 -46.6506 -46.6506 -44.9362 -44.9362 -44.9358 -44.9358 -44.9011 -44.9011 -44.8992 -44.8992 -8.8439 -8.8439 -8.7835 -8.7835 4.4490 4.4490 4.5671 4.5671 5.3692 5.3692 5.3721 5.3721 5.3918 5.3918 5.3949 5.3949 9.8391 9.8391 9.8588 9.8588 9.8885 9.8885 9.9166 9.9166 10.9760 10.9760 11.1461 11.1461 11.8058 11.8058 11.8670 11.8670 11.8989 11.8989 11.9543 11.9543 13.6572 13.6572 14.0960 14.0960 k = 0.0000 0.0000 0.2961 ( 3790 PWs) bands (ev): -80.9611 -80.9611 -80.9607 -80.9607 -46.6512 -46.6512 -46.6508 -46.6508 -44.9360 -44.9360 -44.9358 -44.9358 -44.9005 -44.9005 -44.8996 -44.8996 -8.8288 -8.8288 -8.7986 -8.7986 4.4770 4.4770 4.5360 4.5360 5.3747 5.3747 5.3776 5.3776 5.3860 5.3860 5.3891 5.3891 9.8523 9.8523 9.8739 9.8739 9.8777 9.8777 9.9035 9.9035 11.0208 11.0208 11.1050 11.1050 11.8292 11.8292 11.8757 11.8757 11.8888 11.8888 11.9324 11.9324 13.7650 13.7650 13.9846 13.9846 k = 0.0000 0.0000 0.3063 ( 3784 PWs) bands (ev): -80.9607 -80.9607 -80.9607 -80.9607 -46.6509 -46.6509 -46.6509 -46.6509 -44.9359 -44.9359 -44.9359 -44.9359 -44.9000 -44.9000 -44.9000 -44.9000 -8.8137 -8.8137 -8.8137 -8.8137 4.5061 4.5061 4.5061 4.5061 5.3803 5.3803 5.3803 5.3803 5.3833 5.3833 5.3833 5.3833 9.8655 9.8655 9.8655 9.8655 9.8891 9.8891 9.8891 9.8891 11.0643 11.0643 11.0643 11.0643 11.8525 11.8525 11.8525 11.8525 11.9106 11.9106 11.9106 11.9106 13.8742 13.8742 13.8742 13.8742 k = 0.0000 0.0000 0.3063 ( 3784 PWs) bands (ev): -80.9607 -80.9607 -80.9607 -80.9607 -46.6509 -46.6509 -46.6509 -46.6509 -44.9359 -44.9359 -44.9359 -44.9359 -44.9000 -44.9000 -44.9000 -44.9000 -8.8137 -8.8137 -8.8137 -8.8137 4.5061 4.5061 4.5061 4.5061 5.3803 5.3803 5.3803 5.3803 5.3833 5.3833 5.3833 5.3833 9.8655 9.8655 9.8655 9.8655 9.8891 9.8891 9.8891 9.8891 11.0643 11.0643 11.0643 11.0643 11.8525 11.8525 11.8525 11.8525 11.9106 11.9106 11.9106 11.9106 13.8742 13.8742 13.8742 13.8742 k = 0.0088 0.0051 0.3063 ( 3784 PWs) bands (ev): -80.9607 -80.9607 -80.9607 -80.9607 -46.6510 -46.6510 -46.6509 -46.6509 -44.9359 -44.9359 -44.9359 -44.9359 -44.9001 -44.9001 -44.9000 -44.9000 -8.8135 -8.8135 -8.8133 -8.8133 4.5059 4.5059 4.5060 4.5060 5.3803 5.3803 5.3803 5.3803 5.3833 5.3833 5.3834 5.3834 9.8645 9.8645 9.8661 9.8661 9.8890 9.8890 9.8890 9.8890 11.0641 11.0641 11.0650 11.0650 11.8515 11.8515 11.8515 11.8515 11.9096 11.9096 11.9097 11.9097 13.8760 13.8760 13.8769 13.8769 k = 0.0175 0.0101 0.3063 ( 3790 PWs) bands (ev): -80.9609 -80.9609 -80.9609 -80.9609 -46.6511 -46.6511 -46.6510 -46.6510 -44.9360 -44.9360 -44.9360 -44.9360 -44.9001 -44.9001 -44.9000 -44.9000 -8.8128 -8.8128 -8.8124 -8.8124 4.5054 4.5054 4.5055 4.5055 5.3798 5.3798 5.3802 5.3802 5.3835 5.3835 5.3836 5.3836 9.8626 9.8626 9.8658 9.8658 9.8882 9.8882 9.8883 9.8883 11.0639 11.0639 11.0656 11.0656 11.8479 11.8479 11.8482 11.8482 11.9066 11.9066 11.9066 11.9066 13.8820 13.8820 13.8838 13.8838 k = 0.0263 0.0152 0.3063 ( 3794 PWs) bands (ev): -80.9610 -80.9610 -80.9610 -80.9610 -46.6511 -46.6511 -46.6510 -46.6510 -44.9361 -44.9361 -44.9361 -44.9361 -44.9002 -44.9002 -44.9000 -44.9000 -8.8115 -8.8115 -8.8109 -8.8109 4.5047 4.5047 4.5048 4.5048 5.3788 5.3788 5.3796 5.3796 5.3842 5.3842 5.3846 5.3846 9.8605 9.8605 9.8650 9.8650 9.8872 9.8872 9.8875 9.8875 11.0646 11.0646 11.0673 11.0673 11.8418 11.8418 11.8427 11.8427 11.9017 11.9017 11.9021 11.9021 13.8924 13.8924 13.8950 13.8950 k = 0.0351 0.0203 0.3063 ( 3792 PWs) bands (ev): -80.9609 -80.9609 -80.9609 -80.9609 -46.6512 -46.6512 -46.6510 -46.6510 -44.9361 -44.9361 -44.9361 -44.9361 -44.9003 -44.9003 -44.9000 -44.9000 -8.8096 -8.8096 -8.8089 -8.8089 4.5036 4.5036 4.5037 4.5037 5.3773 5.3773 5.3786 5.3786 5.3854 5.3854 5.3862 5.3862 9.8585 9.8585 9.8642 9.8642 9.8864 9.8864 9.8871 9.8871 11.0662 11.0662 11.0698 11.0698 11.8330 11.8330 11.8351 11.8351 11.8955 11.8955 11.8969 11.8969 13.9070 13.9070 13.9105 13.9105 k = 0.0439 0.0253 0.3063 ( 3804 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6513 -46.6513 -46.6511 -46.6511 -44.9362 -44.9362 -44.9362 -44.9362 -44.9004 -44.9004 -44.9001 -44.9001 -8.8072 -8.8072 -8.8063 -8.8063 4.5022 4.5022 4.5023 4.5023 5.3753 5.3753 5.3770 5.3770 5.3872 5.3872 5.3883 5.3883 9.8549 9.8549 9.8612 9.8612 9.8841 9.8841 9.8856 9.8856 11.0673 11.0673 11.0718 11.0718 11.8202 11.8202 11.8241 11.8241 11.8878 11.8878 11.8906 11.8906 13.9256 13.9256 13.9299 13.9299 k = 0.0526 0.0304 0.3063 ( 3804 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6514 -46.6514 -46.6511 -46.6511 -44.9363 -44.9363 -44.9363 -44.9363 -44.9005 -44.9005 -44.9001 -44.9001 -8.8043 -8.8043 -8.8032 -8.8032 4.5004 4.5004 4.5006 4.5006 5.3730 5.3730 5.3751 5.3751 5.3896 5.3896 5.3909 5.3909 9.8522 9.8522 9.8590 9.8590 9.8827 9.8827 9.8853 9.8853 11.0696 11.0696 11.0751 11.0751 11.8046 11.8046 11.8106 11.8106 11.8797 11.8797 11.8842 11.8842 13.9482 13.9482 13.9533 13.9533 k = 0.0614 0.0355 0.3063 ( 3804 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6515 -46.6515 -46.6512 -46.6512 -44.9365 -44.9365 -44.9365 -44.9364 -44.9005 -44.9005 -44.9001 -44.9001 -8.8008 -8.8008 -8.7996 -8.7996 4.4983 4.4983 4.4985 4.4985 5.3704 5.3704 5.3729 5.3729 5.3923 5.3923 5.3940 5.3940 9.8492 9.8492 9.8563 9.8563 9.8812 9.8812 9.8848 9.8848 11.0721 11.0721 11.0786 11.0786 11.7859 11.7859 11.7943 11.7943 11.8711 11.8711 11.8775 11.8775 13.9746 13.9746 13.9805 13.9805 k = 0.0702 0.0405 0.3063 ( 3812 PWs) bands (ev): -80.9614 -80.9614 -80.9614 -80.9614 -46.6517 -46.6517 -46.6513 -46.6513 -44.9366 -44.9366 -44.9366 -44.9366 -44.9006 -44.9006 -44.9001 -44.9001 -8.7969 -8.7969 -8.7954 -8.7954 4.4958 4.4958 4.4959 4.4959 5.3677 5.3677 5.3705 5.3705 5.3955 5.3955 5.3974 5.3974 9.8451 9.8451 9.8523 9.8523 9.8785 9.8785 9.8833 9.8833 11.0747 11.0747 11.0823 11.0823 11.7640 11.7640 11.7749 11.7749 11.8616 11.8616 11.8700 11.8700 14.0046 14.0046 14.0113 14.0113 k = 0.0789 0.0456 0.3063 ( 3816 PWs) bands (ev): -80.9615 -80.9615 -80.9615 -80.9615 -46.6518 -46.6518 -46.6514 -46.6514 -44.9368 -44.9368 -44.9368 -44.9368 -44.9007 -44.9007 -44.9002 -44.9002 -8.7924 -8.7924 -8.7908 -8.7908 4.4927 4.4927 4.4929 4.4929 5.3648 5.3648 5.3679 5.3679 5.3991 5.3991 5.4012 5.4012 9.8414 9.8414 9.8483 9.8483 9.8765 9.8765 9.8829 9.8829 11.0772 11.0772 11.0859 11.0859 11.7392 11.7392 11.7526 11.7526 11.8522 11.8522 11.8624 11.8624 14.0380 14.0380 14.0454 14.0454 k = 0.0877 0.0506 0.3063 ( 3810 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6519 -46.6519 -46.6514 -46.6514 -44.9370 -44.9370 -44.9370 -44.9370 -44.9007 -44.9007 -44.9001 -44.9001 -8.7874 -8.7874 -8.7856 -8.7856 4.4893 4.4893 4.4894 4.4894 5.3622 5.3622 5.3656 5.3656 5.4032 5.4032 5.4055 5.4055 9.8382 9.8382 9.8448 9.8448 9.8748 9.8748 9.8826 9.8826 11.0801 11.0801 11.0900 11.0900 11.7132 11.7132 11.7291 11.7291 11.8426 11.8426 11.8545 11.8545 14.0748 14.0748 14.0830 14.0830 k = 0.0965 0.0557 0.3063 ( 3802 PWs) bands (ev): -80.9610 -80.9610 -80.9610 -80.9610 -46.6519 -46.6519 -46.6514 -46.6514 -44.9371 -44.9371 -44.9371 -44.9371 -44.9007 -44.9007 -44.9001 -44.9001 -8.7819 -8.7819 -8.7800 -8.7800 4.4853 4.4853 4.4854 4.4854 5.3596 5.3596 5.3633 5.3633 5.4077 5.4077 5.4103 5.4103 9.8348 9.8348 9.8410 9.8410 9.8731 9.8732 9.8825 9.8825 11.0830 11.0830 11.0942 11.0942 11.6852 11.6852 11.7038 11.7038 11.8329 11.8329 11.8464 11.8464 14.1149 14.1149 14.1237 14.1237 k = 0.1053 0.0608 0.3063 ( 3802 PWs) bands (ev): -80.9610 -80.9610 -80.9610 -80.9610 -46.6520 -46.6520 -46.6515 -46.6515 -44.9373 -44.9373 -44.9373 -44.9373 -44.9008 -44.9008 -44.9001 -44.9001 -8.7760 -8.7760 -8.7739 -8.7739 4.4807 4.4807 4.4808 4.4808 5.3572 5.3572 5.3611 5.3611 5.4126 5.4126 5.4154 5.4154 9.8304 9.8304 9.8356 9.8356 9.8709 9.8709 9.8822 9.8822 11.0854 11.0854 11.0980 11.0980 11.6548 11.6548 11.6760 11.6760 11.8222 11.8222 11.8372 11.8372 14.1578 14.1578 14.1672 14.1672 k = 0.1140 0.0658 0.3063 ( 3798 PWs) bands (ev): -80.9609 -80.9609 -80.9609 -80.9609 -46.6521 -46.6521 -46.6516 -46.6516 -44.9375 -44.9375 -44.9375 -44.9375 -44.9008 -44.9008 -44.9001 -44.9001 -8.7696 -8.7696 -8.7674 -8.7674 4.4755 4.4755 4.4756 4.4756 5.3550 5.3550 5.3592 5.3592 5.4179 5.4179 5.4209 5.4209 9.8260 9.8260 9.8301 9.8301 9.8690 9.8690 9.8822 9.8822 11.0877 11.0877 11.1018 11.1018 11.6231 11.6231 11.6470 11.6470 11.8113 11.8113 11.8278 11.8278 14.2035 14.2035 14.2136 14.2136 k = 0.1228 0.0709 0.3063 ( 3796 PWs) bands (ev): -80.9608 -80.9608 -80.9608 -80.9608 -46.6523 -46.6523 -46.6516 -46.6516 -44.9378 -44.9378 -44.9377 -44.9377 -44.9008 -44.9008 -44.9001 -44.9001 -8.7628 -8.7628 -8.7604 -8.7604 4.4697 4.4697 4.4697 4.4697 5.3532 5.3532 5.3576 5.3576 5.4235 5.4235 5.4268 5.4268 9.8211 9.8211 9.8238 9.8238 9.8673 9.8673 9.8826 9.8826 11.0892 11.0892 11.1049 11.1049 11.5896 11.5896 11.6164 11.6164 11.8000 11.8000 11.8178 11.8178 14.2519 14.2519 14.2625 14.2625 k = 0.1316 0.0760 0.3063 ( 3812 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6526 -46.6526 -46.6519 -46.6519 -44.9381 -44.9381 -44.9381 -44.9381 -44.9010 -44.9010 -44.9002 -44.9002 -8.7556 -8.7556 -8.7531 -8.7531 4.4630 4.4630 4.4631 4.4631 5.3517 5.3517 5.3563 5.3563 5.4293 5.4293 5.4327 5.4327 9.8149 9.8149 9.8163 9.8163 9.8642 9.8642 9.8815 9.8815 11.0895 11.0895 11.1070 11.1070 11.5537 11.5537 11.5836 11.5836 11.7864 11.7864 11.8055 11.8055 14.3027 14.3027 14.3137 14.3137 k = 0.1404 0.0810 0.3063 ( 3812 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6527 -46.6527 -46.6520 -46.6520 -44.9384 -44.9384 -44.9384 -44.9384 -44.9010 -44.9010 -44.9002 -44.9002 -8.7479 -8.7479 -8.7453 -8.7453 4.4558 4.4558 4.4560 4.4560 5.3509 5.3509 5.3556 5.3556 5.4355 5.4355 5.4391 5.4391 9.8093 9.8093 9.8094 9.8094 9.8622 9.8622 9.8814 9.8814 11.0895 11.0895 11.1089 11.1089 11.5190 11.5190 11.5521 11.5521 11.7732 11.7732 11.7935 11.7935 14.3560 14.3560 14.3675 14.3675 k = 0.1491 0.0861 0.3063 ( 3820 PWs) bands (ev): -80.9614 -80.9614 -80.9614 -80.9614 -46.6530 -46.6530 -46.6522 -46.6522 -44.9388 -44.9388 -44.9387 -44.9387 -44.9011 -44.9011 -44.9003 -44.9003 -8.7400 -8.7399 -8.7372 -8.7372 4.4479 4.4479 4.4481 4.4481 5.3506 5.3506 5.3556 5.3556 5.4419 5.4419 5.4457 5.4457 9.8012 9.8012 9.8028 9.8028 9.8599 9.8599 9.8810 9.8810 11.0883 11.0883 11.1098 11.1098 11.4838 11.4838 11.5202 11.5202 11.7583 11.7583 11.7796 11.7796 14.4115 14.4115 14.4234 14.4234 k = 0.1579 0.0912 0.3063 ( 3818 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6531 -46.6531 -46.6524 -46.6524 -44.9390 -44.9390 -44.9390 -44.9390 -44.9012 -44.9012 -44.9003 -44.9003 -8.7316 -8.7316 -8.7288 -8.7288 4.4394 4.4394 4.4397 4.4397 5.3512 5.3512 5.3562 5.3562 5.4487 5.4487 5.4526 5.4526 9.7934 9.7934 9.7966 9.7966 9.8582 9.8582 9.8812 9.8812 11.0859 11.0859 11.1096 11.1096 11.4493 11.4493 11.4892 11.4892 11.7438 11.7438 11.7662 11.7662 14.4692 14.4692 14.4815 14.4815 k = 0.1667 0.0962 0.3063 ( 3818 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6533 -46.6533 -46.6525 -46.6525 -44.9394 -44.9394 -44.9393 -44.9393 -44.9012 -44.9012 -44.9003 -44.9003 -8.7230 -8.7230 -8.7200 -8.7200 4.4301 4.4301 4.4305 4.4305 5.3524 5.3524 5.3575 5.3575 5.4557 5.4557 5.4598 5.4598 9.7856 9.7856 9.7903 9.7903 9.8568 9.8568 9.8816 9.8816 11.0818 11.0818 11.1077 11.1077 11.4148 11.4148 11.4581 11.4581 11.7287 11.7287 11.7521 11.7521 14.5289 14.5289 14.5415 14.5415 k = 0.1754 0.1013 0.3063 ( 3814 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6534 -46.6534 -46.6526 -46.6526 -44.9397 -44.9397 -44.9396 -44.9396 -44.9013 -44.9013 -44.9004 -44.9004 -8.7140 -8.7140 -8.7110 -8.7110 4.4202 4.4202 4.4208 4.4208 5.3543 5.3543 5.3595 5.3595 5.4631 5.4631 5.4673 5.4673 9.7775 9.7775 9.7839 9.7839 9.8559 9.8559 9.8823 9.8823 11.0761 11.0761 11.1040 11.1040 11.3814 11.3814 11.4280 11.4280 11.7134 11.7134 11.7377 11.7377 14.5906 14.5906 14.6034 14.6034 k = 0.1842 0.1064 0.3063 ( 3814 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6536 -46.6536 -46.6528 -46.6528 -44.9400 -44.9400 -44.9399 -44.9399 -44.9013 -44.9013 -44.9004 -44.9004 -8.7048 -8.7048 -8.7017 -8.7017 4.4097 4.4097 4.4104 4.4104 5.3569 5.3569 5.3621 5.3621 5.4705 5.4705 5.4749 5.4749 9.7694 9.7694 9.7774 9.7774 9.8551 9.8551 9.8832 9.8832 11.0680 11.0680 11.0977 11.0977 11.3495 11.3495 11.3992 11.3992 11.6967 11.6967 11.7219 11.7219 14.6539 14.6539 14.6669 14.6669 k = 0.1930 0.1114 0.3063 ( 3818 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6538 -46.6538 -46.6530 -46.6530 -44.9404 -44.9404 -44.9403 -44.9403 -44.9014 -44.9014 -44.9004 -44.9004 -8.6953 -8.6953 -8.6922 -8.6921 4.3986 4.3986 4.3994 4.3994 5.3601 5.3601 5.3654 5.3654 5.4781 5.4781 5.4827 5.4827 9.7606 9.7606 9.7703 9.7703 9.8545 9.8545 9.8842 9.8842 11.0573 11.0573 11.0879 11.0879 11.3193 11.3193 11.3712 11.3712 11.6796 11.6796 11.7056 11.7056 14.7189 14.7189 14.7320 14.7320 k = 0.2018 0.1165 0.3063 ( 3822 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6540 -46.6540 -46.6532 -46.6532 -44.9408 -44.9408 -44.9407 -44.9407 -44.9014 -44.9014 -44.9005 -44.9005 -8.6856 -8.6856 -8.6824 -8.6824 4.3869 4.3869 4.3878 4.3878 5.3641 5.3641 5.3694 5.3694 5.4859 5.4859 5.4905 5.4905 9.7520 9.7520 9.7635 9.7635 9.8545 9.8545 9.8856 9.8856 11.0435 11.0435 11.0741 11.0741 11.2923 11.2923 11.3454 11.3454 11.6613 11.6613 11.6880 11.6880 14.7854 14.7854 14.7986 14.7986 k = 0.2105 0.1215 0.3063 ( 3822 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6542 -46.6542 -46.6534 -46.6534 -44.9411 -44.9411 -44.9410 -44.9410 -44.9015 -44.9015 -44.9005 -44.9005 -8.6758 -8.6758 -8.6725 -8.6725 4.3748 4.3748 4.3758 4.3758 5.3689 5.3689 5.3742 5.3742 5.4938 5.4938 5.4985 5.4985 9.7434 9.7434 9.7565 9.7565 9.8547 9.8547 9.8872 9.8872 11.0274 11.0274 11.0565 11.0565 11.2692 11.2692 11.3220 11.3220 11.6431 11.6431 11.6705 11.6705 14.8534 14.8534 14.8667 14.8667 k = 0.2193 0.1266 0.3063 ( 3818 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6544 -46.6544 -46.6535 -46.6535 -44.9414 -44.9414 -44.9414 -44.9414 -44.9015 -44.9015 -44.9006 -44.9006 -8.6658 -8.6657 -8.6624 -8.6624 4.3623 4.3623 4.3634 4.3634 5.3743 5.3743 5.3796 5.3796 5.5020 5.5020 5.5068 5.5068 9.7348 9.7348 9.7496 9.7496 9.8556 9.8556 9.8893 9.8893 11.0087 11.0087 11.0346 11.0346 11.2499 11.2499 11.3009 11.3009 11.6251 11.6251 11.6530 11.6530 14.9229 14.9229 14.9362 14.9362 k = 0.2281 0.1317 0.3063 ( 3826 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6546 -46.6546 -46.6537 -46.6537 -44.9419 -44.9419 -44.9418 -44.9418 -44.9016 -44.9016 -44.9007 -44.9007 -8.6556 -8.6556 -8.6522 -8.6522 4.3494 4.3494 4.3506 4.3506 5.3803 5.3803 5.3855 5.3855 5.5101 5.5101 5.5150 5.5150 9.7256 9.7256 9.7422 9.7422 9.8563 9.8563 9.8912 9.8912 10.9862 10.9862 11.0078 11.0078 11.2333 11.2333 11.2811 11.2811 11.6057 11.6057 11.6341 11.6341 14.9934 14.9934 15.0067 15.0067 k = 0.2368 0.1367 0.3063 ( 3826 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6548 -46.6548 -46.6539 -46.6539 -44.9422 -44.9422 -44.9421 -44.9421 -44.9017 -44.9017 -44.9007 -44.9007 -8.6454 -8.6454 -8.6420 -8.6420 4.3363 4.3363 4.3376 4.3376 5.3869 5.3869 5.3921 5.3921 5.5183 5.5183 5.5232 5.5232 9.7172 9.7172 9.7355 9.7355 9.8573 9.8573 9.8933 9.8933 10.9619 10.9619 10.9786 10.9786 11.2206 11.2206 11.2645 11.2645 11.5859 11.5859 11.6147 11.6147 15.0651 15.0651 15.0783 15.0783 k = 0.2456 0.1418 0.3063 ( 3828 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6550 -46.6550 -46.6541 -46.6541 -44.9426 -44.9426 -44.9425 -44.9425 -44.9018 -44.9018 -44.9008 -44.9008 -8.6350 -8.6350 -8.6316 -8.6316 4.3229 4.3229 4.3244 4.3244 5.3941 5.3941 5.3992 5.3992 5.5265 5.5265 5.5315 5.5315 9.7086 9.7086 9.7286 9.7286 9.8591 9.8591 9.8961 9.8961 10.9352 10.9352 10.9466 10.9466 11.2096 11.2096 11.2493 11.2493 11.5656 11.5656 11.5947 11.5947 15.1379 15.1379 15.1509 15.1509 k = 0.2544 0.1469 0.3063 ( 3824 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6552 -46.6552 -46.6543 -46.6543 -44.9429 -44.9429 -44.9428 -44.9428 -44.9018 -44.9018 -44.9008 -44.9008 -8.6247 -8.6247 -8.6213 -8.6213 4.3095 4.3095 4.3110 4.3110 5.4018 5.4018 5.4068 5.4068 5.5347 5.5347 5.5398 5.5398 9.7008 9.7008 9.7225 9.7225 9.8616 9.8616 9.8996 9.8996 10.9071 10.9071 10.9132 10.9132 11.2004 11.2004 11.2358 11.2358 11.5452 11.5452 11.5745 11.5745 15.2115 15.2115 15.2243 15.2243 k = 0.2632 0.1519 0.3063 ( 3824 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6553 -46.6553 -46.6545 -46.6545 -44.9433 -44.9433 -44.9431 -44.9431 -44.9018 -44.9018 -44.9009 -44.9009 -8.6143 -8.6143 -8.6109 -8.6109 4.2960 4.2960 4.2976 4.2976 5.4098 5.4098 5.4147 5.4147 5.5430 5.5430 5.5480 5.5480 9.6926 9.6926 9.7159 9.7159 9.8647 9.8647 9.9035 9.9035 10.8772 10.8772 10.8783 10.8783 11.1919 11.1919 11.2232 11.2232 11.5246 11.5246 11.5541 11.5541 15.2859 15.2859 15.2985 15.2985 k = 0.2719 0.1570 0.3063 ( 3820 PWs) bands (ev): -80.9609 -80.9609 -80.9609 -80.9609 -46.6555 -46.6555 -46.6546 -46.6546 -44.9436 -44.9436 -44.9435 -44.9435 -44.9019 -44.9019 -44.9009 -44.9009 -8.6040 -8.6040 -8.6006 -8.6006 4.2825 4.2825 4.2842 4.2842 5.4182 5.4182 5.4230 5.4230 5.5512 5.5512 5.5562 5.5562 9.6852 9.6852 9.7102 9.7102 9.8682 9.8682 9.9077 9.9077 10.8431 10.8431 10.8467 10.8467 11.1842 11.1842 11.2117 11.2117 11.5036 11.5036 11.5331 11.5331 15.3610 15.3610 15.3733 15.3733 k = 0.2807 0.1621 0.3063 ( 3812 PWs) bands (ev): -80.9606 -80.9606 -80.9606 -80.9606 -46.6556 -46.6556 -46.6547 -46.6547 -44.9439 -44.9439 -44.9438 -44.9438 -44.9018 -44.9018 -44.9009 -44.9009 -8.5938 -8.5938 -8.5904 -8.5904 4.2691 4.2691 4.2709 4.2709 5.4269 5.4269 5.4317 5.4317 5.5594 5.5594 5.5644 5.5644 9.6787 9.6787 9.7053 9.7053 9.8723 9.8723 9.9125 9.9125 10.8076 10.8076 10.8156 10.8156 11.1771 11.1771 11.2009 11.2009 11.4827 11.4827 11.5121 11.5121 15.4366 15.4366 15.4486 15.4486 k = 0.2895 0.1671 0.3063 ( 3812 PWs) bands (ev): -80.9606 -80.9606 -80.9606 -80.9606 -46.6558 -46.6558 -46.6549 -46.6549 -44.9443 -44.9443 -44.9442 -44.9442 -44.9019 -44.9019 -44.9009 -44.9009 -8.5836 -8.5836 -8.5802 -8.5802 4.2557 4.2557 4.2576 4.2576 5.4358 5.4358 5.4404 5.4404 5.5674 5.5674 5.5724 5.5724 9.6720 9.6720 9.7002 9.7002 9.8767 9.8767 9.9174 9.9174 10.7713 10.7713 10.7833 10.7833 11.1696 11.1696 11.1900 11.1900 11.4612 11.4612 11.4905 11.4905 15.5125 15.5125 15.5241 15.5241 k = 0.2982 0.1722 0.3063 ( 3816 PWs) bands (ev): -80.9607 -80.9607 -80.9607 -80.9607 -46.6560 -46.6560 -46.6551 -46.6551 -44.9447 -44.9447 -44.9445 -44.9445 -44.9019 -44.9019 -44.9010 -44.9010 -8.5735 -8.5735 -8.5702 -8.5702 4.2426 4.2426 4.2445 4.2445 5.4447 5.4447 5.4493 5.4493 5.5753 5.5753 5.5802 5.5802 9.6653 9.6653 9.6950 9.6950 9.8815 9.8815 9.9226 9.9226 10.7345 10.7345 10.7502 10.7502 11.1622 11.1622 11.1794 11.1794 11.4396 11.4396 11.4686 11.4686 15.5886 15.5886 15.5998 15.5998 k = 0.3070 0.1773 0.3063 ( 3812 PWs) bands (ev): -80.9605 -80.9605 -80.9605 -80.9605 -46.6561 -46.6561 -46.6553 -46.6553 -44.9450 -44.9450 -44.9449 -44.9449 -44.9019 -44.9019 -44.9010 -44.9010 -8.5636 -8.5636 -8.5604 -8.5604 4.2298 4.2298 4.2317 4.2317 5.4538 5.4538 5.4582 5.4582 5.5831 5.5831 5.5880 5.5880 9.6602 9.6602 9.6913 9.6913 9.8873 9.8873 9.9287 9.9287 10.6987 10.6987 10.7176 10.7176 11.1545 11.1545 11.1690 11.1690 11.4183 11.4183 11.4470 11.4470 15.6647 15.6647 15.6756 15.6756 k = 0.3158 0.1823 0.3063 ( 3812 PWs) bands (ev): -80.9605 -80.9605 -80.9604 -80.9604 -46.6563 -46.6563 -46.6555 -46.6555 -44.9453 -44.9453 -44.9452 -44.9452 -44.9020 -44.9020 -44.9011 -44.9011 -8.5539 -8.5539 -8.5507 -8.5507 4.2172 4.2172 4.2191 4.2191 5.4629 5.4629 5.4671 5.4671 5.5908 5.5908 5.5956 5.5956 9.6551 9.6551 9.6875 9.6875 9.8934 9.8934 9.9349 9.9349 10.6624 10.6624 10.6843 10.6843 11.1469 11.1469 11.1587 11.1587 11.3973 11.3973 11.4255 11.4255 15.7409 15.7409 15.7513 15.7513 k = 0.3246 0.1874 0.3063 ( 3810 PWs) bands (ev): -80.9604 -80.9604 -80.9604 -80.9604 -46.6564 -46.6564 -46.6556 -46.6556 -44.9456 -44.9456 -44.9455 -44.9455 -44.9020 -44.9020 -44.9011 -44.9011 -8.5444 -8.5444 -8.5413 -8.5413 4.2050 4.2050 4.2069 4.2069 5.4719 5.4719 5.4760 5.4760 5.5982 5.5982 5.6029 5.6029 9.6507 9.6507 9.6844 9.6844 9.9000 9.9000 9.9417 9.9417 10.6268 10.6268 10.6514 10.6514 11.1396 11.1396 11.1490 11.1490 11.3762 11.3762 11.4037 11.4037 15.8169 15.8169 15.8268 15.8268 k = 0.3333 0.1925 0.3063 ( 3804 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6565 -46.6565 -46.6557 -46.6557 -44.9459 -44.9459 -44.9458 -44.9458 -44.9020 -44.9020 -44.9012 -44.9012 -8.5352 -8.5352 -8.5322 -8.5322 4.1932 4.1932 4.1952 4.1952 5.4809 5.4809 5.4848 5.4848 5.6055 5.6055 5.6100 5.6100 9.6480 9.6480 9.6828 9.6828 9.9067 9.9067 9.9483 9.9484 10.5929 10.5929 10.6195 10.6195 11.1323 11.1323 11.1394 11.1394 11.3549 11.3549 11.3817 11.3817 15.8925 15.8925 15.9020 15.9020 k = 0.3421 0.1975 0.3063 ( 3812 PWs) bands (ev): -80.9603 -80.9603 -80.9603 -80.9603 -46.6567 -46.6567 -46.6560 -46.6560 -44.9463 -44.9463 -44.9462 -44.9462 -44.9020 -44.9020 -44.9013 -44.9013 -8.5262 -8.5262 -8.5233 -8.5233 4.1818 4.1818 4.1837 4.1837 5.4896 5.4896 5.4934 5.4934 5.6124 5.6124 5.6168 5.6168 9.6446 9.6446 9.6804 9.6804 9.9133 9.9133 9.9548 9.9548 10.5577 10.5577 10.5863 10.5863 11.1247 11.1247 11.1296 11.1296 11.3335 11.3335 11.3594 11.3594 15.9674 15.9674 15.9763 15.9763 k = 0.3509 0.2026 0.3063 ( 3812 PWs) bands (ev): -80.9603 -80.9603 -80.9603 -80.9603 -46.6569 -46.6569 -46.6561 -46.6561 -44.9466 -44.9466 -44.9465 -44.9465 -44.9021 -44.9021 -44.9013 -44.9013 -8.5175 -8.5175 -8.5147 -8.5147 4.1709 4.1709 4.1728 4.1728 5.4982 5.4982 5.5018 5.5018 5.6191 5.6191 5.6234 5.6234 9.6430 9.6430 9.6798 9.6798 9.9206 9.9206 9.9618 9.9618 10.5237 10.5237 10.5540 10.5540 11.1172 11.1172 11.1202 11.1202 11.3130 11.3130 11.3378 11.3378 16.0415 16.0415 16.0500 16.0500 k = 0.3596 0.2076 0.3063 ( 3812 PWs) bands (ev): -80.9603 -80.9603 -80.9603 -80.9603 -46.6570 -46.6570 -46.6563 -46.6563 -44.9469 -44.9469 -44.9468 -44.9468 -44.9021 -44.9021 -44.9014 -44.9014 -8.5092 -8.5092 -8.5065 -8.5065 4.1605 4.1605 4.1624 4.1624 5.5064 5.5064 5.5099 5.5099 5.6256 5.6256 5.6297 5.6297 9.6424 9.6424 9.6799 9.6799 9.9282 9.9282 9.9690 9.9690 10.4905 10.4905 10.5221 10.5221 11.1099 11.1099 11.1110 11.1110 11.2930 11.2930 11.3166 11.3166 16.1146 16.1146 16.1226 16.1226 k = 0.3684 0.2127 0.3063 ( 3808 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6571 -46.6571 -46.6564 -46.6564 -44.9471 -44.9471 -44.9470 -44.9470 -44.9021 -44.9021 -44.9014 -44.9014 -8.5012 -8.5012 -8.4986 -8.4986 4.1507 4.1507 4.1525 4.1525 5.5144 5.5144 5.5177 5.5177 5.6318 5.6318 5.6358 5.6358 9.6429 9.6429 9.6810 9.6810 9.9364 9.9364 9.9766 9.9766 10.4583 10.4583 10.4909 10.4909 11.1021 11.1021 11.1028 11.1028 11.2739 11.2739 11.2961 11.2961 16.1865 16.1865 16.1939 16.1939 k = 0.3772 0.2178 0.3063 ( 3800 PWs) bands (ev): -80.9599 -80.9599 -80.9599 -80.9599 -46.6571 -46.6571 -46.6565 -46.6565 -44.9473 -44.9473 -44.9472 -44.9472 -44.9020 -44.9020 -44.9014 -44.9014 -8.4936 -8.4936 -8.4911 -8.4911 4.1414 4.1414 4.1431 4.1431 5.5221 5.5221 5.5252 5.5252 5.6378 5.6378 5.6415 5.6415 9.6447 9.6447 9.6832 9.6832 9.9451 9.9451 9.9846 9.9846 10.4272 10.4272 10.4604 10.4604 11.0938 11.0938 11.0961 11.0961 11.2559 11.2559 11.2767 11.2767 16.2570 16.2570 16.2638 16.2638 k = 0.3860 0.2228 0.3063 ( 3804 PWs) bands (ev): -80.9599 -80.9599 -80.9599 -80.9599 -46.6573 -46.6573 -46.6567 -46.6567 -44.9476 -44.9476 -44.9475 -44.9475 -44.9021 -44.9021 -44.9015 -44.9015 -8.4863 -8.4863 -8.4840 -8.4840 4.1327 4.1327 4.1343 4.1343 5.5293 5.5293 5.5322 5.5322 5.6432 5.6432 5.6468 5.6468 9.6471 9.6471 9.6858 9.6858 9.9529 9.9529 9.9915 9.9915 10.3964 10.3964 10.4299 10.4299 11.0852 11.0852 11.0891 11.0891 11.2373 11.2373 11.2564 11.2564 16.3254 16.3254 16.3317 16.3317 k = 0.3947 0.2279 0.3063 ( 3808 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6574 -46.6574 -46.6569 -46.6569 -44.9479 -44.9479 -44.9478 -44.9478 -44.9021 -44.9021 -44.9015 -44.9015 -8.4796 -8.4796 -8.4774 -8.4774 4.1246 4.1246 4.1261 4.1261 5.5361 5.5361 5.5388 5.5388 5.6484 5.6484 5.6518 5.6518 9.6497 9.6497 9.6883 9.6883 9.9609 9.9609 9.9984 9.9984 10.3668 10.3668 10.4002 10.4002 11.0769 11.0769 11.0822 11.0822 11.2201 11.2201 11.2374 11.2374 16.3917 16.3917 16.3974 16.3974 k = 0.4035 0.2330 0.3063 ( 3808 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6575 -46.6575 -46.6570 -46.6570 -44.9481 -44.9481 -44.9480 -44.9480 -44.9021 -44.9021 -44.9016 -44.9016 -8.4732 -8.4732 -8.4712 -8.4712 4.1171 4.1171 4.1186 4.1186 5.5425 5.5425 5.5450 5.5450 5.6532 5.6532 5.6563 5.6563 9.6540 9.6540 9.6921 9.6921 9.9688 9.9688 10.0050 10.0050 10.3391 10.3391 10.3720 10.3720 11.0691 11.0691 11.0756 11.0756 11.2037 11.2037 11.2190 11.2190 16.4555 16.4555 16.4608 16.4608 k = 0.4123 0.2380 0.3063 ( 3816 PWs) bands (ev): -80.9602 -80.9602 -80.9602 -80.9602 -46.6576 -46.6576 -46.6572 -46.6572 -44.9483 -44.9483 -44.9482 -44.9482 -44.9022 -44.9022 -44.9017 -44.9017 -8.4674 -8.4674 -8.4655 -8.4655 4.1102 4.1102 4.1116 4.1116 5.5483 5.5483 5.5506 5.5506 5.6577 5.6577 5.6605 5.6605 9.6590 9.6590 9.6965 9.6965 9.9756 9.9756 10.0104 10.0104 10.3120 10.3120 10.3440 10.3440 11.0611 11.0611 11.0688 11.0688 11.1881 11.1881 11.2015 11.2015 16.5163 16.5163 16.5211 16.5211 k = 0.4211 0.2431 0.3063 ( 3816 PWs) bands (ev): -80.9602 -80.9602 -80.9602 -80.9602 -46.6577 -46.6577 -46.6573 -46.6573 -44.9485 -44.9485 -44.9484 -44.9484 -44.9022 -44.9022 -44.9017 -44.9017 -8.4620 -8.4620 -8.4603 -8.4603 4.1040 4.1040 4.1053 4.1053 5.5538 5.5538 5.5558 5.5558 5.6617 5.6617 5.6643 5.6643 9.6648 9.6648 9.7012 9.7012 9.9832 9.9832 10.0163 10.0163 10.2871 10.2871 10.3178 10.3178 11.0542 11.0542 11.0627 11.0627 11.1743 11.1743 11.1856 11.1856 16.5738 16.5738 16.5780 16.5780 k = 0.4298 0.2482 0.3063 ( 3816 PWs) bands (ev): -80.9602 -80.9602 -80.9602 -80.9602 -46.6578 -46.6578 -46.6574 -46.6574 -44.9487 -44.9487 -44.9486 -44.9486 -44.9021 -44.9021 -44.9018 -44.9018 -8.4571 -8.4571 -8.4556 -8.4556 4.0984 4.0984 4.0996 4.0996 5.5587 5.5587 5.5605 5.5605 5.6655 5.6655 5.6678 5.6678 9.6712 9.6712 9.7060 9.7060 9.9908 9.9908 10.0219 10.0219 10.2637 10.2637 10.2926 10.2926 11.0478 11.0478 11.0568 11.0568 11.1620 11.1620 11.1714 11.1714 16.6274 16.6274 16.6311 16.6311 k = 0.4386 0.2532 0.3063 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6578 -46.6578 -46.6575 -46.6575 -44.9488 -44.9488 -44.9487 -44.9487 -44.9021 -44.9021 -44.9018 -44.9018 -8.4528 -8.4528 -8.4515 -8.4515 4.0935 4.0935 4.0945 4.0945 5.5630 5.5630 5.5647 5.5647 5.6688 5.6688 5.6709 5.6709 9.6783 9.6783 9.7110 9.7110 9.9981 9.9981 10.0269 10.0269 10.2426 10.2426 10.2692 10.2692 11.0422 11.0422 11.0514 11.0514 11.1512 11.1512 11.1587 11.1587 16.6766 16.6766 16.6798 16.6798 k = 0.4474 0.2583 0.3063 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6579 -46.6579 -46.6576 -46.6576 -44.9489 -44.9489 -44.9489 -44.9489 -44.9021 -44.9021 -44.9018 -44.9018 -8.4490 -8.4490 -8.4479 -8.4479 4.0892 4.0893 4.0901 4.0901 5.5669 5.5669 5.5683 5.5683 5.6718 5.6718 5.6735 5.6735 9.6855 9.6855 9.7155 9.7155 10.0050 10.0050 10.0311 10.0311 10.2237 10.2237 10.2475 10.2475 11.0372 11.0372 11.0461 11.0461 11.1417 11.1417 11.1476 11.1476 16.7208 16.7208 16.7235 16.7235 k = 0.4561 0.2634 0.3063 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6579 -46.6579 -46.6577 -46.6577 -44.9490 -44.9490 -44.9490 -44.9490 -44.9021 -44.9021 -44.9019 -44.9019 -8.4457 -8.4457 -8.4448 -8.4448 4.0857 4.0857 4.0864 4.0864 5.5701 5.5701 5.5713 5.5713 5.6743 5.6743 5.6758 5.6758 9.6928 9.6928 9.7194 9.7194 10.0114 10.0114 10.0345 10.0345 10.2075 10.2075 10.2279 10.2279 11.0329 11.0329 11.0412 11.0412 11.1337 11.1337 11.1381 11.1381 16.7595 16.7595 16.7617 16.7617 k = 0.4649 0.2684 0.3063 ( 3812 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6579 -46.6579 -46.6577 -46.6577 -44.9491 -44.9491 -44.9491 -44.9491 -44.9021 -44.9021 -44.9019 -44.9019 -8.4430 -8.4430 -8.4423 -8.4423 4.0827 4.0827 4.0833 4.0833 5.5729 5.5729 5.5738 5.5738 5.6764 5.6764 5.6776 5.6776 9.7001 9.7001 9.7225 9.7225 10.0174 10.0174 10.0369 10.0369 10.1943 10.1943 10.2111 10.2111 11.0298 11.0298 11.0371 11.0371 11.1273 11.1273 11.1304 11.1304 16.7922 16.7922 16.7939 16.7939 k = 0.4737 0.2735 0.3063 ( 3806 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6579 -46.6579 -46.6577 -46.6577 -44.9491 -44.9491 -44.9491 -44.9491 -44.9020 -44.9020 -44.9019 -44.9019 -8.4409 -8.4409 -8.4403 -8.4403 4.0805 4.0805 4.0810 4.0810 5.5751 5.5751 5.5758 5.5758 5.6781 5.6781 5.6790 5.6790 9.7072 9.7072 9.7247 9.7247 10.0231 10.0231 10.0384 10.0384 10.1839 10.1839 10.1967 10.1967 11.0282 11.0282 11.0341 11.0341 11.1226 11.1226 11.1247 11.1247 16.8184 16.8184 16.8197 16.8197 k = 0.4825 0.2785 0.3063 ( 3812 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6579 -46.6579 -46.6578 -46.6578 -44.9492 -44.9492 -44.9492 -44.9492 -44.9020 -44.9020 -44.9019 -44.9019 -8.4394 -8.4394 -8.4390 -8.4390 4.0789 4.0789 4.0792 4.0792 5.5767 5.5767 5.5771 5.5771 5.6793 5.6793 5.6799 5.6799 9.7130 9.7130 9.7251 9.7251 10.0273 10.0273 10.0380 10.0380 10.1765 10.1765 10.1851 10.1851 11.0265 11.0265 11.0307 11.0307 11.1188 11.1188 11.1200 11.1200 16.8374 16.8374 16.8382 16.8382 k = 0.4912 0.2836 0.3063 ( 3808 PWs) bands (ev): -80.9599 -80.9599 -80.9599 -80.9599 -46.6579 -46.6579 -46.6578 -46.6578 -44.9492 -44.9492 -44.9492 -44.9492 -44.9020 -44.9020 -44.9019 -44.9019 -8.4384 -8.4384 -8.4382 -8.4382 4.0779 4.0779 4.0781 4.0781 5.5777 5.5777 5.5779 5.5779 5.6801 5.6801 5.6804 5.6804 9.7183 9.7183 9.7244 9.7244 10.0316 10.0316 10.0371 10.0371 10.1733 10.1733 10.1775 10.1775 11.0264 11.0264 11.0286 11.0286 11.1170 11.1170 11.1176 11.1176 16.8492 16.8492 16.8496 16.8496 k = 0.5000 0.2887 0.3063 ( 3804 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6578 -46.6578 -46.6578 -46.6578 -44.9492 -44.9492 -44.9492 -44.9492 -44.9019 -44.9019 -44.9019 -44.9019 -8.4380 -8.4380 -8.4380 -8.4380 4.0777 4.0777 4.0777 4.0777 5.5782 5.5782 5.5782 5.5782 5.6806 5.6806 5.6806 5.6806 9.7223 9.7223 9.7223 9.7223 10.0352 10.0352 10.0352 10.0352 10.1736 10.1736 10.1736 10.1736 11.0272 11.0272 11.0272 11.0272 11.1168 11.1168 11.1168 11.1168 16.8534 16.8534 16.8534 16.8534 k = 0.5000 0.2887 0.3063 ( 3804 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6578 -46.6578 -46.6578 -46.6578 -44.9492 -44.9492 -44.9492 -44.9492 -44.9019 -44.9019 -44.9019 -44.9019 -8.4380 -8.4380 -8.4380 -8.4380 4.0777 4.0777 4.0777 4.0777 5.5782 5.5782 5.5782 5.5782 5.6806 5.6806 5.6806 5.6806 9.7223 9.7223 9.7223 9.7223 10.0352 10.0352 10.0352 10.0352 10.1736 10.1736 10.1736 10.1736 11.0272 11.0272 11.0272 11.0272 11.1168 11.1168 11.1168 11.1168 16.8534 16.8534 16.8534 16.8534 k = 0.4949 0.2974 0.3063 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6579 -46.6579 -46.6578 -46.6578 -44.9494 -44.9494 -44.9492 -44.9492 -44.9021 -44.9021 -44.9020 -44.9020 -8.4381 -8.4381 -8.4377 -8.4377 4.0782 4.0782 4.0786 4.0786 5.5743 5.5743 5.5755 5.5755 5.6824 5.6824 5.6835 5.6835 9.7162 9.7162 9.7263 9.7263 10.0287 10.0287 10.0406 10.0406 10.1710 10.1710 10.1755 10.1755 11.0124 11.0124 11.0382 11.0382 11.1024 11.1024 11.1302 11.1302 16.8551 16.8551 16.8565 16.8565 k = 0.4899 0.3062 0.3063 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6580 -46.6580 -46.6578 -46.6578 -44.9495 -44.9495 -44.9491 -44.9491 -44.9021 -44.9021 -44.9019 -44.9019 -8.4380 -8.4380 -8.4373 -8.4373 4.0801 4.0801 4.0809 4.0809 5.5652 5.5652 5.5674 5.5674 5.6887 5.6887 5.6907 5.6907 9.7097 9.7097 9.7299 9.7299 10.0227 10.0227 10.0464 10.0464 10.1690 10.1690 10.1779 10.1779 10.9970 10.9970 11.0450 11.0450 11.0919 11.0919 11.1439 11.1439 16.8627 16.8627 16.8655 16.8655 k = 0.4848 0.3149 0.3063 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6581 -46.6581 -46.6578 -46.6578 -44.9496 -44.9496 -44.9490 -44.9490 -44.9022 -44.9022 -44.9019 -44.9019 -8.4378 -8.4378 -8.4367 -8.4367 4.0835 4.0835 4.0848 4.0848 5.5523 5.5523 5.5552 5.5552 5.6977 5.6977 5.7003 5.7003 9.7026 9.7026 9.7326 9.7326 10.0167 10.0167 10.0514 10.0514 10.1677 10.1677 10.1806 10.1806 10.9806 10.9806 11.0423 11.0423 11.0891 11.0891 11.1568 11.1568 16.8757 16.8757 16.8799 16.8799 k = 0.4798 0.3237 0.3063 ( 3810 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6581 -46.6581 -46.6577 -46.6577 -44.9497 -44.9497 -44.9489 -44.9489 -44.9022 -44.9022 -44.9018 -44.9018 -8.4373 -8.4373 -8.4359 -8.4359 4.0883 4.0883 4.0900 4.0900 5.5368 5.5368 5.5401 5.5401 5.7085 5.7085 5.7114 5.7114 9.6946 9.6946 9.7343 9.7343 10.0119 10.0119 10.0570 10.0570 10.1668 10.1668 10.1833 10.1833 10.9635 10.9635 11.0303 11.0303 11.0941 11.0941 11.1688 11.1688 16.8942 16.8942 16.8998 16.8998 k = 0.4747 0.3324 0.3063 ( 3810 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6582 -46.6582 -46.6577 -46.6577 -44.9498 -44.9498 -44.9488 -44.9488 -44.9023 -44.9023 -44.9018 -44.9018 -8.4368 -8.4368 -8.4349 -8.4349 4.0945 4.0945 4.0967 4.0967 5.5193 5.5193 5.5231 5.5231 5.7199 5.7199 5.7231 5.7231 9.6855 9.6855 9.7345 9.7345 10.0071 10.0071 10.0614 10.0614 10.1663 10.1663 10.1858 10.1858 10.9457 10.9457 11.0139 11.0139 11.1018 11.1018 11.1796 11.1796 16.9180 16.9180 16.9248 16.9248 k = 0.4697 0.3412 0.3063 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6583 -46.6583 -46.6577 -46.6577 -44.9500 -44.9500 -44.9487 -44.9487 -44.9024 -44.9024 -44.9018 -44.9018 -8.4360 -8.4360 -8.4338 -8.4338 4.1021 4.1021 4.1047 4.1047 5.5004 5.5004 5.5045 5.5045 5.7316 5.7316 5.7350 5.7350 9.6752 9.6752 9.7333 9.7333 10.0030 10.0030 10.0652 10.0652 10.1664 10.1664 10.1880 10.1880 10.9268 10.9268 10.9950 10.9950 11.1096 11.1096 11.1890 11.1890 16.9469 16.9469 16.9550 16.9550 k = 0.4646 0.3499 0.3063 ( 3822 PWs) bands (ev): -80.9603 -80.9603 -80.9603 -80.9603 -46.6584 -46.6584 -46.6577 -46.6577 -44.9501 -44.9501 -44.9487 -44.9487 -44.9025 -44.9025 -44.9018 -44.9018 -8.4351 -8.4351 -8.4325 -8.4325 4.1110 4.1110 4.1140 4.1140 5.4803 5.4803 5.4847 5.4847 5.7432 5.7432 5.7469 5.7469 9.6634 9.6634 9.7300 9.7300 9.9996 9.9996 10.0683 10.0683 10.1673 10.1673 10.1902 10.1902 10.9077 10.9077 10.9753 10.9753 11.1164 11.1164 11.1965 11.1965 16.9805 16.9805 16.9898 16.9898 k = 0.4596 0.3587 0.3063 ( 3818 PWs) bands (ev): -80.9602 -80.9602 -80.9602 -80.9602 -46.6584 -46.6584 -46.6577 -46.6577 -44.9503 -44.9503 -44.9486 -44.9486 -44.9025 -44.9025 -44.9018 -44.9018 -8.4340 -8.4340 -8.4311 -8.4311 4.1213 4.1213 4.1247 4.1247 5.4593 5.4593 5.4640 5.4640 5.7548 5.7548 5.7586 5.7586 9.6510 9.6510 9.7254 9.7254 9.9981 9.9981 10.0714 10.0714 10.1698 10.1698 10.1932 10.1932 10.8892 10.8892 10.9561 10.9561 11.1234 11.1234 11.2039 11.2039 17.0192 17.0192 17.0296 17.0296 k = 0.4545 0.3674 0.3063 ( 3818 PWs) bands (ev): -80.9602 -80.9602 -80.9602 -80.9602 -46.6585 -46.6585 -46.6576 -46.6576 -44.9504 -44.9504 -44.9485 -44.9485 -44.9026 -44.9026 -44.9018 -44.9018 -8.4328 -8.4328 -8.4296 -8.4296 4.1329 4.1329 4.1368 4.1368 5.4373 5.4373 5.4424 5.4424 5.7661 5.7661 5.7701 5.7701 9.6376 9.6376 9.7191 9.7191 9.9975 9.9975 10.0737 10.0737 10.1730 10.1730 10.1961 10.1961 10.8701 10.8701 10.9361 10.9361 11.1291 11.1291 11.2098 11.2098 17.0624 17.0624 17.0740 17.0740 k = 0.4495 0.3762 0.3063 ( 3814 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6585 -46.6585 -46.6576 -46.6576 -44.9505 -44.9505 -44.9485 -44.9485 -44.9026 -44.9026 -44.9017 -44.9017 -8.4315 -8.4315 -8.4279 -8.4279 4.1458 4.1458 4.1500 4.1500 5.4145 5.4145 5.4199 5.4199 5.7772 5.7772 5.7813 5.7813 9.6229 9.6229 9.7107 9.7107 9.9983 9.9983 10.0758 10.0758 10.1774 10.1774 10.1996 10.1996 10.8516 10.8516 10.9166 10.9166 11.1344 11.1344 11.2149 11.2149 17.1099 17.1099 17.1225 17.1225 k = 0.4444 0.3849 0.3063 ( 3810 PWs) bands (ev): -80.9599 -80.9599 -80.9599 -80.9599 -46.6586 -46.6586 -46.6575 -46.6575 -44.9506 -44.9506 -44.9484 -44.9484 -44.9027 -44.9027 -44.9017 -44.9017 -8.4300 -8.4300 -8.4261 -8.4261 4.1599 4.1599 4.1646 4.1646 5.3910 5.3910 5.3968 5.3968 5.7879 5.7879 5.7921 5.7921 9.6068 9.6068 9.7003 9.7003 10.0005 10.0005 10.0779 10.0779 10.1828 10.1828 10.2038 10.2038 10.8332 10.8332 10.8973 10.8973 11.1385 11.1385 11.2188 11.2188 17.1614 17.1614 17.1750 17.1750 k = 0.4394 0.3936 0.3063 ( 3812 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6587 -46.6587 -46.6576 -46.6576 -44.9507 -44.9507 -44.9484 -44.9484 -44.9027 -44.9027 -44.9017 -44.9017 -8.4284 -8.4284 -8.4242 -8.4242 4.1752 4.1752 4.1803 4.1803 5.3668 5.3668 5.3728 5.3728 5.7982 5.7982 5.8026 5.8026 9.5896 9.5896 9.6880 9.6880 10.0034 10.0034 10.0795 10.0795 10.1881 10.1881 10.2081 10.2081 10.8145 10.8145 10.8775 10.8775 11.1412 11.1412 11.2209 11.2209 17.2167 17.2167 17.2312 17.2312 k = 0.4343 0.4024 0.3063 ( 3812 PWs) bands (ev): -80.9600 -80.9600 -80.9600 -80.9600 -46.6587 -46.6587 -46.6575 -46.6575 -44.9509 -44.9509 -44.9483 -44.9483 -44.9028 -44.9028 -44.9017 -44.9017 -8.4267 -8.4267 -8.4222 -8.4222 4.1917 4.1917 4.1971 4.1971 5.3419 5.3419 5.3482 5.3482 5.8081 5.8081 5.8127 5.8127 9.5715 9.5715 9.6742 9.6742 10.0074 10.0074 10.0813 10.0813 10.1935 10.1935 10.2137 10.2137 10.7963 10.7963 10.8581 10.8581 11.1433 11.1433 11.2223 11.2223 17.2754 17.2754 17.2908 17.2908 k = 0.4293 0.4111 0.3063 ( 3800 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6587 -46.6587 -46.6574 -46.6574 -44.9509 -44.9509 -44.9482 -44.9482 -44.9028 -44.9028 -44.9016 -44.9016 -8.4250 -8.4250 -8.4202 -8.4202 4.2092 4.2092 4.2150 4.2150 5.3165 5.3165 5.3232 5.3232 5.8177 5.8177 5.8224 5.8224 9.5534 9.5534 9.6597 9.6597 10.0126 10.0126 10.0839 10.0839 10.1993 10.1993 10.2214 10.2214 10.7790 10.7790 10.8399 10.8399 11.1456 11.1456 11.2238 11.2238 17.3377 17.3377 17.3539 17.3539 k = 0.4242 0.4199 0.3063 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6588 -46.6588 -46.6575 -46.6575 -44.9511 -44.9511 -44.9482 -44.9482 -44.9029 -44.9029 -44.9017 -44.9017 -8.4231 -8.4231 -8.4180 -8.4180 4.2278 4.2278 4.2340 4.2340 5.2905 5.2905 5.2974 5.2974 5.8268 5.8268 5.8317 5.8317 9.5335 9.5335 9.6429 9.6429 10.0177 10.0177 10.0863 10.0863 10.2040 10.2040 10.2295 10.2295 10.7612 10.7612 10.8208 10.8208 11.1457 11.1457 11.2228 11.2228 17.4025 17.4025 17.4194 17.4194 k = 0.4192 0.4286 0.3063 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6589 -46.6589 -46.6575 -46.6575 -44.9512 -44.9512 -44.9482 -44.9482 -44.9030 -44.9030 -44.9016 -44.9016 -8.4212 -8.4212 -8.4159 -8.4159 4.2473 4.2473 4.2538 4.2538 5.2640 5.2640 5.2713 5.2713 5.8356 5.8356 5.8406 5.8406 9.5132 9.5132 9.6255 9.6255 10.0230 10.0230 10.0893 10.0893 10.2088 10.2088 10.2391 10.2391 10.7439 10.7439 10.8024 10.8024 11.1452 11.1452 11.2211 11.2211 17.4700 17.4700 17.4877 17.4877 k = 0.4141 0.4374 0.3063 ( 3800 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6589 -46.6589 -46.6574 -46.6574 -44.9513 -44.9513 -44.9481 -44.9481 -44.9030 -44.9030 -44.9016 -44.9016 -8.4193 -8.4193 -8.4137 -8.4137 4.2677 4.2677 4.2746 4.2746 5.2371 5.2371 5.2447 5.2447 5.8440 5.8440 5.8491 5.8491 9.4932 9.4932 9.6078 9.6078 10.0285 10.0285 10.0931 10.0931 10.2138 10.2138 10.2500 10.2500 10.7272 10.7272 10.7845 10.7845 11.1445 11.1445 11.2192 11.2192 17.5398 17.5398 17.5582 17.5582 k = 0.4091 0.4461 0.3063 ( 3800 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6590 -46.6590 -46.6575 -46.6575 -44.9514 -44.9514 -44.9481 -44.9481 -44.9031 -44.9031 -44.9016 -44.9016 -8.4173 -8.4173 -8.4115 -8.4115 4.2889 4.2889 4.2962 4.2962 5.2098 5.2098 5.2176 5.2176 5.8519 5.8519 5.8572 5.8572 9.4724 9.4724 9.5891 9.5891 10.0337 10.0337 10.0974 10.0974 10.2191 10.2191 10.2617 10.2617 10.7107 10.7107 10.7668 10.7668 11.1428 11.1428 11.2161 11.2161 17.6115 17.6115 17.6305 17.6305 k = 0.4040 0.4549 0.3063 ( 3796 PWs) bands (ev): -80.9595 -80.9595 -80.9595 -80.9595 -46.6590 -46.6590 -46.6574 -46.6574 -44.9515 -44.9515 -44.9481 -44.9481 -44.9031 -44.9031 -44.9016 -44.9016 -8.4154 -8.4154 -8.4093 -8.4093 4.3108 4.3108 4.3184 4.3184 5.1823 5.1823 5.1904 5.1904 5.8595 5.8595 5.8649 5.8649 9.4521 9.4521 9.5706 9.5706 10.0384 10.0384 10.1024 10.1024 10.2250 10.2250 10.2743 10.2743 10.6947 10.6947 10.7497 10.7497 11.1410 11.1410 11.2128 11.2128 17.6848 17.6848 17.7044 17.7044 k = 0.3990 0.4636 0.3063 ( 3796 PWs) bands (ev): -80.9595 -80.9595 -80.9595 -80.9595 -46.6591 -46.6591 -46.6574 -46.6574 -44.9516 -44.9516 -44.9481 -44.9481 -44.9032 -44.9032 -44.9016 -44.9016 -8.4134 -8.4134 -8.4071 -8.4071 4.3333 4.3333 4.3413 4.3413 5.1546 5.1546 5.1629 5.1629 5.8666 5.8666 5.8721 5.8721 9.4317 9.4317 9.5517 9.5517 10.0425 10.0425 10.1077 10.1077 10.2315 10.2315 10.2876 10.2876 10.6788 10.6788 10.7327 10.7327 11.1383 11.1383 11.2086 11.2086 17.7593 17.7593 17.7795 17.7795 k = 0.3939 0.4724 0.3063 ( 3800 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6592 -46.6592 -46.6575 -46.6575 -44.9518 -44.9518 -44.9481 -44.9481 -44.9033 -44.9033 -44.9017 -44.9017 -8.4115 -8.4115 -8.4050 -8.4050 4.3563 4.3563 4.3646 4.3646 5.1269 5.1269 5.1353 5.1353 5.8732 5.8732 5.8789 5.8789 9.4117 9.4117 9.5330 9.5330 10.0458 10.0458 10.1131 10.1131 10.2384 10.2384 10.3012 10.3012 10.6627 10.6627 10.7156 10.7156 11.1352 11.1352 11.2038 11.2038 17.8345 17.8345 17.8553 17.8553 k = 0.3889 0.4811 0.3063 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6593 -46.6593 -46.6575 -46.6575 -44.9519 -44.9519 -44.9481 -44.9481 -44.9034 -44.9034 -44.9017 -44.9017 -8.4096 -8.4096 -8.4029 -8.4029 4.3797 4.3797 4.3882 4.3882 5.0992 5.0992 5.1078 5.1078 5.8794 5.8794 5.8851 5.8851 9.3923 9.3923 9.5148 9.5148 10.0489 10.0489 10.1184 10.1184 10.2469 10.2469 10.3157 10.3157 10.6466 10.6466 10.6986 10.6986 11.1314 11.1314 11.1984 11.1984 17.9103 17.9103 17.9316 17.9316 k = 0.3838 0.4899 0.3063 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6594 -46.6594 -46.6576 -46.6576 -44.9520 -44.9520 -44.9481 -44.9481 -44.9034 -44.9034 -44.9017 -44.9017 -8.4078 -8.4078 -8.4009 -8.4009 4.4032 4.4032 4.4120 4.4120 5.0718 5.0718 5.0805 5.0805 5.8851 5.8851 5.8910 5.8910 9.3740 9.3740 9.4975 9.4975 10.0514 10.0514 10.1236 10.1236 10.2562 10.2562 10.3307 10.3307 10.6312 10.6312 10.6825 10.6825 11.1280 11.1280 11.1933 11.1933 17.9860 17.9860 18.0078 18.0078 k = 0.3788 0.4986 0.3063 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6594 -46.6594 -46.6576 -46.6576 -44.9521 -44.9521 -44.9481 -44.9481 -44.9035 -44.9035 -44.9017 -44.9017 -8.4060 -8.4060 -8.3990 -8.3990 4.4267 4.4267 4.4359 4.4359 5.0447 5.0447 5.0536 5.0536 5.8904 5.8904 5.8963 5.8963 9.3570 9.3570 9.4813 9.4813 10.0534 10.0534 10.1282 10.1282 10.2664 10.2664 10.3461 10.3461 10.6159 10.6159 10.6666 10.6666 11.1245 11.1245 11.1882 11.1882 18.0613 18.0613 18.0835 18.0835 k = 0.3737 0.5074 0.3063 ( 3808 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6595 -46.6595 -46.6576 -46.6576 -44.9522 -44.9522 -44.9482 -44.9482 -44.9035 -44.9035 -44.9018 -44.9018 -8.4044 -8.4044 -8.3973 -8.3972 4.4500 4.4500 4.4594 4.4594 5.0183 5.0183 5.0273 5.0273 5.8951 5.8951 5.9012 5.9012 9.3408 9.3408 9.4658 9.4658 10.0549 10.0550 10.1322 10.1322 10.2772 10.2772 10.3617 10.3617 10.6004 10.6004 10.6507 10.6507 11.1207 11.1207 11.1828 11.1828 18.1354 18.1354 18.1580 18.1580 k = 0.3687 0.5161 0.3063 ( 3796 PWs) bands (ev): -80.9594 -80.9594 -80.9594 -80.9594 -46.6594 -46.6594 -46.6575 -46.6575 -44.9522 -44.9522 -44.9481 -44.9481 -44.9035 -44.9035 -44.9017 -44.9017 -8.4029 -8.4029 -8.3956 -8.3956 4.4728 4.4728 4.4825 4.4825 4.9930 4.9930 5.0019 5.0019 5.8995 5.8995 5.9057 5.9057 9.3269 9.3269 9.4525 9.4525 10.0569 10.0569 10.1362 10.1362 10.2901 10.2901 10.3786 10.3786 10.5862 10.5862 10.6362 10.6362 11.1182 11.1182 11.1788 11.1788 18.2079 18.2079 18.2308 18.2308 k = 0.3636 0.5249 0.3063 ( 3796 PWs) bands (ev): -80.9594 -80.9594 -80.9594 -80.9594 -46.6595 -46.6595 -46.6575 -46.6575 -44.9523 -44.9523 -44.9481 -44.9481 -44.9035 -44.9035 -44.9017 -44.9017 -8.4015 -8.4015 -8.3941 -8.3941 4.4947 4.4947 4.5046 4.5046 4.9688 4.9688 4.9777 4.9777 5.9032 5.9032 5.9095 5.9095 9.3142 9.3142 9.4404 9.4404 10.0580 10.0580 10.1391 10.1391 10.3023 10.3023 10.3948 10.3948 10.5709 10.5709 10.6209 10.6209 11.1151 11.1151 11.1744 11.1744 18.2776 18.2776 18.3007 18.3007 k = 0.3586 0.5336 0.3063 ( 3788 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6594 -46.6594 -46.6575 -46.6575 -44.9523 -44.9523 -44.9481 -44.9481 -44.9035 -44.9035 -44.9017 -44.9017 -8.4003 -8.4003 -8.3928 -8.3928 4.5151 4.5151 4.5254 4.5254 4.9464 4.9464 4.9553 4.9553 5.9065 5.9065 5.9128 5.9128 9.3036 9.3036 9.4302 9.4302 10.0593 10.0593 10.1418 10.1418 10.3153 10.3153 10.4119 10.4119 10.5567 10.5567 10.6069 10.6069 11.1126 11.1126 11.1706 11.1706 18.3433 18.3433 18.3666 18.3666 k = 0.3535 0.5424 0.3063 ( 3784 PWs) bands (ev): -80.9590 -80.9590 -80.9590 -80.9590 -46.6594 -46.6594 -46.6575 -46.6575 -44.9523 -44.9523 -44.9480 -44.9480 -44.9035 -44.9035 -44.9017 -44.9017 -8.3992 -8.3992 -8.3917 -8.3917 4.5336 4.5336 4.5441 4.5441 4.9264 4.9264 4.9352 4.9352 5.9092 5.9092 5.9155 5.9155 9.2948 9.2948 9.4218 9.4218 10.0598 10.0598 10.1433 10.1433 10.3278 10.3278 10.4284 10.4284 10.5425 10.5425 10.5931 10.5931 11.1105 11.1105 11.1675 11.1675 18.4034 18.4034 18.4267 18.4267 k = 0.3485 0.5511 0.3063 ( 3788 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6595 -46.6595 -46.6575 -46.6575 -44.9523 -44.9523 -44.9481 -44.9481 -44.9036 -44.9036 -44.9017 -44.9017 -8.3984 -8.3984 -8.3908 -8.3908 4.5494 4.5494 4.5600 4.5600 4.9094 4.9094 4.9181 4.9181 5.9112 5.9112 5.9177 5.9177 9.2874 9.2874 9.4146 9.4146 10.0597 10.0597 10.1440 10.1440 10.3387 10.3387 10.4445 10.4445 10.5281 10.5281 10.5796 10.5796 11.1083 11.1083 11.1645 11.1645 18.4555 18.4555 18.4787 18.4787 k = 0.3434 0.5599 0.3063 ( 3794 PWs) bands (ev): -80.9593 -80.9593 -80.9593 -80.9593 -46.6595 -46.6595 -46.6576 -46.6576 -44.9524 -44.9524 -44.9481 -44.9481 -44.9036 -44.9036 -44.9017 -44.9017 -8.3978 -8.3978 -8.3902 -8.3902 4.5614 4.5614 4.5723 4.5723 4.8965 4.8965 4.9050 4.9050 5.9127 5.9127 5.9192 5.9192 9.2816 9.2816 9.4090 9.4090 10.0598 10.0598 10.1446 10.1446 10.3473 10.3473 10.4595 10.4595 10.5144 10.5144 10.5681 10.5681 11.1062 11.1062 11.1619 11.1619 18.4970 18.4970 18.5199 18.5199 k = 0.3384 0.5686 0.3063 ( 3786 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6595 -46.6595 -46.6575 -46.6575 -44.9524 -44.9524 -44.9481 -44.9481 -44.9036 -44.9036 -44.9017 -44.9017 -8.3974 -8.3974 -8.3898 -8.3898 4.5691 4.5691 4.5801 4.5801 4.8883 4.8883 4.8968 4.8968 5.9137 5.9137 5.9202 5.9202 9.2791 9.2791 9.4066 9.4066 10.0602 10.0602 10.1453 10.1453 10.3543 10.3543 10.4748 10.4748 10.5021 10.5021 10.5603 10.5603 11.1059 11.1059 11.1612 11.1612 18.5245 18.5245 18.5473 18.5473 k = 0.3333 0.5774 0.3063 ( 3786 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6595 -46.6595 -46.6575 -46.6575 -44.9524 -44.9524 -44.9481 -44.9481 -44.9036 -44.9036 -44.9017 -44.9017 -8.3973 -8.3973 -8.3896 -8.3896 4.5718 4.5718 4.5828 4.5828 4.8856 4.8856 4.8940 4.8940 5.9140 5.9140 5.9205 5.9205 9.2780 9.2780 9.4056 9.4056 10.0602 10.0602 10.1454 10.1454 10.3566 10.3566 10.4853 10.4853 10.4924 10.4924 10.5573 10.5573 11.1055 11.1055 11.1607 11.1607 18.5342 18.5342 18.5570 18.5570 k = 0.3333 0.5774 0.3063 ( 3786 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6595 -46.6595 -46.6575 -46.6575 -44.9524 -44.9524 -44.9481 -44.9481 -44.9036 -44.9036 -44.9017 -44.9017 -8.3973 -8.3973 -8.3896 -8.3896 4.5718 4.5718 4.5828 4.5828 4.8856 4.8856 4.8940 4.8940 5.9140 5.9140 5.9205 5.9205 9.2780 9.2780 9.4056 9.4056 10.0602 10.0602 10.1454 10.1454 10.3566 10.3566 10.4853 10.4853 10.4924 10.4924 10.5573 10.5573 11.1055 11.1055 11.1607 11.1607 18.5342 18.5342 18.5570 18.5570 k = 0.3283 0.5686 0.3063 ( 3790 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6595 -46.6595 -46.6575 -46.6575 -44.9524 -44.9524 -44.9481 -44.9481 -44.9036 -44.9036 -44.9017 -44.9017 -8.3974 -8.3974 -8.3898 -8.3898 4.5692 4.5692 4.5802 4.5802 4.8883 4.8883 4.8967 4.8967 5.9137 5.9137 5.9201 5.9201 9.2788 9.2788 9.4063 9.4063 10.0600 10.0600 10.1451 10.1451 10.3539 10.3539 10.4746 10.4746 10.5017 10.5017 10.5602 10.5602 11.1056 11.1056 11.1609 11.1609 18.5240 18.5240 18.5468 18.5468 k = 0.3232 0.5599 0.3063 ( 3786 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6595 -46.6595 -46.6575 -46.6575 -44.9523 -44.9523 -44.9481 -44.9481 -44.9035 -44.9035 -44.9017 -44.9017 -8.3978 -8.3978 -8.3902 -8.3902 4.5620 4.5620 4.5728 4.5728 4.8960 4.8960 4.9046 4.9046 5.9127 5.9127 5.9192 5.9192 9.2821 9.2821 9.4095 9.4095 10.0605 10.0605 10.1453 10.1453 10.3472 10.3472 10.4603 10.4603 10.5145 10.5145 10.5692 10.5692 11.1068 11.1068 11.1624 11.1624 18.4940 18.4940 18.5169 18.5169 k = 0.3182 0.5511 0.3063 ( 3786 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6595 -46.6595 -46.6575 -46.6575 -44.9523 -44.9523 -44.9481 -44.9481 -44.9035 -44.9035 -44.9017 -44.9017 -8.3985 -8.3985 -8.3910 -8.3910 4.5509 4.5509 4.5615 4.5615 4.9080 4.9080 4.9166 4.9166 5.9112 5.9112 5.9176 5.9176 9.2873 9.2873 9.4145 9.4145 10.0606 10.0606 10.1448 10.1448 10.3366 10.3366 10.4447 10.4447 10.5277 10.5277 10.5818 10.5818 11.1086 11.1086 11.1648 11.1648 18.4464 18.4464 18.4691 18.4691 k = 0.3131 0.5424 0.3063 ( 3792 PWs) bands (ev): -80.9593 -80.9593 -80.9593 -80.9593 -46.6595 -46.6595 -46.6575 -46.6575 -44.9523 -44.9523 -44.9481 -44.9481 -44.9035 -44.9035 -44.9017 -44.9017 -8.3996 -8.3996 -8.3921 -8.3921 4.5368 4.5368 4.5473 4.5473 4.9231 4.9231 4.9319 4.9319 5.9090 5.9090 5.9153 5.9153 9.2942 9.2942 9.4210 9.4210 10.0604 10.0604 10.1436 10.1436 10.3231 10.3231 10.4281 10.4281 10.5418 10.5418 10.5961 10.5961 11.1111 11.1111 11.1679 11.1679 18.3841 18.3841 18.4066 18.4066 k = 0.3081 0.5336 0.3063 ( 3804 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6596 -46.6596 -46.6576 -46.6576 -44.9524 -44.9524 -44.9482 -44.9482 -44.9036 -44.9036 -44.9017 -44.9017 -8.4010 -8.4010 -8.3935 -8.3935 4.5208 4.5208 4.5310 4.5310 4.9405 4.9405 4.9494 4.9494 5.9061 5.9061 5.9124 5.9124 9.3025 9.3025 9.4289 9.4289 10.0603 10.0603 10.1422 10.1422 10.3075 10.3075 10.4104 10.4104 10.5568 10.5568 10.6115 10.6115 11.1138 11.1138 11.1714 11.1714 18.3105 18.3105 18.3327 18.3327 k = 0.3030 0.5249 0.3063 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6595 -46.6595 -46.6576 -46.6576 -44.9523 -44.9523 -44.9482 -44.9482 -44.9035 -44.9035 -44.9017 -44.9017 -8.4027 -8.4027 -8.3953 -8.3953 4.5035 4.5035 4.5134 4.5134 4.9595 4.9595 4.9686 4.9686 5.9027 5.9027 5.9089 5.9089 9.3137 9.3137 9.4395 9.4395 10.0607 10.0607 10.1406 10.1406 10.2920 10.2920 10.3934 10.3934 10.5734 10.5734 10.6281 10.6281 11.1182 11.1182 11.1768 11.1768 18.2289 18.2289 18.2506 18.2506 k = 0.2980 0.5161 0.3063 ( 3808 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6595 -46.6595 -46.6576 -46.6576 -44.9522 -44.9522 -44.9481 -44.9481 -44.9036 -44.9036 -44.9018 -44.9018 -8.4047 -8.4047 -8.3974 -8.3974 4.4856 4.4856 4.4952 4.4952 4.9795 4.9795 4.9887 4.9887 5.8986 5.8986 5.9047 5.9047 9.3266 9.3266 9.4516 9.4516 10.0609 10.0609 10.1380 10.1380 10.2766 10.2766 10.3763 10.3763 10.5903 10.5903 10.6447 10.6447 11.1232 11.1232 11.1830 11.1830 18.1410 18.1410 18.1622 18.1622 k = 0.2929 0.5074 0.3063 ( 3806 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6594 -46.6594 -46.6575 -46.6575 -44.9521 -44.9521 -44.9480 -44.9480 -44.9035 -44.9035 -44.9018 -44.9018 -8.4072 -8.4072 -8.3999 -8.3999 4.4675 4.4675 4.4768 4.4768 5.0002 5.0002 5.0095 5.0095 5.8938 5.8938 5.8999 5.8999 9.3418 9.3418 9.4658 9.4658 10.0616 10.0616 10.1349 10.1349 10.2623 10.2623 10.3600 10.3600 10.6080 10.6080 10.6617 10.6617 11.1293 11.1293 11.1904 11.1904 18.0487 18.0487 18.0693 18.0693 k = 0.2879 0.4986 0.3063 ( 3806 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6594 -46.6594 -46.6575 -46.6575 -44.9520 -44.9520 -44.9480 -44.9480 -44.9035 -44.9035 -44.9017 -44.9017 -8.4100 -8.4100 -8.4028 -8.4028 4.4494 4.4494 4.4584 4.4584 5.0210 5.0210 5.0303 5.0303 5.8886 5.8886 5.8946 5.8946 9.3577 9.3577 9.4806 9.4806 10.0623 10.0623 10.1304 10.1304 10.2491 10.2491 10.3442 10.3442 10.6262 10.6262 10.6793 10.6793 11.1365 11.1365 11.1988 11.1988 17.9529 17.9529 17.9730 17.9730 k = 0.2828 0.4899 0.3063 ( 3810 PWs) bands (ev): -80.9599 -80.9599 -80.9599 -80.9599 -46.6593 -46.6593 -46.6575 -46.6575 -44.9519 -44.9519 -44.9480 -44.9480 -44.9035 -44.9035 -44.9017 -44.9017 -8.4131 -8.4131 -8.4061 -8.4061 4.4317 4.4317 4.4403 4.4403 5.0418 5.0418 5.0512 5.0512 5.8827 5.8827 5.8885 5.8885 9.3746 9.3746 9.4960 9.4960 10.0629 10.0629 10.1241 10.1241 10.2382 10.2382 10.3294 10.3294 10.6445 10.6445 10.6966 10.6966 11.1438 11.1438 11.2074 11.2074 17.8546 17.8546 17.8742 17.8742 k = 0.2778 0.4811 0.3063 ( 3806 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6592 -46.6592 -46.6574 -46.6574 -44.9517 -44.9517 -44.9479 -44.9479 -44.9034 -44.9034 -44.9017 -44.9017 -8.4167 -8.4167 -8.4098 -8.4098 4.4146 4.4146 4.4229 4.4229 5.0624 5.0624 5.0718 5.0718 5.8762 5.8762 5.8819 5.8819 9.3931 9.3931 9.5128 9.5128 10.0633 10.0633 10.1166 10.1166 10.2306 10.2306 10.3170 10.3170 10.6636 10.6636 10.7146 10.7146 11.1523 11.1523 11.2173 11.2173 17.7547 17.7547 17.7737 17.7737 k = 0.2727 0.4724 0.3063 ( 3806 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6591 -46.6591 -46.6574 -46.6574 -44.9515 -44.9515 -44.9478 -44.9478 -44.9033 -44.9033 -44.9016 -44.9016 -8.4206 -8.4206 -8.4139 -8.4139 4.3982 4.3982 4.4062 4.4062 5.0826 5.0826 5.0920 5.0920 5.8692 5.8692 5.8748 5.8748 9.4123 9.4123 9.5300 9.5300 10.0618 10.0618 10.1075 10.1075 10.2258 10.2258 10.3072 10.3072 10.6825 10.6825 10.7322 10.7322 11.1614 11.1614 11.2278 11.2278 17.6535 17.6535 17.6720 17.6720 k = 0.2677 0.4636 0.3063 ( 3810 PWs) bands (ev): -80.9599 -80.9599 -80.9599 -80.9599 -46.6591 -46.6591 -46.6573 -46.6573 -44.9514 -44.9514 -44.9477 -44.9477 -44.9033 -44.9033 -44.9016 -44.9016 -8.4250 -8.4250 -8.4184 -8.4184 4.3826 4.3826 4.3902 4.3902 5.1023 5.1023 5.1117 5.1117 5.8615 5.8615 5.8670 5.8670 9.4317 9.4317 9.5470 9.5470 10.0573 10.0573 10.0985 10.0985 10.2233 10.2233 10.3004 10.3004 10.7010 10.7010 10.7495 10.7495 11.1711 11.1711 11.2388 11.2388 17.5514 17.5514 17.5693 17.5693 k = 0.2626 0.4549 0.3063 ( 3806 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6589 -46.6589 -46.6572 -46.6572 -44.9511 -44.9511 -44.9476 -44.9476 -44.9032 -44.9032 -44.9016 -44.9016 -8.4297 -8.4297 -8.4232 -8.4232 4.3679 4.3679 4.3752 4.3752 5.1214 5.1214 5.1308 5.1308 5.8534 5.8534 5.8587 5.8587 9.4521 9.4521 9.5647 9.5647 10.0491 10.0491 10.0911 10.0911 10.2245 10.2245 10.2988 10.2988 10.7200 10.7200 10.7671 10.7671 11.1817 11.1817 11.2508 11.2508 17.4490 17.4490 17.4664 17.4664 k = 0.2576 0.4461 0.3063 ( 3802 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6588 -46.6588 -46.6571 -46.6571 -44.9509 -44.9509 -44.9474 -44.9474 -44.9032 -44.9032 -44.9016 -44.9016 -8.4348 -8.4348 -8.4285 -8.4285 4.3543 4.3543 4.3613 4.3613 5.1398 5.1398 5.1492 5.1492 5.8447 5.8447 5.8499 5.8499 9.4725 9.4725 9.5818 9.5818 10.0374 10.0374 10.0848 10.0848 10.2284 10.2284 10.3016 10.3016 10.7391 10.7391 10.7847 10.7847 11.1928 11.1928 11.2634 11.2634 17.3462 17.3462 17.3633 17.3633 k = 0.2525 0.4374 0.3063 ( 3802 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6587 -46.6587 -46.6570 -46.6570 -44.9507 -44.9507 -44.9473 -44.9473 -44.9031 -44.9031 -44.9015 -44.9015 -8.4403 -8.4403 -8.4341 -8.4341 4.3418 4.3418 4.3484 4.3484 5.1574 5.1574 5.1668 5.1668 5.8355 5.8355 5.8406 5.8406 9.4922 9.4922 9.5981 9.5981 10.0227 10.0227 10.0776 10.0776 10.2361 10.2361 10.3095 10.3095 10.7580 10.7580 10.8020 10.8020 11.2042 11.2042 11.2762 11.2762 17.2434 17.2434 17.2601 17.2601 k = 0.2475 0.4286 0.3063 ( 3804 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6586 -46.6586 -46.6570 -46.6570 -44.9504 -44.9504 -44.9472 -44.9472 -44.9030 -44.9030 -44.9015 -44.9015 -8.4462 -8.4462 -8.4402 -8.4402 4.3303 4.3303 4.3366 4.3366 5.1742 5.1742 5.1835 5.1835 5.8258 5.8258 5.8308 5.8308 9.5115 9.5115 9.6136 9.6136 10.0065 10.0065 10.0688 10.0688 10.2473 10.2473 10.3211 10.3211 10.7767 10.7767 10.8193 10.8193 11.2161 11.2161 11.2894 11.2894 17.1407 17.1407 17.1570 17.1570 k = 0.2424 0.4199 0.3063 ( 3812 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6585 -46.6585 -46.6569 -46.6569 -44.9502 -44.9502 -44.9471 -44.9471 -44.9030 -44.9030 -44.9015 -44.9015 -8.4525 -8.4525 -8.4466 -8.4466 4.3200 4.3200 4.3260 4.3260 5.1901 5.1901 5.1994 5.1994 5.8155 5.8155 5.8205 5.8205 9.5299 9.5299 9.6278 9.6278 9.9895 9.9895 10.0581 10.0581 10.2619 10.2619 10.3360 10.3360 10.7952 10.7952 10.8362 10.8362 11.2282 11.2282 11.3029 11.3029 17.0382 17.0382 17.0541 17.0541 k = 0.2374 0.4111 0.3063 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9601 -80.9601 -46.6584 -46.6584 -46.6568 -46.6568 -44.9500 -44.9500 -44.9469 -44.9469 -44.9030 -44.9030 -44.9015 -44.9015 -8.4592 -8.4592 -8.4534 -8.4534 4.3109 4.3109 4.3166 4.3166 5.2051 5.2051 5.2144 5.2144 5.8049 5.8049 5.8098 5.8098 9.5477 9.5477 9.6413 9.6413 9.9733 9.9733 10.0470 10.0470 10.2812 10.2812 10.3553 10.3553 10.8136 10.8136 10.8530 10.8530 11.2405 11.2405 11.3166 11.3166 16.9361 16.9361 16.9518 16.9518 k = 0.2323 0.4024 0.3063 ( 3818 PWs) bands (ev): -80.9603 -80.9603 -80.9603 -80.9603 -46.6583 -46.6583 -46.6568 -46.6568 -44.9497 -44.9497 -44.9468 -44.9468 -44.9029 -44.9029 -44.9015 -44.9015 -8.4662 -8.4662 -8.4605 -8.4605 4.3030 4.3030 4.3084 4.3084 5.2192 5.2192 5.2285 5.2285 5.7938 5.7938 5.7987 5.7987 9.5644 9.5644 9.6537 9.6537 9.9572 9.9572 10.0349 10.0349 10.3034 10.3034 10.3772 10.3772 10.8321 10.8321 10.8701 10.8701 11.2533 11.2533 11.3307 11.3307 16.8346 16.8346 16.8500 16.8500 k = 0.2273 0.3936 0.3063 ( 3822 PWs) bands (ev): -80.9604 -80.9604 -80.9604 -80.9604 -46.6581 -46.6581 -46.6567 -46.6567 -44.9494 -44.9494 -44.9466 -44.9466 -44.9029 -44.9029 -44.9015 -44.9015 -8.4735 -8.4735 -8.4680 -8.4680 4.2964 4.2964 4.3014 4.3014 5.2325 5.2325 5.2416 5.2416 5.7824 5.7824 5.7872 5.7872 9.5802 9.5802 9.6652 9.6652 9.9410 9.9410 10.0218 10.0218 10.3288 10.3288 10.4020 10.4020 10.8508 10.8508 10.8872 10.8872 11.2667 11.2667 11.3453 11.3453 16.7336 16.7336 16.7489 16.7489 k = 0.2222 0.3849 0.3063 ( 3818 PWs) bands (ev): -80.9603 -80.9603 -80.9603 -80.9603 -46.6579 -46.6579 -46.6565 -46.6565 -44.9491 -44.9491 -44.9463 -44.9463 -44.9028 -44.9028 -44.9014 -44.9014 -8.4812 -8.4812 -8.4759 -8.4759 4.2910 4.2910 4.2958 4.2958 5.2448 5.2448 5.2539 5.2539 5.7706 5.7706 5.7754 5.7754 9.5954 9.5954 9.6761 9.6761 9.9264 9.9264 10.0096 10.0096 10.3574 10.3574 10.4298 10.4298 10.8695 10.8695 10.9044 10.9044 11.2809 11.2809 11.3607 11.3607 16.6335 16.6335 16.6486 16.6486 k = 0.2172 0.3762 0.3063 ( 3826 PWs) bands (ev): -80.9606 -80.9606 -80.9606 -80.9606 -46.6579 -46.6579 -46.6565 -46.6565 -44.9488 -44.9488 -44.9462 -44.9462 -44.9028 -44.9028 -44.9014 -44.9014 -8.4893 -8.4893 -8.4840 -8.4840 4.2868 4.2868 4.2913 4.2913 5.2562 5.2562 5.2652 5.2652 5.7584 5.7584 5.7632 5.7632 9.6083 9.6083 9.6851 9.6851 9.9121 9.9121 9.9972 9.9972 10.3877 10.3877 10.4591 10.4591 10.8876 10.8876 10.9211 10.9211 11.2944 11.2944 11.3753 11.3753 16.5340 16.5340 16.5489 16.5489 k = 0.2121 0.3674 0.3063 ( 3822 PWs) bands (ev): -80.9605 -80.9605 -80.9605 -80.9605 -46.6576 -46.6576 -46.6563 -46.6563 -44.9484 -44.9484 -44.9459 -44.9459 -44.9028 -44.9028 -44.9014 -44.9014 -8.4976 -8.4976 -8.4925 -8.4925 4.2839 4.2839 4.2881 4.2881 5.2667 5.2667 5.2756 5.2756 5.7459 5.7459 5.7506 5.7506 9.6209 9.6209 9.6939 9.6939 9.8997 9.8997 9.9861 9.9861 10.4210 10.4210 10.4913 10.4913 10.9059 10.9059 10.9382 10.9382 11.3091 11.3091 11.3911 11.3911 16.4354 16.4354 16.4502 16.4502 k = 0.2071 0.3587 0.3063 ( 3826 PWs) bands (ev): -80.9607 -80.9607 -80.9607 -80.9607 -46.6575 -46.6575 -46.6562 -46.6562 -44.9481 -44.9481 -44.9457 -44.9457 -44.9027 -44.9027 -44.9014 -44.9014 -8.5063 -8.5063 -8.5013 -8.5013 4.2821 4.2821 4.2862 4.2862 5.2763 5.2763 5.2851 5.2851 5.7332 5.7332 5.7379 5.7379 9.6320 9.6320 9.7017 9.7017 9.8869 9.8869 9.9742 9.9742 10.4560 10.4560 10.5252 10.5252 10.9238 10.9238 10.9549 10.9549 11.3235 11.3235 11.4065 11.4065 16.3377 16.3377 16.3524 16.3524 k = 0.2020 0.3499 0.3063 ( 3834 PWs) bands (ev): -80.9609 -80.9609 -80.9609 -80.9609 -46.6574 -46.6574 -46.6561 -46.6561 -44.9478 -44.9478 -44.9455 -44.9455 -44.9027 -44.9027 -44.9014 -44.9014 -8.5152 -8.5152 -8.5103 -8.5103 4.2814 4.2814 4.2853 4.2853 5.2849 5.2849 5.2936 5.2936 5.7201 5.7201 5.7250 5.7250 9.6419 9.6419 9.7087 9.7087 9.8751 9.8751 9.9630 9.9630 10.4919 10.4919 10.5600 10.5600 10.9413 10.9413 10.9714 10.9714 11.3377 11.3377 11.4216 11.4216 16.2408 16.2408 16.2555 16.2555 k = 0.1970 0.3412 0.3063 ( 3830 PWs) bands (ev): -80.9609 -80.9609 -80.9609 -80.9609 -46.6572 -46.6572 -46.6559 -46.6559 -44.9474 -44.9474 -44.9453 -44.9453 -44.9026 -44.9026 -44.9013 -44.9013 -8.5244 -8.5244 -8.5196 -8.5196 4.2820 4.2820 4.2856 4.2856 5.2928 5.2928 5.3013 5.3013 5.7070 5.7070 5.7119 5.7119 9.6516 9.6516 9.7160 9.7160 9.8651 9.8651 9.9533 9.9533 10.5298 10.5298 10.5966 10.5966 10.9595 10.9595 10.9889 10.9889 11.3529 11.3529 11.4375 11.4375 16.1450 16.1450 16.1597 16.1597 k = 0.1919 0.3324 0.3063 ( 3818 PWs) bands (ev): -80.9605 -80.9605 -80.9605 -80.9605 -46.6569 -46.6569 -46.6557 -46.6557 -44.9469 -44.9469 -44.9449 -44.9449 -44.9025 -44.9025 -44.9012 -44.9012 -8.5338 -8.5338 -8.5291 -8.5291 4.2837 4.2837 4.2872 4.2872 5.2999 5.2999 5.3083 5.3083 5.6937 5.6937 5.6986 5.6986 9.6611 9.6611 9.7232 9.7232 9.8568 9.8568 9.9449 9.9449 10.5691 10.5691 10.6345 10.6345 10.9777 10.9777 11.0067 11.0067 11.3691 11.3691 11.4544 11.4544 16.0505 16.0505 16.0652 16.0652 k = 0.1869 0.3237 0.3063 ( 3816 PWs) bands (ev): -80.9605 -80.9605 -80.9605 -80.9605 -46.6567 -46.6567 -46.6555 -46.6555 -44.9465 -44.9465 -44.9446 -44.9446 -44.9024 -44.9024 -44.9011 -44.9011 -8.5434 -8.5434 -8.5388 -8.5388 4.2864 4.2864 4.2897 4.2897 5.3061 5.3061 5.3144 5.3144 5.6802 5.6802 5.6853 5.6853 9.6689 9.6689 9.7293 9.7293 9.8484 9.8484 9.9363 9.9363 10.6090 10.6090 10.6728 10.6728 10.9948 10.9948 11.0238 11.0238 11.3850 11.3850 11.4708 11.4708 15.9570 15.9570 15.9717 15.9717 k = 0.1818 0.3149 0.3063 ( 3818 PWs) bands (ev): -80.9606 -80.9606 -80.9606 -80.9606 -46.6565 -46.6565 -46.6554 -46.6554 -44.9461 -44.9461 -44.9443 -44.9443 -44.9023 -44.9023 -44.9011 -44.9011 -8.5532 -8.5532 -8.5487 -8.5487 4.2901 4.2901 4.2933 4.2933 5.3116 5.3116 5.3197 5.3197 5.6666 5.6666 5.6718 5.6718 9.6762 9.6762 9.7351 9.7351 9.8406 9.8406 9.9282 9.9282 10.6492 10.6492 10.7112 10.7112 11.0111 11.0111 11.0408 11.0408 11.4009 11.4009 11.4869 11.4869 15.8647 15.8647 15.8794 15.8794 k = 0.1768 0.3062 0.3063 ( 3822 PWs) bands (ev): -80.9608 -80.9608 -80.9608 -80.9608 -46.6564 -46.6564 -46.6552 -46.6552 -44.9458 -44.9458 -44.9441 -44.9441 -44.9023 -44.9023 -44.9011 -44.9011 -8.5632 -8.5632 -8.5588 -8.5588 4.2947 4.2947 4.2977 4.2977 5.3162 5.3162 5.3242 5.3242 5.6530 5.6530 5.6582 5.6582 9.6828 9.6828 9.7404 9.7404 9.8342 9.8342 9.9209 9.9209 10.6896 10.6896 10.7496 10.7496 11.0271 11.0271 11.0580 11.0580 11.4166 11.4166 11.5027 11.5027 15.7735 15.7735 15.7883 15.7883 k = 0.1717 0.2974 0.3063 ( 3822 PWs) bands (ev): -80.9608 -80.9608 -80.9608 -80.9608 -46.6562 -46.6562 -46.6551 -46.6551 -44.9454 -44.9454 -44.9438 -44.9438 -44.9022 -44.9022 -44.9010 -44.9010 -8.5733 -8.5733 -8.5690 -8.5690 4.3002 4.3002 4.3031 4.3031 5.3203 5.3203 5.3281 5.3281 5.6394 5.6394 5.6447 5.6447 9.6895 9.6895 9.7460 9.7460 9.8285 9.8285 9.9144 9.9144 10.7301 10.7301 10.7879 10.7879 11.0427 11.0427 11.0755 11.0755 11.4333 11.4333 11.5193 11.5193 15.6837 15.6837 15.6985 15.6985 k = 0.1667 0.2887 0.3063 ( 3824 PWs) bands (ev): -80.9609 -80.9609 -80.9609 -80.9609 -46.6560 -46.6560 -46.6549 -46.6549 -44.9450 -44.9450 -44.9435 -44.9435 -44.9022 -44.9022 -44.9010 -44.9010 -8.5835 -8.5835 -8.5793 -8.5793 4.3066 4.3066 4.3093 4.3093 5.3237 5.3237 5.3314 5.3314 5.6258 5.6258 5.6312 5.6312 9.6960 9.6960 9.7515 9.7515 9.8234 9.8234 9.9081 9.9081 10.7700 10.7700 10.8255 10.8255 11.0577 11.0577 11.0932 11.0932 11.4504 11.4504 11.5360 11.5360 15.5953 15.5953 15.6100 15.6100 k = 0.1616 0.2799 0.3063 ( 3816 PWs) bands (ev): -80.9607 -80.9607 -80.9607 -80.9607 -46.6557 -46.6557 -46.6547 -46.6547 -44.9445 -44.9445 -44.9432 -44.9432 -44.9020 -44.9020 -44.9009 -44.9009 -8.5939 -8.5939 -8.5897 -8.5897 4.3137 4.3137 4.3164 4.3164 5.3266 5.3266 5.3341 5.3341 5.6124 5.6124 5.6179 5.6179 9.7028 9.7028 9.7575 9.7575 9.8199 9.8199 9.9033 9.9033 10.8104 10.8104 10.8634 10.8634 11.0723 11.0723 11.1116 11.1116 11.4688 11.4688 11.5537 11.5537 15.5084 15.5084 15.5232 15.5232 k = 0.1566 0.2712 0.3063 ( 3816 PWs) bands (ev): -80.9608 -80.9608 -80.9608 -80.9608 -46.6556 -46.6556 -46.6545 -46.6545 -44.9441 -44.9441 -44.9429 -44.9429 -44.9020 -44.9020 -44.9008 -44.9008 -8.6043 -8.6043 -8.6002 -8.6002 4.3214 4.3214 4.3240 4.3240 5.3289 5.3289 5.3362 5.3362 5.5991 5.5991 5.6046 5.6046 9.7092 9.7092 9.7631 9.7631 9.8168 9.8168 9.8987 9.8987 10.8492 10.8492 10.8998 10.8998 11.0863 11.0863 11.1304 11.1304 11.4864 11.4864 11.5703 11.5703 15.4228 15.4228 15.4376 15.4376 k = 0.1515 0.2624 0.3063 ( 3816 PWs) bands (ev): -80.9608 -80.9608 -80.9608 -80.9608 -46.6554 -46.6554 -46.6543 -46.6543 -44.9437 -44.9437 -44.9426 -44.9426 -44.9019 -44.9019 -44.9008 -44.9008 -8.6147 -8.6147 -8.6107 -8.6107 4.3298 4.3298 4.3322 4.3322 5.3308 5.3308 5.3379 5.3379 5.5860 5.5860 5.5915 5.5915 9.7153 9.7153 9.7684 9.7684 9.8146 9.8146 9.8949 9.8949 10.8861 10.8861 10.9348 10.9348 11.1004 11.1004 11.1501 11.1501 11.5045 11.5045 11.5872 11.5872 15.3388 15.3388 15.3536 15.3536 k = 0.1465 0.2537 0.3063 ( 3816 PWs) bands (ev): -80.9609 -80.9609 -80.9609 -80.9609 -46.6552 -46.6552 -46.6541 -46.6541 -44.9433 -44.9433 -44.9422 -44.9422 -44.9018 -44.9018 -44.9007 -44.9007 -8.6251 -8.6251 -8.6212 -8.6212 4.3386 4.3386 4.3409 4.3409 5.3323 5.3323 5.3393 5.3393 5.5730 5.5730 5.5786 5.5786 9.7213 9.7213 9.7737 9.7737 9.8132 9.8132 9.8917 9.8917 10.9208 10.9208 10.9683 10.9683 11.1149 11.1149 11.1711 11.1711 11.5230 11.5230 11.6041 11.6041 15.2564 15.2564 15.2712 15.2712 k = 0.1414 0.2449 0.3063 ( 3824 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6550 -46.6550 -46.6540 -46.6540 -44.9430 -44.9430 -44.9420 -44.9420 -44.9018 -44.9018 -44.9007 -44.9007 -8.6355 -8.6355 -8.6317 -8.6317 4.3478 4.3478 4.3500 4.3500 5.3334 5.3334 5.3402 5.3402 5.5603 5.5603 5.5659 5.5659 9.7269 9.7269 9.7784 9.7784 9.8118 9.8118 9.8884 9.8884 10.9523 10.9523 10.9994 10.9994 11.1300 11.1300 11.1930 11.1930 11.5412 11.5412 11.6204 11.6204 15.1756 15.1756 15.1904 15.1904 k = 0.1364 0.2362 0.3063 ( 3820 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6548 -46.6548 -46.6538 -46.6538 -44.9425 -44.9425 -44.9416 -44.9416 -44.9017 -44.9017 -44.9007 -44.9007 -8.6459 -8.6459 -8.6421 -8.6421 4.3573 4.3573 4.3594 4.3594 5.3344 5.3344 5.3410 5.3410 5.5479 5.5479 5.5536 5.5536 9.7331 9.7331 9.7836 9.7836 9.8119 9.8119 9.8862 9.8862 10.9808 10.9808 11.0282 11.0282 11.1483 11.1483 11.2177 11.2177 11.5604 11.5604 11.6375 11.6375 15.0967 15.0967 15.1113 15.1113 k = 0.1313 0.2274 0.3063 ( 3824 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6546 -46.6546 -46.6537 -46.6537 -44.9422 -44.9422 -44.9413 -44.9413 -44.9017 -44.9017 -44.9006 -44.9006 -8.6561 -8.6561 -8.6525 -8.6525 4.3671 4.3671 4.3690 4.3690 5.3351 5.3351 5.3415 5.3415 5.5358 5.5358 5.5415 5.5415 9.7391 9.7391 9.7884 9.7884 9.8123 9.8123 9.8842 9.8842 11.0049 11.0049 11.0523 11.0523 11.1694 11.1694 11.2433 11.2433 11.5790 11.5790 11.6538 11.6538 15.0194 15.0194 15.0339 15.0339 k = 0.1263 0.2187 0.3063 ( 3828 PWs) bands (ev): -80.9614 -80.9614 -80.9614 -80.9614 -46.6545 -46.6545 -46.6535 -46.6535 -44.9418 -44.9418 -44.9411 -44.9411 -44.9017 -44.9017 -44.9006 -44.9006 -8.6663 -8.6663 -8.6627 -8.6627 4.3769 4.3769 4.3787 4.3787 5.3357 5.3357 5.3419 5.3419 5.5241 5.5241 5.5297 5.5297 9.7452 9.7452 9.7930 9.7930 9.8133 9.8133 9.8824 9.8824 11.0249 11.0249 11.0713 11.0713 11.1949 11.1949 11.2708 11.2708 11.5979 11.5979 11.6701 11.6701 14.9438 14.9438 14.9583 14.9583 k = 0.1212 0.2099 0.3063 ( 3820 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6542 -46.6542 -46.6533 -46.6533 -44.9414 -44.9414 -44.9407 -44.9407 -44.9015 -44.9015 -44.9005 -44.9005 -8.6763 -8.6763 -8.6728 -8.6728 4.3868 4.3868 4.3885 4.3885 5.3363 5.3363 5.3424 5.3424 5.5129 5.5129 5.5184 5.5184 9.7520 9.7520 9.7981 9.7981 9.8161 9.8161 9.8822 9.8822 11.0422 11.0422 11.0862 11.0862 11.2254 11.2254 11.3007 11.3007 11.6173 11.6173 11.6867 11.6867 14.8703 14.8703 14.8845 14.8845 k = 0.1162 0.2012 0.3063 ( 3818 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6540 -46.6540 -46.6531 -46.6531 -44.9410 -44.9410 -44.9404 -44.9404 -44.9015 -44.9015 -44.9004 -44.9004 -8.6862 -8.6862 -8.6828 -8.6828 4.3967 4.3967 4.3982 4.3982 5.3369 5.3369 5.3428 5.3428 5.5020 5.5020 5.5075 5.5075 9.7588 9.7588 9.8028 9.8028 9.8189 9.8189 9.8817 9.8817 11.0557 11.0557 11.0964 11.0964 11.2583 11.2583 11.3312 11.3312 11.6366 11.6366 11.7030 11.7030 14.7986 14.7986 14.8127 14.8127 k = 0.1111 0.1925 0.3063 ( 3818 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6538 -46.6538 -46.6530 -46.6530 -44.9406 -44.9406 -44.9401 -44.9401 -44.9014 -44.9014 -44.9004 -44.9004 -8.6958 -8.6958 -8.6926 -8.6926 4.4064 4.4064 4.4078 4.4078 5.3375 5.3375 5.3433 5.3433 5.4916 5.4916 5.4970 5.4970 9.7652 9.7652 9.8068 9.8068 9.8222 9.8222 9.8813 9.8813 11.0663 11.0663 11.1034 11.1034 11.2934 11.2934 11.3629 11.3629 11.6552 11.6552 11.7185 11.7185 14.7289 14.7289 14.7428 14.7428 k = 0.1061 0.1837 0.3063 ( 3814 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6536 -46.6536 -46.6528 -46.6528 -44.9402 -44.9402 -44.9397 -44.9397 -44.9013 -44.9013 -44.9004 -44.9004 -8.7053 -8.7053 -8.7021 -8.7021 4.4158 4.4158 4.4171 4.4171 5.3383 5.3383 5.3439 5.3439 5.4817 5.4817 5.4869 5.4869 9.7718 9.7718 9.8108 9.8108 9.8263 9.8263 9.8814 9.8814 11.0747 11.0747 11.1081 11.1081 11.3304 11.3304 11.3959 11.3959 11.6736 11.6736 11.7337 11.7337 14.6614 14.6614 14.6750 14.6750 k = 0.1010 0.1750 0.3063 ( 3814 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6534 -46.6534 -46.6526 -46.6526 -44.9398 -44.9398 -44.9394 -44.9394 -44.9013 -44.9013 -44.9003 -44.9003 -8.7145 -8.7145 -8.7114 -8.7114 4.4250 4.4250 4.4261 4.4261 5.3392 5.3392 5.3447 5.3447 5.4722 5.4722 5.4773 5.4773 9.7783 9.7783 9.8145 9.8145 9.8304 9.8304 9.8814 9.8814 11.0809 11.0809 11.1109 11.1109 11.3674 11.3674 11.4288 11.4288 11.6915 11.6915 11.7483 11.7483 14.5959 14.5959 14.6092 14.6092 k = 0.0960 0.1662 0.3063 ( 3814 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6532 -46.6532 -46.6525 -46.6525 -44.9395 -44.9395 -44.9391 -44.9391 -44.9012 -44.9012 -44.9003 -44.9003 -8.7234 -8.7234 -8.7204 -8.7204 4.4338 4.4338 4.4348 4.4348 5.3403 5.3403 5.3457 5.3457 5.4631 5.4631 5.4681 5.4681 9.7848 9.7848 9.8181 9.8181 9.8349 9.8349 9.8817 9.8817 11.0845 11.0845 11.1115 11.1115 11.4051 11.4051 11.4624 11.4624 11.7090 11.7090 11.7625 11.7625 14.5326 14.5326 14.5456 14.5456 k = 0.0909 0.1575 0.3063 ( 3816 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6531 -46.6531 -46.6523 -46.6523 -44.9391 -44.9391 -44.9388 -44.9388 -44.9012 -44.9012 -44.9003 -44.9003 -8.7320 -8.7320 -8.7292 -8.7292 4.4421 4.4421 4.4430 4.4430 5.3417 5.3417 5.3470 5.3470 5.4545 5.4545 5.4593 5.4593 9.7911 9.7911 9.8215 9.8215 9.8392 9.8392 9.8818 9.8818 11.0873 11.0873 11.1115 11.1115 11.4421 11.4421 11.4954 11.4954 11.7256 11.7256 11.7758 11.7758 14.4715 14.4715 14.4841 14.4841 k = 0.0859 0.1487 0.3063 ( 3816 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6529 -46.6529 -46.6522 -46.6522 -44.9388 -44.9388 -44.9386 -44.9386 -44.9011 -44.9011 -44.9003 -44.9003 -8.7403 -8.7403 -8.7376 -8.7376 4.4499 4.4499 4.4507 4.4507 5.3433 5.3433 5.3485 5.3485 5.4464 5.4464 5.4510 5.4510 9.7978 9.7978 9.8252 9.8252 9.8438 9.8438 9.8821 9.8821 11.0893 11.0893 11.1111 11.1111 11.4787 11.4787 11.5281 11.5281 11.7413 11.7413 11.7882 11.7882 14.4128 14.4128 14.4249 14.4249 k = 0.0808 0.1400 0.3063 ( 3812 PWs) bands (ev): -80.9612 -80.9612 -80.9612 -80.9612 -46.6527 -46.6527 -46.6520 -46.6520 -44.9385 -44.9385 -44.9383 -44.9383 -44.9010 -44.9010 -44.9002 -44.9002 -8.7483 -8.7483 -8.7457 -8.7457 4.4573 4.4573 4.4579 4.4579 5.3453 5.3454 5.3503 5.3503 5.4388 5.4388 5.4432 5.4432 9.8043 9.8043 9.8288 9.8288 9.8484 9.8484 9.8825 9.8825 11.0901 11.0901 11.1096 11.1096 11.5155 11.5155 11.5611 11.5611 11.7569 11.7569 11.8005 11.8005 14.3565 14.3565 14.3682 14.3682 k = 0.0758 0.1312 0.3063 ( 3816 PWs) bands (ev): -80.9614 -80.9614 -80.9614 -80.9614 -46.6526 -46.6526 -46.6519 -46.6519 -44.9382 -44.9382 -44.9381 -44.9381 -44.9010 -44.9010 -44.9002 -44.9002 -8.7559 -8.7559 -8.7534 -8.7534 4.4640 4.4640 4.4645 4.4645 5.3475 5.3475 5.3523 5.3523 5.4316 5.4316 5.4358 5.4358 9.8105 9.8105 9.8322 9.8322 9.8526 9.8526 9.8825 9.8825 11.0894 11.0894 11.1070 11.1070 11.5507 11.5507 11.5926 11.5926 11.7714 11.7714 11.8116 11.8116 14.3025 14.3025 14.3137 14.3137 k = 0.0707 0.1225 0.3063 ( 3812 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6524 -46.6524 -46.6518 -46.6518 -44.9379 -44.9379 -44.9378 -44.9378 -44.9009 -44.9009 -44.9002 -44.9002 -8.7630 -8.7630 -8.7607 -8.7607 4.4703 4.4703 4.4707 4.4707 5.3500 5.3500 5.3546 5.3546 5.4251 5.4251 5.4290 5.4290 9.8163 9.8163 9.8357 9.8357 9.8568 9.8568 9.8829 9.8829 11.0886 11.0886 11.1044 11.1044 11.5855 11.5855 11.6237 11.6237 11.7862 11.7862 11.8231 11.8231 14.2513 14.2513 14.2619 14.2619 k = 0.0657 0.1137 0.3063 ( 3804 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6522 -46.6522 -46.6516 -46.6516 -44.9376 -44.9376 -44.9375 -44.9375 -44.9008 -44.9008 -44.9001 -44.9001 -8.7698 -8.7698 -8.7676 -8.7676 4.4759 4.4759 4.4763 4.4763 5.3527 5.3527 5.3571 5.3571 5.4191 5.4191 5.4228 5.4228 9.8227 9.8227 9.8399 9.8399 9.8613 9.8613 9.8836 9.8836 11.0870 11.0870 11.1011 11.1011 11.6195 11.6195 11.6541 11.6541 11.8005 11.8005 11.8339 11.8339 14.2027 14.2027 14.2128 14.2128 k = 0.0606 0.1050 0.3063 ( 3804 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6521 -46.6521 -46.6515 -46.6515 -44.9374 -44.9374 -44.9373 -44.9373 -44.9008 -44.9008 -44.9001 -44.9001 -8.7762 -8.7762 -8.7741 -8.7741 4.4809 4.4809 4.4812 4.4812 5.3555 5.3555 5.3597 5.3597 5.4135 5.4135 5.4169 5.4169 9.8280 9.8280 9.8432 9.8432 9.8652 9.8652 9.8840 9.8840 11.0848 11.0848 11.0973 11.0973 11.6517 11.6517 11.6827 11.6827 11.8131 11.8131 11.8432 11.8432 14.1569 14.1569 14.1663 14.1663 k = 0.0556 0.0962 0.3063 ( 3812 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6520 -46.6520 -46.6515 -46.6515 -44.9372 -44.9372 -44.9371 -44.9371 -44.9008 -44.9008 -44.9001 -44.9001 -8.7821 -8.7821 -8.7802 -8.7802 4.4854 4.4854 4.4856 4.4856 5.3583 5.3583 5.3622 5.3622 5.4082 5.4082 5.4114 5.4114 9.8323 9.8323 9.8460 9.8460 9.8681 9.8681 9.8840 9.8840 11.0821 11.0821 11.0932 11.0932 11.6814 11.6814 11.7090 11.7090 11.8249 11.8249 11.8516 11.8516 14.1138 14.1138 14.1227 14.1227 k = 0.0505 0.0875 0.3063 ( 3812 PWs) bands (ev): -80.9614 -80.9614 -80.9614 -80.9614 -46.6519 -46.6519 -46.6514 -46.6514 -44.9370 -44.9370 -44.9370 -44.9369 -44.9007 -44.9007 -44.9001 -44.9001 -8.7875 -8.7875 -8.7858 -8.7858 4.4894 4.4894 4.4896 4.4896 5.3614 5.3614 5.3650 5.3650 5.4034 5.4034 5.4063 5.4063 9.8367 9.8367 9.8488 9.8488 9.8713 9.8713 9.8845 9.8845 11.0798 11.0798 11.0896 11.0896 11.7107 11.7107 11.7347 11.7347 11.8358 11.8358 11.8590 11.8590 14.0740 14.0740 14.0821 14.0821 k = 0.0455 0.0787 0.3063 ( 3808 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6517 -46.6517 -46.6513 -46.6513 -44.9368 -44.9368 -44.9367 -44.9367 -44.9006 -44.9006 -44.9001 -44.9001 -8.7925 -8.7925 -8.7909 -8.7909 4.4929 4.4929 4.4930 4.4930 5.3645 5.3645 5.3678 5.3678 5.3992 5.3992 5.4018 5.4018 9.8408 9.8408 9.8516 9.8516 9.8742 9.8742 9.8849 9.8849 11.0773 11.0773 11.0860 11.0860 11.7379 11.7379 11.7585 11.7585 11.8470 11.8470 11.8669 11.8669 14.0373 14.0373 14.0448 14.0448 k = 0.0404 0.0700 0.3063 ( 3808 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6516 -46.6516 -46.6513 -46.6513 -44.9366 -44.9366 -44.9366 -44.9366 -44.9006 -44.9006 -44.9001 -44.9001 -8.7970 -8.7970 -8.7955 -8.7955 4.4958 4.4958 4.4960 4.4960 5.3674 5.3674 5.3704 5.3704 5.3954 5.3954 5.3977 5.3977 9.8448 9.8448 9.8544 9.8544 9.8769 9.8769 9.8851 9.8851 11.0745 11.0745 11.0820 11.0820 11.7624 11.7624 11.7793 11.7793 11.8574 11.8574 11.8737 11.8737 14.0039 14.0039 14.0106 14.0106 k = 0.0354 0.0612 0.3063 ( 3808 PWs) bands (ev): -80.9613 -80.9613 -80.9613 -80.9613 -46.6515 -46.6515 -46.6512 -46.6512 -44.9365 -44.9365 -44.9365 -44.9365 -44.9005 -44.9005 -44.9001 -44.9001 -8.8009 -8.8009 -8.7997 -8.7997 4.4983 4.4983 4.4985 4.4985 5.3703 5.3703 5.3729 5.3729 5.3921 5.3921 5.3941 5.3941 9.8483 9.8483 9.8570 9.8570 9.8793 9.8793 9.8853 9.8853 11.0718 11.0718 11.0783 11.0783 11.7843 11.7843 11.7975 11.7975 11.8674 11.8674 11.8801 11.8801 13.9740 13.9740 13.9800 13.9800 k = 0.0303 0.0525 0.3063 ( 3800 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6514 -46.6514 -46.6511 -46.6511 -44.9363 -44.9363 -44.9363 -44.9363 -44.9004 -44.9004 -44.9001 -44.9001 -8.8044 -8.8044 -8.8033 -8.8033 4.5005 4.5005 4.5006 4.5006 5.3729 5.3729 5.3752 5.3752 5.3894 5.3894 5.3911 5.3911 9.8524 9.8524 9.8601 9.8601 9.8822 9.8822 9.8863 9.8863 11.0697 11.0697 11.0752 11.0752 11.8037 11.8037 11.8132 11.8132 11.8773 11.8773 11.8863 11.8863 13.9478 13.9478 13.9529 13.9529 k = 0.0253 0.0437 0.3063 ( 3800 PWs) bands (ev): -80.9611 -80.9611 -80.9611 -80.9611 -46.6513 -46.6513 -46.6511 -46.6511 -44.9362 -44.9362 -44.9362 -44.9362 -44.9004 -44.9004 -44.9001 -44.9001 -8.8073 -8.8073 -8.8064 -8.8064 4.5022 4.5022 4.5023 4.5023 5.3752 5.3752 5.3770 5.3770 5.3871 5.3871 5.3884 5.3884 9.8554 9.8554 9.8622 9.8622 9.8841 9.8841 9.8867 9.8867 11.0674 11.0674 11.0719 11.0719 11.8194 11.8194 11.8255 11.8255 11.8863 11.8863 11.8921 11.8921 13.9253 13.9253 13.9296 13.9296 k = 0.0202 0.0350 0.3063 ( 3794 PWs) bands (ev): -80.9610 -80.9610 -80.9610 -80.9610 -46.6512 -46.6512 -46.6510 -46.6510 -44.9361 -44.9361 -44.9361 -44.9361 -44.9003 -44.9003 -44.9000 -44.9000 -8.8097 -8.8096 -8.8089 -8.8089 4.5036 4.5036 4.5037 4.5037 5.3772 5.3772 5.3787 5.3787 5.3853 5.3853 5.3864 5.3864 9.8584 9.8584 9.8641 9.8641 9.8860 9.8860 9.8874 9.8874 11.0657 11.0657 11.0692 11.0692 11.8324 11.8324 11.8358 11.8358 11.8948 11.8948 11.8978 11.8978 13.9068 13.9068 13.9103 13.9103 k = 0.0152 0.0262 0.3063 ( 3794 PWs) bands (ev): -80.9610 -80.9610 -80.9610 -80.9610 -46.6511 -46.6511 -46.6510 -46.6510 -44.9360 -44.9360 -44.9360 -44.9360 -44.9002 -44.9002 -44.9000 -44.9000 -8.8115 -8.8115 -8.8109 -8.8109 4.5047 4.5047 4.5047 4.5047 5.3788 5.3788 5.3797 5.3797 5.3841 5.3841 5.3847 5.3847 9.8606 9.8606 9.8651 9.8651 9.8871 9.8871 9.8877 9.8877 11.0644 11.0644 11.0671 11.0671 11.8416 11.8416 11.8431 11.8431 11.9013 11.9013 11.9026 11.9026 13.8922 13.8922 13.8949 13.8949 k = 0.0101 0.0175 0.3063 ( 3794 PWs) bands (ev): -80.9610 -80.9610 -80.9610 -80.9610 -46.6511 -46.6511 -46.6510 -46.6510 -44.9360 -44.9360 -44.9360 -44.9360 -44.9002 -44.9002 -44.9001 -44.9001 -8.8128 -8.8128 -8.8124 -8.8124 4.5054 4.5054 4.5054 4.5054 5.3798 5.3798 5.3802 5.3802 5.3835 5.3835 5.3837 5.3837 9.8623 9.8623 9.8654 9.8654 9.8878 9.8878 9.8880 9.8880 11.0635 11.0635 11.0653 11.0653 11.8477 11.8477 11.8482 11.8482 11.9063 11.9063 11.9067 11.9067 13.8819 13.8819 13.8837 13.8837 k = 0.0051 0.0087 0.3063 ( 3786 PWs) bands (ev): -80.9608 -80.9608 -80.9608 -80.9608 -46.6510 -46.6510 -46.6509 -46.6509 -44.9359 -44.9359 -44.9359 -44.9359 -44.9001 -44.9001 -44.9000 -44.9000 -8.8135 -8.8135 -8.8133 -8.8133 4.5059 4.5059 4.5059 4.5059 5.3802 5.3802 5.3803 5.3803 5.3833 5.3833 5.3834 5.3834 9.8644 9.8644 9.8660 9.8660 9.8889 9.8889 9.8890 9.8890 11.0639 11.0639 11.0647 11.0647 11.8514 11.8514 11.8515 11.8515 11.9095 11.9095 11.9097 11.9097 13.8759 13.8759 13.8768 13.8768 k = 0.0000 0.0000 0.3063 ( 3784 PWs) bands (ev): -80.9607 -80.9607 -80.9607 -80.9607 -46.6509 -46.6509 -46.6509 -46.6509 -44.9359 -44.9359 -44.9359 -44.9359 -44.9000 -44.9000 -44.9000 -44.9000 -8.8137 -8.8137 -8.8137 -8.8137 4.5061 4.5061 4.5061 4.5061 5.3803 5.3803 5.3803 5.3803 5.3833 5.3833 5.3833 5.3833 9.8655 9.8655 9.8655 9.8655 9.8891 9.8891 9.8891 9.8891 11.0643 11.0643 11.0643 11.0643 11.8525 11.8525 11.8525 11.8525 11.9106 11.9106 11.9106 11.9106 13.8742 13.8742 13.8742 13.8742 k = 0.5000 0.2887 0.3063 ( 3804 PWs) bands (ev): -80.9598 -80.9598 -80.9598 -80.9598 -46.6578 -46.6578 -46.6578 -46.6578 -44.9492 -44.9492 -44.9492 -44.9492 -44.9019 -44.9019 -44.9019 -44.9019 -8.4380 -8.4380 -8.4380 -8.4380 4.0777 4.0777 4.0777 4.0777 5.5782 5.5782 5.5782 5.5782 5.6806 5.6806 5.6806 5.6806 9.7223 9.7223 9.7223 9.7223 10.0352 10.0352 10.0352 10.0352 10.1736 10.1736 10.1736 10.1736 11.0272 11.0272 11.0272 11.0272 11.1168 11.1168 11.1168 11.1168 16.8534 16.8534 16.8534 16.8534 k = 0.5000 0.2887 0.2961 ( 3814 PWs) bands (ev): -80.9602 -80.9602 -80.9600 -80.9600 -46.6580 -46.6580 -46.6578 -46.6578 -44.9493 -44.9493 -44.9492 -44.9492 -44.9022 -44.9022 -44.9018 -44.9018 -8.4426 -8.4426 -8.4334 -8.4334 4.0733 4.0733 4.0835 4.0835 5.5665 5.5665 5.5890 5.5890 5.6728 5.6728 5.6882 5.6882 9.7170 9.7170 9.7251 9.7251 10.0301 10.0301 10.0393 10.0393 10.1646 10.1646 10.1811 10.1811 10.9947 10.9947 11.0557 11.0557 11.0913 11.0913 11.1427 11.1427 16.8386 16.8386 16.8691 16.8691 k = 0.5000 0.2887 0.2859 ( 3814 PWs) bands (ev): -80.9601 -80.9601 -80.9600 -80.9600 -46.6581 -46.6581 -46.6577 -46.6577 -44.9493 -44.9493 -44.9492 -44.9492 -44.9024 -44.9024 -44.9017 -44.9017 -8.4473 -8.4473 -8.4289 -8.4289 4.0704 4.0704 4.0908 4.0908 5.5547 5.5547 5.5995 5.5995 5.6653 5.6653 5.6960 5.6960 9.7110 9.7110 9.7274 9.7274 10.0253 10.0253 10.0434 10.0434 10.1557 10.1557 10.1881 10.1881 10.9628 10.9628 11.0587 11.0587 11.0919 11.0919 11.1696 11.1696 16.8255 16.8255 16.8865 16.8865 k = 0.5000 0.2887 0.2757 ( 3820 PWs) bands (ev): -80.9603 -80.9603 -80.9602 -80.9602 -46.6582 -46.6582 -46.6577 -46.6577 -44.9493 -44.9493 -44.9492 -44.9492 -44.9027 -44.9027 -44.9016 -44.9016 -8.4519 -8.4519 -8.4245 -8.4245 4.0689 4.0689 4.0995 4.0995 5.5425 5.5425 5.6093 5.6093 5.6578 5.6578 5.7038 5.7038 9.7037 9.7037 9.7284 9.7284 10.0198 10.0198 10.0468 10.0468 10.1463 10.1463 10.1935 10.1935 10.9305 10.9305 11.0344 11.0344 11.1177 11.1177 11.1959 11.1959 16.8141 16.8141 16.9048 16.9048 k = 0.5000 0.2887 0.2655 ( 3822 PWs) bands (ev): -80.9606 -80.9606 -80.9600 -80.9600 -46.6583 -46.6583 -46.6576 -46.6576 -44.9493 -44.9493 -44.9492 -44.9492 -44.9028 -44.9028 -44.9014 -44.9014 -8.4566 -8.4566 -8.4201 -8.4201 4.0689 4.0689 4.1095 4.1095 5.5300 5.5300 5.6186 5.6186 5.6505 5.6505 5.7116 5.7116 9.6951 9.6951 9.7282 9.7282 10.0151 10.0151 10.0493 10.0493 10.1375 10.1375 10.1981 10.1981 10.8989 10.8989 11.0086 11.0086 11.1445 11.1445 11.2228 11.2228 16.8047 16.8047 16.9239 16.9239 k = 0.5000 0.2887 0.2552 ( 3818 PWs) bands (ev): -80.9606 -80.9606 -80.9598 -80.9598 -46.6583 -46.6583 -46.6576 -46.6576 -44.9493 -44.9493 -44.9491 -44.9491 -44.9030 -44.9030 -44.9013 -44.9013 -8.4613 -8.4613 -8.4158 -8.4158 4.0704 4.0704 4.1210 4.1210 5.5171 5.5171 5.6272 5.6272 5.6435 5.6435 5.7195 5.7195 9.6857 9.6857 9.7269 9.7269 10.0107 10.0107 10.0523 10.0523 10.1298 10.1298 10.2013 10.2013 10.8684 10.8684 10.9835 10.9835 11.1703 11.1703 11.2493 11.2493 16.7975 16.7975 16.9437 16.9437 k = 0.5000 0.2887 0.2450 ( 3818 PWs) bands (ev): -80.9606 -80.9606 -80.9597 -80.9597 -46.6584 -46.6584 -46.6575 -46.6575 -44.9493 -44.9493 -44.9491 -44.9491 -44.9031 -44.9031 -44.9011 -44.9011 -8.4659 -8.4659 -8.4117 -8.4117 4.0733 4.0733 4.1336 4.1336 5.5039 5.5039 5.6342 5.6342 5.6378 5.6378 5.7273 5.7273 9.6749 9.6749 9.7241 9.7241 10.0051 10.0051 10.0533 10.0533 10.1234 10.1234 10.2023 10.2023 10.8392 10.8392 10.9582 10.9582 11.1952 11.1952 11.2753 11.2753 16.7925 16.7925 16.9638 16.9638 k = 0.5000 0.2887 0.2348 ( 3814 PWs) bands (ev): -80.9606 -80.9606 -80.9595 -80.9595 -46.6584 -46.6584 -46.6574 -46.6574 -44.9493 -44.9493 -44.9491 -44.9491 -44.9033 -44.9033 -44.9010 -44.9010 -8.4705 -8.4705 -8.4076 -8.4076 4.0776 4.0776 4.1475 4.1475 5.4904 5.4904 5.6294 5.6294 5.6435 5.6435 5.7351 5.7351 9.6631 9.6631 9.7200 9.7200 9.9997 9.9997 10.0532 10.0532 10.1192 10.1192 10.2018 10.2018 10.8119 10.8119 10.9335 10.9335 11.2189 11.2189 11.3009 11.3009 16.7900 16.7900 16.9841 16.9841 k = 0.5000 0.2887 0.2246 ( 3814 PWs) bands (ev): -80.9606 -80.9606 -80.9595 -80.9595 -46.6585 -46.6585 -46.6573 -46.6573 -44.9493 -44.9493 -44.9490 -44.9490 -44.9034 -44.9034 -44.9008 -44.9008 -8.4751 -8.4751 -8.4037 -8.4037 4.0832 4.0832 4.1624 4.1624 5.4767 5.4767 5.6229 5.6229 5.6504 5.6504 5.7427 5.7427 9.6499 9.6499 9.7145 9.7145 9.9939 9.9939 10.0511 10.0511 10.1168 10.1168 10.1992 10.1992 10.7864 10.7864 10.9087 10.9087 11.2414 11.2414 11.3252 11.3252 16.7898 16.7898 17.0045 17.0045 k = 0.5000 0.2887 0.2144 ( 3822 PWs) bands (ev): -80.9609 -80.9609 -80.9597 -80.9597 -46.6587 -46.6587 -46.6573 -46.6573 -44.9494 -44.9494 -44.9491 -44.9491 -44.9037 -44.9037 -44.9007 -44.9007 -8.4795 -8.4795 -8.3999 -8.3999 4.0900 4.0900 4.1783 4.1783 5.4627 5.4627 5.6165 5.6165 5.6567 5.6567 5.7502 5.7502 9.6352 9.6352 9.7070 9.7070 9.9870 9.9870 10.0471 10.0471 10.1161 10.1161 10.1937 10.1937 10.7630 10.7630 10.8842 10.8842 11.2624 11.2624 11.3480 11.3480 16.7918 16.7918 17.0244 17.0244 k = 0.5000 0.2887 0.2042 ( 3830 PWs) bands (ev): -80.9610 -80.9610 -80.9600 -80.9600 -46.6588 -46.6588 -46.6572 -46.6572 -44.9494 -44.9494 -44.9490 -44.9490 -44.9039 -44.9039 -44.9006 -44.9006 -8.4839 -8.4839 -8.3962 -8.3962 4.0980 4.0980 4.1951 4.1951 5.4486 5.4486 5.6103 5.6103 5.6624 5.6624 5.7576 5.7576 9.6197 9.6197 9.6982 9.6982 9.9806 9.9806 10.0421 10.0421 10.1164 10.1164 10.1873 10.1873 10.7418 10.7418 10.8587 10.8587 11.2822 11.2822 11.3697 11.3697 16.7963 16.7963 17.0442 17.0442 k = 0.5000 0.2887 0.1940 ( 3818 PWs) bands (ev): -80.9607 -80.9607 -80.9596 -80.9596 -46.6588 -46.6588 -46.6571 -46.6571 -44.9494 -44.9494 -44.9490 -44.9490 -44.9039 -44.9039 -44.9003 -44.9003 -8.4882 -8.4882 -8.3927 -8.3927 4.1071 4.1071 4.2128 4.2128 5.4345 5.4345 5.6044 5.6044 5.6676 5.6676 5.7650 5.7650 9.6041 9.6041 9.6885 9.6885 9.9751 9.9751 10.0378 10.0378 10.1192 10.1192 10.1804 10.1804 10.7249 10.7249 10.8361 10.8361 11.3025 11.3025 11.3916 11.3916 16.8035 16.8035 17.0637 17.0637 k = 0.5000 0.2887 0.1838 ( 3810 PWs) bands (ev): -80.9605 -80.9605 -80.9593 -80.9593 -46.6588 -46.6588 -46.6569 -46.6569 -44.9493 -44.9493 -44.9489 -44.9489 -44.9041 -44.9041 -44.9001 -44.9001 -8.4924 -8.4924 -8.3893 -8.3893 4.1172 4.1172 4.2311 4.2311 5.4202 5.4202 5.5989 5.5989 5.6720 5.6720 5.7721 5.7721 9.5875 9.5875 9.6778 9.6778 9.9694 9.9694 10.0331 10.0331 10.1221 10.1221 10.1728 10.1728 10.7096 10.7096 10.8137 10.8137 11.3213 11.3213 11.4111 11.4111 16.8126 16.8126 17.0828 17.0828 k = 0.5000 0.2887 0.1736 ( 3812 PWs) bands (ev): -80.9606 -80.9606 -80.9594 -80.9594 -46.6589 -46.6589 -46.6568 -46.6568 -44.9493 -44.9493 -44.9489 -44.9489 -44.9043 -44.9043 -44.9000 -44.9000 -8.4964 -8.4964 -8.3861 -8.3861 4.1282 4.1282 4.2498 4.2498 5.4059 5.4059 5.5935 5.5935 5.6757 5.6757 5.7790 5.7790 9.5696 9.5696 9.6647 9.6647 9.9635 9.9635 10.0279 10.0279 10.1244 10.1244 10.1649 10.1649 10.6957 10.6957 10.7911 10.7911 11.3384 11.3384 11.4288 11.4288 16.8238 16.8238 17.1011 17.1011 k = 0.5000 0.2887 0.1634 ( 3816 PWs) bands (ev): -80.9606 -80.9606 -80.9596 -80.9596 -46.6590 -46.6590 -46.6568 -46.6568 -44.9494 -44.9494 -44.9488 -44.9488 -44.9045 -44.9045 -44.8999 -44.8999 -8.5004 -8.5004 -8.3830 -8.3830 4.1399 4.1399 4.2690 4.2690 5.3915 5.3915 5.5883 5.5883 5.6788 5.6788 5.7857 5.7857 9.5508 9.5508 9.6500 9.6500 9.9577 9.9577 10.0228 10.0228 10.1250 10.1250 10.1585 10.1585 10.6840 10.6840 10.7690 10.7690 11.3543 11.3543 11.4449 11.4449 16.8369 16.8369 17.1186 17.1186 k = 0.5000 0.2887 0.1531 ( 3820 PWs) bands (ev): -80.9608 -80.9608 -80.9596 -80.9596 -46.6591 -46.6591 -46.6568 -46.6568 -44.9494 -44.9494 -44.9488 -44.9488 -44.9046 -44.9046 -44.8998 -44.8998 -8.5041 -8.5041 -8.3801 -8.3801 4.1522 4.1522 4.2883 4.2883 5.3773 5.3773 5.5834 5.5834 5.6812 5.6812 5.7921 5.7921 9.5314 9.5314 9.6339 9.6339 9.9522 9.9522 10.0181 10.0181 10.1224 10.1224 10.1556 10.1556 10.6742 10.6742 10.7484 10.7484 11.3693 11.3693 11.4594 11.4594 16.8517 16.8517 17.1351 17.1351 k = 0.5000 0.2887 0.1429 ( 3820 PWs) bands (ev): -80.9608 -80.9608 -80.9596 -80.9596 -46.6592 -46.6592 -46.6567 -46.6567 -44.9494 -44.9494 -44.9488 -44.9488 -44.9048 -44.9048 -44.8997 -44.8997 -8.5077 -8.5077 -8.3774 -8.3774 4.1651 4.1651 4.3077 4.3077 5.3632 5.3632 5.5788 5.5788 5.6830 5.6830 5.7983 5.7983 9.5127 9.5127 9.6175 9.6175 9.9470 9.9470 10.0138 10.0138 10.1164 10.1164 10.1567 10.1567 10.6656 10.6656 10.7285 10.7285 11.3834 11.3834 11.4732 11.4732 16.8680 16.8680 17.1509 17.1509 k = 0.5000 0.2887 0.1327 ( 3822 PWs) bands (ev): -80.9607 -80.9607 -80.9598 -80.9598 -46.6593 -46.6593 -46.6566 -46.6566 -44.9494 -44.9494 -44.9487 -44.9487 -44.9049 -44.9049 -44.8996 -44.8996 -8.5111 -8.5111 -8.3748 -8.3748 4.1783 4.1783 4.3270 4.3270 5.3493 5.3493 5.5745 5.5745 5.6842 5.6842 5.8041 5.8041 9.4941 9.4941 9.6007 9.6007 9.9419 9.9419 10.0095 10.0095 10.1083 10.1083 10.1600 10.1600 10.6581 10.6581 10.7098 10.7098 11.3962 11.3962 11.4854 11.4854 16.8856 16.8856 17.1656 17.1656 k = 0.5000 0.2887 0.1225 ( 3814 PWs) bands (ev): -80.9605 -80.9605 -80.9595 -80.9595 -46.6592 -46.6592 -46.6565 -46.6565 -44.9494 -44.9494 -44.9487 -44.9487 -44.9050 -44.9050 -44.8995 -44.8995 -8.5143 -8.5143 -8.3725 -8.3725 4.1917 4.1917 4.3460 4.3460 5.3358 5.3358 5.5705 5.5705 5.6850 5.6850 5.8096 5.8096 9.4762 9.4762 9.5838 9.5838 9.9378 9.9378 10.0063 10.0063 10.1007 10.1007 10.1649 10.1649 10.6508 10.6508 10.6940 10.6940 11.4086 11.4086 11.4972 11.4972 16.9043 16.9043 17.1797 17.1797 k = 0.5000 0.2887 0.1123 ( 3808 PWs) bands (ev): -80.9603 -80.9603 -80.9594 -80.9594 -46.6593 -46.6593 -46.6564 -46.6564 -44.9493 -44.9493 -44.9486 -44.9486 -44.9051 -44.9051 -44.8993 -44.8993 -8.5172 -8.5172 -8.3703 -8.3703 4.2051 4.2051 4.3644 4.3644 5.3228 5.3228 5.5668 5.5668 5.6853 5.6853 5.8148 5.8148 9.4590 9.4590 9.5669 9.5669 9.9337 9.9337 10.0031 10.0031 10.0929 10.0929 10.1702 10.1702 10.6421 10.6421 10.6815 10.6815 11.4199 11.4199 11.5080 11.5080 16.9235 16.9235 17.1926 17.1926 k = 0.5000 0.2887 0.1021 ( 3816 PWs) bands (ev): -80.9605 -80.9605 -80.9596 -80.9596 -46.6594 -46.6594 -46.6564 -46.6564 -44.9494 -44.9494 -44.9486 -44.9486 -44.9053 -44.9053 -44.8993 -44.8993 -8.5200 -8.5200 -8.3683 -8.3683 4.2181 4.2181 4.3821 4.3821 5.3102 5.3102 5.5633 5.5633 5.6851 5.6851 5.8195 5.8195 9.4417 9.4417 9.5489 9.5489 9.9295 9.9295 9.9999 9.9999 10.0851 10.0851 10.1749 10.1749 10.6298 10.6298 10.6712 10.6712 11.4295 11.4295 11.5168 11.5168 16.9426 16.9426 17.2044 17.2044 k = 0.5000 0.2887 0.0919 ( 3816 PWs) bands (ev): -80.9605 -80.9605 -80.9596 -80.9596 -46.6594 -46.6594 -46.6563 -46.6563 -44.9494 -44.9494 -44.9486 -44.9486 -44.9054 -44.9054 -44.8992 -44.8992 -8.5226 -8.5226 -8.3665 -8.3665 4.2308 4.2308 4.3989 4.3989 5.2982 5.2982 5.5603 5.5603 5.6846 5.6846 5.8239 5.8239 9.4255 9.4255 9.5323 9.5323 9.9259 9.9259 9.9971 9.9971 10.0781 10.0781 10.1806 10.1806 10.6173 10.6173 10.6652 10.6652 11.4383 11.4383 11.5248 11.5248 16.9615 16.9615 17.2151 17.2151 k = 0.5000 0.2887 0.0817 ( 3808 PWs) bands (ev): -80.9604 -80.9604 -80.9593 -80.9593 -46.6594 -46.6594 -46.6563 -46.6563 -44.9493 -44.9493 -44.9486 -44.9486 -44.9054 -44.9054 -44.8991 -44.8991 -8.5248 -8.5248 -8.3648 -8.3648 4.2430 4.2430 4.4147 4.4147 5.2870 5.2870 5.5575 5.5575 5.6838 5.6838 5.8279 5.8279 9.4112 9.4112 9.5169 9.5169 9.9230 9.9230 9.9949 9.9949 10.0722 10.0722 10.1871 10.1871 10.6050 10.6050 10.6618 10.6618 11.4467 11.4467 11.5324 11.5324 16.9799 16.9799 17.2248 17.2248 k = 0.5000 0.2887 0.0715 ( 3800 PWs) bands (ev): -80.9601 -80.9601 -80.9590 -80.9590 -46.6593 -46.6593 -46.6562 -46.6562 -44.9493 -44.9493 -44.9485 -44.9485 -44.9053 -44.9053 -44.8989 -44.8989 -8.5269 -8.5269 -8.3634 -8.3634 4.2543 4.2543 4.4292 4.4292 5.2767 5.2767 5.5551 5.5551 5.6830 5.6830 5.8315 5.8315 9.3983 9.3983 9.5029 9.5029 9.9203 9.9203 9.9931 9.9931 10.0670 10.0670 10.1926 10.1926 10.5926 10.5926 10.6601 10.6601 11.4540 11.4540 11.5395 11.5395 16.9976 16.9976 17.2334 17.2334 k = 0.5000 0.2887 0.0613 ( 3800 PWs) bands (ev): -80.9602 -80.9602 -80.9590 -80.9590 -46.6593 -46.6593 -46.6561 -46.6561 -44.9493 -44.9493 -44.9485 -44.9485 -44.9054 -44.9054 -44.8989 -44.8989 -8.5287 -8.5287 -8.3622 -8.3622 4.2646 4.2646 4.4422 4.4422 5.2674 5.2674 5.5530 5.5530 5.6819 5.6819 5.8346 5.8346 9.3861 9.3861 9.4895 9.4895 9.9179 9.9179 9.9912 9.9912 10.0625 10.0625 10.1977 10.1977 10.5809 10.5809 10.6581 10.6581 11.4599 11.4599 11.5448 11.5448 17.0135 17.0135 17.2409 17.2409 k = 0.5000 0.2887 0.0510 ( 3804 PWs) bands (ev): -80.9604 -80.9604 -80.9590 -80.9590 -46.6594 -46.6594 -46.6561 -46.6561 -44.9493 -44.9493 -44.9485 -44.9485 -44.9055 -44.9055 -44.8989 -44.8989 -8.5302 -8.5302 -8.3611 -8.3611 4.2737 4.2737 4.4535 4.4535 5.2593 5.2593 5.5510 5.5510 5.6808 5.6808 5.8373 5.8373 9.3755 9.3755 9.4779 9.4779 9.9155 9.9155 9.9892 9.9892 10.0585 10.0585 10.2020 10.2020 10.5703 10.5703 10.6567 10.6567 11.4643 11.4643 11.5489 11.5489 17.0277 17.0277 17.2472 17.2472 k = 0.5000 0.2887 0.0408 ( 3808 PWs) bands (ev): -80.9604 -80.9604 -80.9592 -80.9592 -46.6595 -46.6595 -46.6561 -46.6561 -44.9493 -44.9493 -44.9485 -44.9485 -44.9056 -44.9056 -44.8989 -44.8989 -8.5315 -8.5315 -8.3602 -8.3602 4.2814 4.2814 4.4629 4.4629 5.2524 5.2524 5.5494 5.5494 5.6798 5.6798 5.8395 5.8395 9.3664 9.3664 9.4677 9.4677 9.9138 9.9138 9.9877 9.9877 10.0554 10.0554 10.2056 10.2056 10.5612 10.5612 10.6550 10.6550 11.4681 11.4681 11.5523 11.5523 17.0398 17.0398 17.2523 17.2523 k = 0.5000 0.2887 0.0306 ( 3806 PWs) bands (ev): -80.9605 -80.9605 -80.9590 -80.9590 -46.6594 -46.6594 -46.6561 -46.6561 -44.9493 -44.9493 -44.9485 -44.9485 -44.9056 -44.9056 -44.8989 -44.8989 -8.5325 -8.5325 -8.3595 -8.3595 4.2876 4.2876 4.4704 4.4704 5.2470 5.2470 5.5483 5.5483 5.6789 5.6789 5.8412 5.8412 9.3595 9.3595 9.4602 9.4602 9.9126 9.9126 9.9866 9.9866 10.0531 10.0531 10.2093 10.2093 10.5544 10.5544 10.6546 10.6546 11.4712 11.4712 11.5552 11.5552 17.0494 17.0494 17.2564 17.2564 k = 0.5000 0.2887 0.0204 ( 3814 PWs) bands (ev): -80.9607 -80.9607 -80.9593 -80.9593 -46.6595 -46.6595 -46.6562 -46.6562 -44.9494 -44.9494 -44.9485 -44.9485 -44.9056 -44.9056 -44.8989 -44.8989 -8.5332 -8.5332 -8.3591 -8.3591 4.2922 4.2922 4.4759 4.4759 5.2429 5.2429 5.5473 5.5473 5.6782 5.6782 5.8424 5.8424 9.3543 9.3543 9.4543 9.4543 9.9106 9.9106 9.9853 9.9853 10.0509 10.0509 10.2114 10.2114 10.5489 10.5489 10.6538 10.6538 11.4726 11.4726 11.5566 11.5566 17.0566 17.0566 17.2591 17.2591 k = 0.5000 0.2887 0.0102 ( 3804 PWs) bands (ev): -80.9607 -80.9607 -80.9587 -80.9587 -46.6593 -46.6593 -46.6562 -46.6562 -44.9492 -44.9492 -44.9485 -44.9485 -44.9055 -44.9055 -44.8989 -44.8989 -8.5336 -8.5336 -8.3588 -8.3588 4.2950 4.2950 4.4793 4.4793 5.2406 5.2406 5.5468 5.5468 5.6778 5.6778 5.8432 5.8432 9.3520 9.3520 9.4511 9.4511 9.9109 9.9109 9.9853 9.9853 10.0506 10.0506 10.2139 10.2139 10.5466 10.5466 10.6536 10.6536 11.4746 11.4746 11.5585 11.5585 17.0609 17.0609 17.2611 17.2611 k = 0.5000 0.2887-0.0000 ( 3814 PWs) bands (ev): -80.9607 -80.9607 -80.9593 -80.9593 -46.6595 -46.6595 -46.6562 -46.6562 -44.9493 -44.9493 -44.9485 -44.9485 -44.9057 -44.9057 -44.8989 -44.8989 -8.5337 -8.5337 -8.3587 -8.3587 4.2959 4.2959 4.4804 4.4804 5.2398 5.2398 5.5466 5.5466 5.6776 5.6776 5.8434 5.8434 9.3505 9.3505 9.4493 9.4493 9.9099 9.9099 9.9850 9.9850 10.0498 10.0498 10.2130 10.2130 10.5446 10.5446 10.6527 10.6527 11.4746 11.4746 11.5585 11.5585 17.0623 17.0623 17.2616 17.2616 k = 0.3333 0.5774-0.0000 ( 3786 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6608 -46.6582 -46.6575 -46.6575 -44.9517 -44.9517 -44.9482 -44.9482 -44.9052 -44.9023 -44.9023 -44.9019 -8.4115 -8.4013 -8.3987 -8.3987 4.8601 4.8601 4.9232 4.9232 5.1101 5.1187 5.1310 5.1310 5.5554 5.5701 5.5701 5.5837 9.1255 9.1255 9.3229 9.4310 9.4310 9.4808 9.5847 9.5847 10.2776 10.2776 10.5972 10.5972 10.6350 10.7060 10.7224 10.7224 11.1102 11.1451 11.1451 11.2163 18.5039 18.5039 18.7853 18.7853 k = 0.3333 0.5774 0.0102 ( 3783 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6608 -46.6582 -46.6575 -46.6575 -44.9517 -44.9517 -44.9482 -44.9482 -44.9051 -44.9023 -44.9023 -44.9019 -8.4115 -8.4012 -8.3987 -8.3987 4.8601 4.8601 4.9232 4.9232 5.1072 5.1159 5.1281 5.1281 5.5577 5.5725 5.5725 5.5859 9.1257 9.1257 9.3248 9.4328 9.4328 9.4827 9.5845 9.5845 10.2779 10.2779 10.5972 10.5972 10.6350 10.7059 10.7224 10.7224 11.1104 11.1453 11.1453 11.2165 18.5039 18.5039 18.7848 18.7848 k = 0.3333 0.5774 0.0204 ( 3783 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6608 -46.6582 -46.6575 -46.6575 -44.9517 -44.9517 -44.9482 -44.9482 -44.9051 -44.9023 -44.9023 -44.9019 -8.4114 -8.4012 -8.3986 -8.3986 4.8602 4.8602 4.9231 4.9231 5.0988 5.1077 5.1195 5.1195 5.5646 5.5794 5.5794 5.5924 9.1266 9.1266 9.3293 9.4371 9.4371 9.4871 9.5837 9.5837 10.2788 10.2788 10.5967 10.5967 10.6343 10.7054 10.7217 10.7217 11.1106 11.1451 11.1451 11.2164 18.5039 18.5039 18.7830 18.7830 k = 0.3333 0.5774 0.0306 ( 3786 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6608 -46.6582 -46.6575 -46.6575 -44.9518 -44.9518 -44.9483 -44.9483 -44.9051 -44.9023 -44.9023 -44.9019 -8.4112 -8.4011 -8.3985 -8.3985 4.8604 4.8604 4.9228 4.9228 5.0854 5.0947 5.1059 5.1059 5.5754 5.5903 5.5903 5.6025 9.1279 9.1279 9.3366 9.4440 9.4440 9.4943 9.5821 9.5821 10.2803 10.2803 10.5955 10.5955 10.6327 10.7042 10.7199 10.7199 11.1108 11.1447 11.1447 11.2161 18.5038 18.5038 18.7796 18.7796 k = 0.3333 0.5774 0.0408 ( 3789 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6608 -46.6582 -46.6575 -46.6575 -44.9518 -44.9518 -44.9483 -44.9483 -44.9051 -44.9022 -44.9022 -44.9019 -8.4110 -8.4010 -8.3983 -8.3983 4.8607 4.8607 4.9223 4.9223 5.0678 5.0775 5.0881 5.0881 5.5893 5.6044 5.6044 5.6158 9.1294 9.1294 9.3471 9.4540 9.4540 9.5046 9.5801 9.5801 10.2822 10.2822 10.5939 10.5939 10.6307 10.7026 10.7175 10.7175 11.1112 11.1443 11.1443 11.2159 18.5036 18.5036 18.7750 18.7750 k = 0.3333 0.5774 0.0510 ( 3798 PWs) bands (ev): -80.9595 -80.9595 -80.9595 -80.9595 -46.6609 -46.6583 -46.6576 -46.6576 -44.9519 -44.9519 -44.9483 -44.9483 -44.9052 -44.9023 -44.9023 -44.9021 -8.4107 -8.4008 -8.3981 -8.3981 4.8610 4.8610 4.9219 4.9219 5.0468 5.0567 5.0667 5.0667 5.6057 5.6208 5.6208 5.6313 9.1316 9.1316 9.3594 9.4655 9.4655 9.5168 9.5779 9.5779 10.2836 10.2836 10.5920 10.5920 10.6280 10.7006 10.7150 10.7150 11.1109 11.1428 11.1428 11.2146 18.5034 18.5034 18.7697 18.7697 k = 0.3333 0.5774 0.0613 ( 3795 PWs) bands (ev): -80.9594 -80.9594 -80.9594 -80.9594 -46.6608 -46.6583 -46.6576 -46.6576 -44.9519 -44.9519 -44.9483 -44.9483 -44.9051 -44.9023 -44.9023 -44.9020 -8.4104 -8.4006 -8.3978 -8.3978 4.8614 4.8614 4.9214 4.9214 5.0233 5.0335 5.0429 5.0429 5.6238 5.6389 5.6389 5.6485 9.1345 9.1345 9.3755 9.4803 9.4803 9.5326 9.5757 9.5757 10.2869 10.2869 10.5902 10.5902 10.6254 10.6988 10.7128 10.7128 11.1116 11.1422 11.1422 11.2142 18.5033 18.5033 18.7637 18.7637 k = 0.3333 0.5774 0.0715 ( 3795 PWs) bands (ev): -80.9594 -80.9594 -80.9594 -80.9594 -46.6608 -46.6583 -46.6576 -46.6576 -44.9519 -44.9519 -44.9483 -44.9483 -44.9051 -44.9022 -44.9022 -44.9021 -8.4100 -8.4004 -8.3975 -8.3975 4.8618 4.8618 4.9208 4.9208 4.9979 5.0083 5.0172 5.0172 5.6429 5.6580 5.6580 5.6667 9.1380 9.1380 9.3939 9.4966 9.4966 9.5507 9.5737 9.5737 10.2907 10.2907 10.5878 10.5878 10.6219 10.6963 10.7095 10.7095 11.1124 11.1413 11.1413 11.2137 18.5032 18.5032 18.7565 18.7565 k = 0.3333 0.5774 0.0817 ( 3789 PWs) bands (ev): -80.9592 -80.9592 -80.9592 -80.9592 -46.6607 -46.6583 -46.6575 -46.6575 -44.9519 -44.9519 -44.9483 -44.9483 -44.9050 -44.9022 -44.9022 -44.9021 -8.4096 -8.4002 -8.3972 -8.3972 4.8624 4.8624 4.9202 4.9202 4.9711 4.9816 4.9902 4.9902 5.6626 5.6776 5.6776 5.6855 9.1423 9.1423 9.4152 9.5136 9.5136 9.5716 9.5734 9.5734 10.2952 10.2952 10.5853 10.5853 10.6183 10.6936 10.7067 10.7067 11.1137 11.1407 11.1407 11.2133 18.5034 18.5034 18.7490 18.7490 k = 0.3333 0.5774 0.0919 ( 3804 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6608 -46.6585 -46.6577 -46.6577 -44.9520 -44.9520 -44.9483 -44.9483 -44.9051 -44.9023 -44.9023 -44.9023 -8.4091 -8.3999 -8.3968 -8.3968 4.8629 4.8629 4.9193 4.9193 4.9435 4.9540 4.9623 4.9623 5.6824 5.6972 5.6972 5.7043 9.1463 9.1463 9.4371 9.5268 9.5268 9.5768 9.5768 9.5931 10.2977 10.2977 10.5816 10.5816 10.6129 10.6897 10.7022 10.7022 11.1133 11.1379 11.1379 11.2109 18.5031 18.5031 18.7401 18.7401 k = 0.3333 0.5774 0.1021 ( 3804 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6608 -46.6585 -46.6577 -46.6577 -44.9520 -44.9520 -44.9483 -44.9483 -44.9050 -44.9022 -44.9022 -44.9022 -8.4085 -8.3997 -8.3964 -8.3964 4.8635 4.8635 4.9156 4.9184 4.9184 4.9261 4.9343 4.9343 5.7020 5.7167 5.7167 5.7230 9.1501 9.1501 9.4629 9.5339 9.5339 9.5896 9.5896 9.6183 10.3026 10.3026 10.5776 10.5776 10.6076 10.6854 10.6985 10.6985 11.1141 11.1367 11.1367 11.2099 18.5026 18.5026 18.7314 18.7314 k = 0.3333 0.5774 0.1123 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9596 -46.6607 -46.6585 -46.6577 -46.6577 -44.9521 -44.9521 -44.9483 -44.9483 -44.9050 -44.9023 -44.9022 -44.9022 -8.4080 -8.3994 -8.3960 -8.3960 4.8642 4.8642 4.8875 4.8978 4.9053 4.9053 4.9181 4.9181 5.7213 5.7358 5.7358 5.7413 9.1552 9.1552 9.4902 9.5338 9.5338 9.6108 9.6108 9.6449 10.3083 10.3083 10.5733 10.5733 10.6018 10.6808 10.6933 10.6933 11.1153 11.1352 11.1352 11.2088 18.5027 18.5027 18.7215 18.7215 k = 0.3333 0.5774 0.1225 ( 3804 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6607 -46.6586 -46.6577 -46.6577 -44.9521 -44.9521 -44.9483 -44.9483 -44.9049 -44.9023 -44.9022 -44.9022 -8.4074 -8.3991 -8.3956 -8.3956 4.8596 4.8643 4.8643 4.8697 4.8780 4.8780 4.9168 4.9168 5.7400 5.7543 5.7543 5.7591 9.1608 9.1608 9.5193 9.5301 9.5301 9.6369 9.6369 9.6732 10.3145 10.3145 10.5686 10.5686 10.5953 10.6757 10.6877 10.6877 11.1166 11.1336 11.1336 11.2075 18.5028 18.5028 18.7112 18.7112 k = 0.3333 0.5774 0.1327 ( 3804 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6607 -46.6586 -46.6577 -46.6577 -44.9521 -44.9521 -44.9483 -44.9483 -44.9049 -44.9024 -44.9022 -44.9022 -8.4068 -8.3988 -8.3951 -8.3951 4.8322 4.8419 4.8486 4.8486 4.8668 4.8668 4.9157 4.9157 5.7579 5.7720 5.7720 5.7760 9.1672 9.1672 9.5249 9.5249 9.5496 9.6655 9.6655 9.7024 10.3219 10.3219 10.5637 10.5637 10.5883 10.6704 10.6815 10.6815 11.1176 11.1312 11.1312 11.2054 18.5032 18.5032 18.7006 18.7006 k = 0.3333 0.5774 0.1429 ( 3804 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6606 -46.6587 -46.6577 -46.6577 -44.9521 -44.9521 -44.9483 -44.9483 -44.9049 -44.9025 -44.9021 -44.9021 -8.4061 -8.3985 -8.3946 -8.3946 4.8053 4.8148 4.8219 4.8219 4.8674 4.8674 4.9145 4.9145 5.7751 5.7889 5.7889 5.7922 9.1735 9.1735 9.5184 9.5184 9.5816 9.6965 9.6965 9.7332 10.3288 10.3288 10.5579 10.5579 10.5805 10.6640 10.6750 10.6750 11.1191 11.1293 11.1293 11.2038 18.5035 18.5035 18.6898 18.6898 k = 0.3333 0.5774 0.1531 ( 3804 PWs) bands (ev): -80.9596 -80.9596 -80.9596 -80.9596 -46.6606 -46.6587 -46.6577 -46.6577 -44.9522 -44.9522 -44.9483 -44.9483 -44.9048 -44.9025 -44.9021 -44.9021 -8.4055 -8.3982 -8.3942 -8.3942 4.7794 4.7884 4.7956 4.7956 4.8683 4.8683 4.9132 4.9132 5.7914 5.8049 5.8049 5.8075 9.1798 9.1798 9.5113 9.5113 9.6149 9.7292 9.7292 9.7650 10.3364 10.3364 10.5511 10.5511 10.5717 10.6566 10.6676 10.6676 11.1211 11.1278 11.1278 11.2024 18.5038 18.5038 18.6787 18.6787 k = 0.3333 0.5774 0.1634 ( 3798 PWs) bands (ev): -80.9595 -80.9595 -80.9595 -80.9595 -46.6605 -46.6587 -46.6576 -46.6576 -44.9522 -44.9522 -44.9482 -44.9482 -44.9047 -44.9025 -44.9020 -44.9020 -8.4048 -8.3979 -8.3937 -8.3937 4.7545 4.7631 4.7704 4.7704 4.8694 4.8694 4.9119 4.9119 5.8068 5.8199 5.8199 5.8219 9.1870 9.1870 9.5036 9.5036 9.6494 9.7633 9.7633 9.7976 10.3449 10.3449 10.5443 10.5443 10.5628 10.6489 10.6605 10.6605 11.1233 11.1263 11.1263 11.2010 18.5047 18.5047 18.6679 18.6679 k = 0.3333 0.5774 0.1736 ( 3798 PWs) bands (ev): -80.9595 -80.9595 -80.9595 -80.9595 -46.6604 -46.6588 -46.6576 -46.6576 -44.9522 -44.9522 -44.9482 -44.9482 -44.9046 -44.9026 -44.9020 -44.9020 -8.4041 -8.3976 -8.3932 -8.3932 4.7306 4.7388 4.7463 4.7463 4.8704 4.8704 4.9106 4.9106 5.8212 5.8339 5.8339 5.8353 9.1943 9.1943 9.4953 9.4953 9.6841 9.7977 9.7977 9.8301 10.3517 10.3517 10.5367 10.5367 10.5532 10.6404 10.6530 10.6530 11.1243 11.1243 11.1253 11.1990 18.5055 18.5055 18.6571 18.6571 k = 0.3333 0.5774 0.1838 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6604 -46.6589 -46.6577 -46.6577 -44.9523 -44.9523 -44.9483 -44.9483 -44.9046 -44.9027 -44.9020 -44.9020 -8.4034 -8.3974 -8.3928 -8.3928 4.7081 4.7157 4.7234 4.7234 4.8716 4.8716 4.9092 4.9092 5.8344 5.8468 5.8468 5.8475 9.2018 9.2018 9.4867 9.4867 9.7187 9.8320 9.8320 9.8619 10.3584 10.3584 10.5284 10.5284 10.5427 10.6307 10.6444 10.6444 11.1218 11.1218 11.1270 11.1963 18.5064 18.5064 18.6462 18.6462 k = 0.3333 0.5774 0.1940 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6604 -46.6589 -46.6577 -46.6577 -44.9523 -44.9523 -44.9483 -44.9483 -44.9045 -44.9028 -44.9020 -44.9020 -8.4028 -8.3972 -8.3923 -8.3923 4.6870 4.6941 4.7020 4.7020 4.8728 4.8728 4.9078 4.9078 5.8467 5.8587 5.8587 5.8588 9.2095 9.2095 9.4780 9.4780 9.7539 9.8670 9.8670 9.8937 10.3655 10.3655 10.5201 10.5201 10.5322 10.6206 10.6361 10.6361 11.1196 11.1196 11.1291 11.1938 18.5077 18.5077 18.6357 18.6357 k = 0.3333 0.5774 0.2042 ( 3804 PWs) bands (ev): -80.9597 -80.9597 -80.9597 -80.9597 -46.6603 -46.6590 -46.6577 -46.6577 -44.9524 -44.9524 -44.9483 -44.9483 -44.9045 -44.9029 -44.9019 -44.9019 -8.4021 -8.3970 -8.3919 -8.3919 4.6674 4.6739 4.6820 4.6820 4.8740 4.8740 4.9063 4.9063 5.8580 5.8690 5.8695 5.8695 9.2174 9.2174 9.4691 9.4691 9.7890 9.9019 9.9019 9.9247 10.3722 10.3722 10.5116 10.5116 10.5216 10.6098 10.6275 10.6275 11.1174 11.1174 11.1313 11.1911 18.5091 18.5091 18.6255 18.6255 k = 0.3333 0.5774 0.2144 ( 3798 PWs) bands (ev): -80.9595 -80.9595 -80.9595 -80.9595 -46.6602 -46.6590 -46.6576 -46.6576 -44.9524 -44.9524 -44.9482 -44.9482 -44.9044 -44.9029 -44.9019 -44.9019 -8.4015 -8.3968 -8.3915 -8.3915 4.6495 4.6554 4.6637 4.6637 4.8753 4.8753 4.9049 4.9049 5.8682 5.8781 5.8793 5.8793 9.2258 9.2258 9.4602 9.4602 9.8241 9.9367 9.9367 9.9548 10.3782 10.3782 10.5037 10.5037 10.5113 10.5987 10.6197 10.6197 11.1155 11.1155 11.1338 11.1885 18.5110 18.5110 18.6160 18.6160 k = 0.3333 0.5774 0.2246 ( 3798 PWs) bands (ev): -80.9595 -80.9595 -80.9595 -80.9595 -46.6601 -46.6591 -46.6576 -46.6576 -44.9524 -44.9524 -44.9482 -44.9482 -44.9043 -44.9030 -44.9018 -44.9018 -8.4009 -8.3967 -8.3911 -8.3911 4.6332 4.6386 4.6471 4.6471 4.8767 4.8767 4.9034 4.9034 5.8774 5.8862 5.8880 5.8880 9.2338 9.2338 9.4513 9.4513 9.8581 9.9704 9.9704 9.9825 10.3828 10.3828 10.4960 10.4960 10.5009 10.5864 10.6107 10.6107 11.1135 11.1135 11.1362 11.1856 18.5130 18.5130 18.6066 18.6066 k = 0.3333 0.5774 0.2348 ( 3792 PWs) bands (ev): -80.9593 -80.9593 -80.9593 -80.9593 -46.6600 -46.6591 -46.6576 -46.6576 -44.9523 -44.9523 -44.9481 -44.9481 -44.9042 -44.9030 -44.9018 -44.9018 -8.4003 -8.3966 -8.3908 -8.3908 4.6188 4.6235 4.6323 4.6323 4.8780 4.8780 4.9019 4.9019 5.8856 5.8933 5.8957 5.8957 9.2426 9.2426 9.4429 9.4429 9.8912 10.0032 10.0032 10.0079 10.3859 10.3859 10.4901 10.4901 10.4921 10.5743 10.6019 10.6019 11.1119 11.1119 11.1392 11.1829 18.5155 18.5155 18.5977 18.5977 k = 0.3333 0.5774 0.2450 ( 3792 PWs) bands (ev): -80.9593 -80.9593 -80.9593 -80.9593 -46.6599 -46.6591 -46.6576 -46.6576 -44.9524 -44.9524 -44.9481 -44.9481 -44.9041 -44.9031 -44.9018 -44.9018 -8.3997 -8.3965 -8.3905 -8.3905 4.6061 4.6102 4.6193 4.6193 4.8794 4.8794 4.9004 4.9004 5.8927 5.8993 5.9023 5.9023 9.2502 9.2502 9.4346 9.4346 9.9229 10.0299 10.0342 10.0342 10.3860 10.3860 10.4837 10.4857 10.4857 10.5609 10.5930 10.5930 11.1102 11.1102 11.1419 11.1798 18.5180 18.5180 18.5892 18.5892 k = 0.3333 0.5774 0.2552 ( 3795 PWs) bands (ev): -80.9594 -80.9594 -80.9594 -80.9594 -46.6599 -46.6592 -46.6576 -46.6576 -44.9524 -44.9524 -44.9482 -44.9482 -44.9040 -44.9032 -44.9018 -44.9018 -8.3992 -8.3965 -8.3902 -8.3902 4.5954 4.5988 4.6082 4.6082 4.8807 4.8807 4.8989 4.8989 5.8988 5.9043 5.9079 5.9079 9.2573 9.2573 9.4266 9.4266 9.9526 10.0477 10.0630 10.0630 10.3825 10.3825 10.4770 10.4831 10.4831 10.5470 10.5842 10.5842 11.1089 11.1089 11.1449 11.1768 18.5208 18.5208 18.5812 18.5812 k = 0.3333 0.5774 0.2655 ( 3783 PWs) bands (ev): -80.9590 -80.9590 -80.9590 -80.9590 -46.6597 -46.6592 -46.6575 -46.6575 -44.9524 -44.9523 -44.9481 -44.9481 -44.9038 -44.9032 -44.9017 -44.9017 -8.3987 -8.3966 -8.3900 -8.3900 4.5867 4.5894 4.5991 4.5991 4.8821 4.8821 4.8976 4.8976 5.9039 5.9083 5.9125 5.9125 9.2641 9.2641 9.4200 9.4200 9.9815 10.0624 10.0902 10.0902 10.3780 10.3780 10.4730 10.4846 10.4846 10.5337 10.5772 10.5772 11.1079 11.1079 11.1481 11.1738 18.5242 18.5242 18.5745 18.5745 k = 0.3333 0.5774 0.2757 ( 3774 PWs) bands (ev): -80.9587 -80.9587 -80.9587 -80.9587 -46.6596 -46.6592 -46.6574 -46.6574 -44.9523 -44.9523 -44.9481 -44.9481 -44.9037 -44.9032 -44.9016 -44.9016 -8.3983 -8.3967 -8.3898 -8.3898 4.5800 4.5821 4.5921 4.5921 4.8834 4.8834 4.8964 4.8964 5.9080 5.9113 5.9161 5.9161 9.2699 9.2699 9.4142 9.4142 10.0073 10.0712 10.1134 10.1134 10.3715 10.3715 10.4720 10.4874 10.4874 10.5207 10.5703 10.5703 11.1076 11.1076 11.1518 11.1712 18.5276 18.5276 18.5683 18.5683 k = 0.3333 0.5774 0.2859 ( 3786 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6596 -46.6593 -46.6575 -46.6575 -44.9523 -44.9523 -44.9481 -44.9481 -44.9037 -44.9034 -44.9017 -44.9017 -8.3979 -8.3968 -8.3897 -8.3897 4.5752 4.5766 4.5869 4.5869 4.8844 4.8844 4.8951 4.8951 5.9109 5.9131 5.9185 5.9185 9.2743 9.2743 9.4097 9.4097 10.0280 10.0723 10.1298 10.1298 10.3638 10.3638 10.4730 10.4892 10.4892 10.5072 10.5630 10.5630 11.1062 11.1062 11.1544 11.1673 18.5305 18.5305 18.5626 18.5626 k = 0.3333 0.5774 0.2961 ( 3786 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6596 -46.6594 -46.6575 -46.6575 -44.9524 -44.9524 -44.9481 -44.9481 -44.9037 -44.9035 -44.9017 -44.9017 -8.3975 -8.3970 -8.3897 -8.3897 4.5724 4.5731 4.5838 4.5838 4.8853 4.8853 4.8943 4.8943 5.9129 5.9140 5.9200 5.9200 9.2771 9.2771 9.4066 9.4066 10.0463 10.0690 10.1414 10.1414 10.3585 10.3585 10.4777 10.4915 10.4915 10.4953 10.5588 10.5588 11.1057 11.1057 11.1575 11.1640 18.5331 18.5331 18.5585 18.5585 k = 0.3333 0.5774 0.3063 ( 3786 PWs) bands (ev): -80.9591 -80.9591 -80.9591 -80.9591 -46.6595 -46.6595 -46.6575 -46.6575 -44.9524 -44.9524 -44.9481 -44.9481 -44.9036 -44.9036 -44.9017 -44.9017 -8.3973 -8.3973 -8.3896 -8.3896 4.5718 4.5718 4.5828 4.5828 4.8856 4.8856 4.8940 4.8940 5.9140 5.9140 5.9205 5.9205 9.2780 9.2780 9.4056 9.4056 10.0602 10.0602 10.1454 10.1454 10.3566 10.3566 10.4853 10.4853 10.4924 10.4924 10.5573 10.5573 11.1055 11.1055 11.1607 11.1607 18.5342 18.5342 18.5570 18.5570 Writing output data file CoO.save init_run : 0.43s CPU 0.28s WALL ( 1 calls) electrons : 298.62s CPU 185.37s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.20s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 298.60s CPU 185.35s WALL ( 1 calls) v_of_rho : 0.10s CPU 0.05s WALL ( 1 calls) v_h : 0.08s CPU 0.04s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.08s CPU 0.05s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.25s CPU 0.43s WALL ( 411 calls) cegterg : 266.25s CPU 165.30s WALL ( 491 calls) Called by sum_band: Called by *egterg: h_psi : 174.72s CPU 101.31s WALL ( 7242 calls) s_psi : 3.92s CPU 2.31s WALL ( 7242 calls) g_psi : 0.32s CPU 0.22s WALL ( 6340 calls) cdiaghg : 81.98s CPU 56.28s WALL ( 6751 calls) cegterg:over : 12.98s CPU 7.66s WALL ( 6340 calls) cegterg:upda : 8.76s CPU 5.40s WALL ( 6340 calls) cegterg:last : 5.62s CPU 3.93s WALL ( 1313 calls) cdiaghg:chol : 4.34s CPU 3.08s WALL ( 6751 calls) cdiaghg:inve : 2.66s CPU 1.92s WALL ( 6751 calls) cdiaghg:para : 5.00s CPU 3.33s WALL ( 13502 calls) Called by h_psi: h_psi:vloc : 155.56s CPU 90.03s WALL ( 7242 calls) h_psi:vnl : 18.69s CPU 11.05s WALL ( 7242 calls) add_vuspsi : 10.62s CPU 6.14s WALL ( 7242 calls) General routines calbec : 8.03s CPU 4.88s WALL ( 7242 calls) fft : 0.04s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 148.24s CPU 85.78s WALL ( 843708 calls) interpolate : 0.01s CPU 0.00s WALL ( 4 calls) davcio : 0.55s CPU 1.11s WALL ( 822 calls) Parallel routines fft_scatter : 65.98s CPU 39.35s WALL ( 843731 calls) PWSCF : 5m17.69s CPU 3m39.53s WALL This run was terminated on: 15:46:17 10Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=