Program PWSCF v.5.4.0 starts on 12Feb2017 at 2:35:30 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: ./ScAlCO.save/ file Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 3P 3P renormalized 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 28 14 4 2356 834 138 Max 29 15 5 2375 873 153 Sum 1039 517 163 85353 30747 5189 bravais-lattice index = 14 lattice parameter (alat) = 6.1377 a.u. unit-cell volume = 627.2322 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 51.0000 Ry charge density cutoff = 402.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.137698 celldm(2)= 1.000000 celldm(3)= 3.132429 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 3.132429 ) 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 0.319241 ) 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 Sc read from file: /users/gautes/Pseudo/Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: e27f768e72ba10e20459589e24f2b6a7 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1173 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Sc 11.00 44.95590 Sc( 1.00) C 4.00 12.01070 C( 1.00) Al 3.00 26.98150 Al( 1.00) 6 Sym. Ops. (no inversion) found (note: 6 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 120 deg rotation - cryst. axis [0,0,1] cryst. s( 2) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 3) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 1 1 0 ) ( 0 -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 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 0 -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 ) double point group C_3v (3m) there are 6 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3s_v -3s_v G_4 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6 1.00 -1.00 -1.00 1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3s_v -3s_v G_4 0.00 0.00 0.00 0.00 0.00 0.00 G_5 0.00 0.00 0.00 0.00 1.00 -1.00 G_6 0.00 0.00 0.00 0.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 2 3 120 deg rotation - cryst. axis [0,0,1] -2C3 -2 -3 120 deg rotation - cryst. axis [0,0,1] E 3s_v 4 5 -6 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 6 -4 -5 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 365 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 2) = ( 0.0089286 0.0051549 -0.0000000), wk = 0.0027397 k( 3) = ( 0.0178571 0.0103098 -0.0000000), wk = 0.0027397 k( 4) = ( 0.0267857 0.0154647 -0.0000000), wk = 0.0027397 k( 5) = ( 0.0357143 0.0206197 -0.0000000), wk = 0.0027397 k( 6) = ( 0.0446429 0.0257746 -0.0000000), wk = 0.0027397 k( 7) = ( 0.0535714 0.0309295 -0.0000000), wk = 0.0027397 k( 8) = ( 0.0625000 0.0360844 -0.0000000), wk = 0.0027397 k( 9) = ( 0.0714286 0.0412393 -0.0000000), wk = 0.0027397 k( 10) = ( 0.0803571 0.0463942 -0.0000000), wk = 0.0027397 k( 11) = ( 0.0892857 0.0515491 -0.0000000), wk = 0.0027397 k( 12) = ( 0.0982143 0.0567040 -0.0000000), wk = 0.0027397 k( 13) = ( 0.1071429 0.0618590 -0.0000000), wk = 0.0027397 k( 14) = ( 0.1160714 0.0670139 -0.0000000), wk = 0.0027397 k( 15) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0027397 k( 16) = ( 0.1339286 0.0773237 -0.0000000), wk = 0.0027397 k( 17) = ( 0.1428571 0.0824786 -0.0000000), wk = 0.0027397 k( 18) = ( 0.1517857 0.0876335 -0.0000000), wk = 0.0027397 k( 19) = ( 0.1607143 0.0927884 -0.0000000), wk = 0.0027397 k( 20) = ( 0.1696429 0.0979434 -0.0000000), wk = 0.0027397 k( 21) = ( 0.1785714 0.1030983 -0.0000000), wk = 0.0027397 k( 22) = ( 0.1875000 0.1082532 -0.0000000), wk = 0.0027397 k( 23) = ( 0.1964286 0.1134081 -0.0000000), wk = 0.0027397 k( 24) = ( 0.2053571 0.1185630 -0.0000000), wk = 0.0027397 k( 25) = ( 0.2142857 0.1237179 -0.0000000), wk = 0.0027397 k( 26) = ( 0.2232143 0.1288728 -0.0000000), wk = 0.0027397 k( 27) = ( 0.2321429 0.1340277 -0.0000000), wk = 0.0027397 k( 28) = ( 0.2410714 0.1391827 -0.0000000), wk = 0.0027397 k( 29) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0027397 k( 30) = ( 0.2589286 0.1494925 -0.0000000), wk = 0.0027397 k( 31) = ( 0.2678571 0.1546474 -0.0000000), wk = 0.0027397 k( 32) = ( 0.2767857 0.1598023 -0.0000000), wk = 0.0027397 k( 33) = ( 0.2857143 0.1649572 -0.0000000), wk = 0.0027397 k( 34) = ( 0.2946429 0.1701121 -0.0000000), wk = 0.0027397 k( 35) = ( 0.3035714 0.1752670 -0.0000000), wk = 0.0027397 k( 36) = ( 0.3125000 0.1804220 -0.0000000), wk = 0.0027397 k( 37) = ( 0.3214286 0.1855769 -0.0000000), wk = 0.0027397 k( 38) = ( 0.3303571 0.1907318 -0.0000000), wk = 0.0027397 k( 39) = ( 0.3392857 0.1958867 -0.0000000), wk = 0.0027397 k( 40) = ( 0.3482143 0.2010416 -0.0000000), wk = 0.0027397 k( 41) = ( 0.3571429 0.2061965 -0.0000000), wk = 0.0027397 k( 42) = ( 0.3660714 0.2113514 -0.0000000), wk = 0.0027397 k( 43) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0027397 k( 44) = ( 0.3839286 0.2216613 -0.0000000), wk = 0.0027397 k( 45) = ( 0.3928571 0.2268162 -0.0000000), wk = 0.0027397 k( 46) = ( 0.4017857 0.2319711 -0.0000000), wk = 0.0027397 k( 47) = ( 0.4107143 0.2371260 -0.0000000), wk = 0.0027397 k( 48) = ( 0.4196429 0.2422809 -0.0000000), wk = 0.0027397 k( 49) = ( 0.4285714 0.2474358 -0.0000000), wk = 0.0027397 k( 50) = ( 0.4375000 0.2525907 -0.0000000), wk = 0.0027397 k( 51) = ( 0.4464286 0.2577457 -0.0000000), wk = 0.0027397 k( 52) = ( 0.4553571 0.2629006 -0.0000000), wk = 0.0027397 k( 53) = ( 0.4642857 0.2680555 -0.0000000), wk = 0.0027397 k( 54) = ( 0.4732143 0.2732104 -0.0000000), wk = 0.0027397 k( 55) = ( 0.4821429 0.2783653 -0.0000000), wk = 0.0027397 k( 56) = ( 0.4910714 0.2835202 -0.0000000), wk = 0.0027397 k( 57) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0027397 k( 58) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0027397 k( 59) = ( 0.4949495 0.2974229 -0.0000000), wk = 0.0027397 k( 60) = ( 0.4898990 0.3061706 -0.0000000), wk = 0.0027397 k( 61) = ( 0.4848485 0.3149183 -0.0000000), wk = 0.0027397 k( 62) = ( 0.4797980 0.3236661 -0.0000000), wk = 0.0027397 k( 63) = ( 0.4747475 0.3324138 -0.0000000), wk = 0.0027397 k( 64) = ( 0.4696970 0.3411615 -0.0000000), wk = 0.0027397 k( 65) = ( 0.4646465 0.3499093 -0.0000000), wk = 0.0027397 k( 66) = ( 0.4595960 0.3586570 -0.0000000), wk = 0.0027397 k( 67) = ( 0.4545455 0.3674047 -0.0000000), wk = 0.0027397 k( 68) = ( 0.4494950 0.3761524 -0.0000000), wk = 0.0027397 k( 69) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0027397 k( 70) = ( 0.4393939 0.3936479 -0.0000000), wk = 0.0027397 k( 71) = ( 0.4343434 0.4023956 -0.0000000), wk = 0.0027397 k( 72) = ( 0.4292929 0.4111434 -0.0000000), wk = 0.0027397 k( 73) = ( 0.4242424 0.4198911 -0.0000000), wk = 0.0027397 k( 74) = ( 0.4191919 0.4286388 -0.0000000), wk = 0.0027397 k( 75) = ( 0.4141414 0.4373866 -0.0000000), wk = 0.0027397 k( 76) = ( 0.4090909 0.4461343 -0.0000000), wk = 0.0027397 k( 77) = ( 0.4040404 0.4548820 -0.0000000), wk = 0.0027397 k( 78) = ( 0.3989899 0.4636298 -0.0000000), wk = 0.0027397 k( 79) = ( 0.3939394 0.4723775 -0.0000000), wk = 0.0027397 k( 80) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0027397 k( 81) = ( 0.3838384 0.4898730 -0.0000000), wk = 0.0027397 k( 82) = ( 0.3787879 0.4986207 -0.0000000), wk = 0.0027397 k( 83) = ( 0.3737374 0.5073684 -0.0000000), wk = 0.0027397 k( 84) = ( 0.3686869 0.5161161 -0.0000000), wk = 0.0027397 k( 85) = ( 0.3636364 0.5248639 -0.0000000), wk = 0.0027397 k( 86) = ( 0.3585859 0.5336116 -0.0000000), wk = 0.0027397 k( 87) = ( 0.3535354 0.5423593 -0.0000000), wk = 0.0027397 k( 88) = ( 0.3484849 0.5511071 -0.0000000), wk = 0.0027397 k( 89) = ( 0.3434343 0.5598548 -0.0000000), wk = 0.0027397 k( 90) = ( 0.3383838 0.5686025 -0.0000000), wk = 0.0027397 k( 91) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0027397 k( 92) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0027397 k( 93) = ( 0.3282051 0.5684680 -0.0000000), wk = 0.0027397 k( 94) = ( 0.3230769 0.5595856 -0.0000000), wk = 0.0027397 k( 95) = ( 0.3179487 0.5507033 -0.0000000), wk = 0.0027397 k( 96) = ( 0.3128205 0.5418210 -0.0000000), wk = 0.0027397 k( 97) = ( 0.3076923 0.5329387 -0.0000000), wk = 0.0027397 k( 98) = ( 0.3025641 0.5240564 -0.0000000), wk = 0.0027397 k( 99) = ( 0.2974359 0.5151741 -0.0000000), wk = 0.0027397 k( 100) = ( 0.2923077 0.5062918 -0.0000000), wk = 0.0027397 k( 101) = ( 0.2871795 0.4974095 -0.0000000), wk = 0.0027397 k( 102) = ( 0.2820513 0.4885271 -0.0000000), wk = 0.0027397 k( 103) = ( 0.2769231 0.4796448 -0.0000000), wk = 0.0027397 k( 104) = ( 0.2717949 0.4707625 -0.0000000), wk = 0.0027397 k( 105) = ( 0.2666667 0.4618802 -0.0000000), wk = 0.0027397 k( 106) = ( 0.2615385 0.4529979 -0.0000000), wk = 0.0027397 k( 107) = ( 0.2564103 0.4441156 -0.0000000), wk = 0.0027397 k( 108) = ( 0.2512820 0.4352333 -0.0000000), wk = 0.0027397 k( 109) = ( 0.2461539 0.4263510 -0.0000000), wk = 0.0027397 k( 110) = ( 0.2410256 0.4174687 -0.0000000), wk = 0.0027397 k( 111) = ( 0.2358974 0.4085864 -0.0000000), wk = 0.0027397 k( 112) = ( 0.2307692 0.3997040 -0.0000000), wk = 0.0027397 k( 113) = ( 0.2256410 0.3908217 -0.0000000), wk = 0.0027397 k( 114) = ( 0.2205128 0.3819394 -0.0000000), wk = 0.0027397 k( 115) = ( 0.2153846 0.3730571 -0.0000000), wk = 0.0027397 k( 116) = ( 0.2102564 0.3641748 -0.0000000), wk = 0.0027397 k( 117) = ( 0.2051282 0.3552925 -0.0000000), wk = 0.0027397 k( 118) = ( 0.2000000 0.3464102 -0.0000000), wk = 0.0027397 k( 119) = ( 0.1948718 0.3375278 -0.0000000), wk = 0.0027397 k( 120) = ( 0.1897436 0.3286455 -0.0000000), wk = 0.0027397 k( 121) = ( 0.1846154 0.3197632 -0.0000000), wk = 0.0027397 k( 122) = ( 0.1794872 0.3108809 -0.0000000), wk = 0.0027397 k( 123) = ( 0.1743590 0.3019986 -0.0000000), wk = 0.0027397 k( 124) = ( 0.1692308 0.2931163 -0.0000000), wk = 0.0027397 k( 125) = ( 0.1641026 0.2842340 -0.0000000), wk = 0.0027397 k( 126) = ( 0.1589744 0.2753517 -0.0000000), wk = 0.0027397 k( 127) = ( 0.1538461 0.2664693 -0.0000000), wk = 0.0027397 k( 128) = ( 0.1487179 0.2575870 -0.0000000), wk = 0.0027397 k( 129) = ( 0.1435897 0.2487047 -0.0000000), wk = 0.0027397 k( 130) = ( 0.1384615 0.2398224 -0.0000000), wk = 0.0027397 k( 131) = ( 0.1333333 0.2309401 -0.0000000), wk = 0.0027397 k( 132) = ( 0.1282051 0.2220578 -0.0000000), wk = 0.0027397 k( 133) = ( 0.1230769 0.2131755 -0.0000000), wk = 0.0027397 k( 134) = ( 0.1179487 0.2042932 -0.0000000), wk = 0.0027397 k( 135) = ( 0.1128205 0.1954109 -0.0000000), wk = 0.0027397 k( 136) = ( 0.1076923 0.1865286 -0.0000000), wk = 0.0027397 k( 137) = ( 0.1025641 0.1776462 -0.0000000), wk = 0.0027397 k( 138) = ( 0.0974359 0.1687639 -0.0000000), wk = 0.0027397 k( 139) = ( 0.0923077 0.1598816 -0.0000000), wk = 0.0027397 k( 140) = ( 0.0871795 0.1509993 -0.0000000), wk = 0.0027397 k( 141) = ( 0.0820513 0.1421170 -0.0000000), wk = 0.0027397 k( 142) = ( 0.0769231 0.1332347 -0.0000000), wk = 0.0027397 k( 143) = ( 0.0717949 0.1243524 -0.0000000), wk = 0.0027397 k( 144) = ( 0.0666667 0.1154701 -0.0000000), wk = 0.0027397 k( 145) = ( 0.0615385 0.1065877 -0.0000000), wk = 0.0027397 k( 146) = ( 0.0564103 0.0977054 -0.0000000), wk = 0.0027397 k( 147) = ( 0.0512821 0.0888231 -0.0000000), wk = 0.0027397 k( 148) = ( 0.0461539 0.0799408 -0.0000000), wk = 0.0027397 k( 149) = ( 0.0410256 0.0710585 -0.0000000), wk = 0.0027397 k( 150) = ( 0.0358974 0.0621762 -0.0000000), wk = 0.0027397 k( 151) = ( 0.0307692 0.0532939 -0.0000000), wk = 0.0027397 k( 152) = ( 0.0256410 0.0444116 -0.0000000), wk = 0.0027397 k( 153) = ( 0.0205128 0.0355292 -0.0000000), wk = 0.0027397 k( 154) = ( 0.0153846 0.0266469 -0.0000000), wk = 0.0027397 k( 155) = ( 0.0102564 0.0177646 -0.0000000), wk = 0.0027397 k( 156) = ( 0.0051282 0.0088823 -0.0000000), wk = 0.0027397 k( 157) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 158) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 159) = ( 0.0000000 0.0000000 0.0099763), wk = 0.0027397 k( 160) = ( 0.0000000 0.0000000 0.0199526), wk = 0.0027397 k( 161) = ( 0.0000000 0.0000000 0.0299289), wk = 0.0027397 k( 162) = ( 0.0000000 0.0000000 0.0399051), wk = 0.0027397 k( 163) = ( 0.0000000 0.0000000 0.0498814), wk = 0.0027397 k( 164) = ( 0.0000000 0.0000000 0.0598577), wk = 0.0027397 k( 165) = ( 0.0000000 0.0000000 0.0698340), wk = 0.0027397 k( 166) = ( 0.0000000 0.0000000 0.0798103), wk = 0.0027397 k( 167) = ( 0.0000000 0.0000000 0.0897866), wk = 0.0027397 k( 168) = ( 0.0000000 0.0000000 0.0997628), wk = 0.0027397 k( 169) = ( 0.0000000 0.0000000 0.1097391), wk = 0.0027397 k( 170) = ( 0.0000000 0.0000000 0.1197154), wk = 0.0027397 k( 171) = ( 0.0000000 0.0000000 0.1296917), wk = 0.0027397 k( 172) = ( 0.0000000 0.0000000 0.1396680), wk = 0.0027397 k( 173) = ( 0.0000000 0.0000000 0.1496443), wk = 0.0027397 k( 174) = ( 0.0000000 0.0000000 0.1596205), wk = 0.0027397 k( 175) = ( 0.0000000 0.0000000 0.1596205), wk = 0.0027397 k( 176) = ( 0.0089286 0.0051549 0.1596205), wk = 0.0027397 k( 177) = ( 0.0178571 0.0103098 0.1596205), wk = 0.0027397 k( 178) = ( 0.0267857 0.0154647 0.1596205), wk = 0.0027397 k( 179) = ( 0.0357143 0.0206197 0.1596205), wk = 0.0027397 k( 180) = ( 0.0446429 0.0257746 0.1596205), wk = 0.0027397 k( 181) = ( 0.0535714 0.0309295 0.1596205), wk = 0.0027397 k( 182) = ( 0.0625000 0.0360844 0.1596205), wk = 0.0027397 k( 183) = ( 0.0714286 0.0412393 0.1596205), wk = 0.0027397 k( 184) = ( 0.0803571 0.0463942 0.1596205), wk = 0.0027397 k( 185) = ( 0.0892857 0.0515491 0.1596205), wk = 0.0027397 k( 186) = ( 0.0982143 0.0567040 0.1596205), wk = 0.0027397 k( 187) = ( 0.1071429 0.0618590 0.1596205), wk = 0.0027397 k( 188) = ( 0.1160714 0.0670139 0.1596205), wk = 0.0027397 k( 189) = ( 0.1250000 0.0721688 0.1596205), wk = 0.0027397 k( 190) = ( 0.1339286 0.0773237 0.1596205), wk = 0.0027397 k( 191) = ( 0.1428571 0.0824786 0.1596205), wk = 0.0027397 k( 192) = ( 0.1517857 0.0876335 0.1596205), wk = 0.0027397 k( 193) = ( 0.1607143 0.0927884 0.1596205), wk = 0.0027397 k( 194) = ( 0.1696429 0.0979434 0.1596205), wk = 0.0027397 k( 195) = ( 0.1785714 0.1030983 0.1596205), wk = 0.0027397 k( 196) = ( 0.1875000 0.1082532 0.1596205), wk = 0.0027397 k( 197) = ( 0.1964286 0.1134081 0.1596205), wk = 0.0027397 k( 198) = ( 0.2053571 0.1185630 0.1596205), wk = 0.0027397 k( 199) = ( 0.2142857 0.1237179 0.1596205), wk = 0.0027397 k( 200) = ( 0.2232143 0.1288728 0.1596205), wk = 0.0027397 k( 201) = ( 0.2321429 0.1340277 0.1596205), wk = 0.0027397 k( 202) = ( 0.2410714 0.1391827 0.1596205), wk = 0.0027397 k( 203) = ( 0.2500000 0.1443376 0.1596205), wk = 0.0027397 k( 204) = ( 0.2589286 0.1494925 0.1596205), wk = 0.0027397 k( 205) = ( 0.2678571 0.1546474 0.1596205), wk = 0.0027397 k( 206) = ( 0.2767857 0.1598023 0.1596205), wk = 0.0027397 k( 207) = ( 0.2857143 0.1649572 0.1596205), wk = 0.0027397 k( 208) = ( 0.2946429 0.1701121 0.1596205), wk = 0.0027397 k( 209) = ( 0.3035714 0.1752670 0.1596205), wk = 0.0027397 k( 210) = ( 0.3125000 0.1804220 0.1596205), wk = 0.0027397 k( 211) = ( 0.3214286 0.1855769 0.1596205), wk = 0.0027397 k( 212) = ( 0.3303571 0.1907318 0.1596205), wk = 0.0027397 k( 213) = ( 0.3392857 0.1958867 0.1596205), wk = 0.0027397 k( 214) = ( 0.3482143 0.2010416 0.1596205), wk = 0.0027397 k( 215) = ( 0.3571429 0.2061965 0.1596205), wk = 0.0027397 k( 216) = ( 0.3660714 0.2113514 0.1596205), wk = 0.0027397 k( 217) = ( 0.3750000 0.2165064 0.1596205), wk = 0.0027397 k( 218) = ( 0.3839286 0.2216613 0.1596205), wk = 0.0027397 k( 219) = ( 0.3928571 0.2268162 0.1596205), wk = 0.0027397 k( 220) = ( 0.4017857 0.2319711 0.1596205), wk = 0.0027397 k( 221) = ( 0.4107143 0.2371260 0.1596205), wk = 0.0027397 k( 222) = ( 0.4196429 0.2422809 0.1596205), wk = 0.0027397 k( 223) = ( 0.4285714 0.2474358 0.1596205), wk = 0.0027397 k( 224) = ( 0.4375000 0.2525907 0.1596205), wk = 0.0027397 k( 225) = ( 0.4464286 0.2577457 0.1596205), wk = 0.0027397 k( 226) = ( 0.4553571 0.2629006 0.1596205), wk = 0.0027397 k( 227) = ( 0.4642857 0.2680555 0.1596205), wk = 0.0027397 k( 228) = ( 0.4732143 0.2732104 0.1596205), wk = 0.0027397 k( 229) = ( 0.4821429 0.2783653 0.1596205), wk = 0.0027397 k( 230) = ( 0.4910714 0.2835202 0.1596205), wk = 0.0027397 k( 231) = ( 0.5000000 0.2886751 0.1596205), wk = 0.0027397 k( 232) = ( 0.5000000 0.2886751 0.1596205), wk = 0.0027397 k( 233) = ( 0.4949495 0.2974229 0.1596205), wk = 0.0027397 k( 234) = ( 0.4898990 0.3061706 0.1596205), wk = 0.0027397 k( 235) = ( 0.4848485 0.3149183 0.1596205), wk = 0.0027397 k( 236) = ( 0.4797980 0.3236661 0.1596205), wk = 0.0027397 k( 237) = ( 0.4747475 0.3324138 0.1596205), wk = 0.0027397 k( 238) = ( 0.4696970 0.3411615 0.1596205), wk = 0.0027397 k( 239) = ( 0.4646465 0.3499093 0.1596205), wk = 0.0027397 k( 240) = ( 0.4595960 0.3586570 0.1596205), wk = 0.0027397 k( 241) = ( 0.4545455 0.3674047 0.1596205), wk = 0.0027397 k( 242) = ( 0.4494950 0.3761524 0.1596205), wk = 0.0027397 k( 243) = ( 0.4444444 0.3849002 0.1596205), wk = 0.0027397 k( 244) = ( 0.4393939 0.3936479 0.1596205), wk = 0.0027397 k( 245) = ( 0.4343434 0.4023956 0.1596205), wk = 0.0027397 k( 246) = ( 0.4292929 0.4111434 0.1596205), wk = 0.0027397 k( 247) = ( 0.4242424 0.4198911 0.1596205), wk = 0.0027397 k( 248) = ( 0.4191919 0.4286388 0.1596205), wk = 0.0027397 k( 249) = ( 0.4141414 0.4373866 0.1596205), wk = 0.0027397 k( 250) = ( 0.4090909 0.4461343 0.1596205), wk = 0.0027397 k( 251) = ( 0.4040404 0.4548820 0.1596205), wk = 0.0027397 k( 252) = ( 0.3989899 0.4636298 0.1596205), wk = 0.0027397 k( 253) = ( 0.3939394 0.4723775 0.1596205), wk = 0.0027397 k( 254) = ( 0.3888889 0.4811252 0.1596205), wk = 0.0027397 k( 255) = ( 0.3838384 0.4898730 0.1596205), wk = 0.0027397 k( 256) = ( 0.3787879 0.4986207 0.1596205), wk = 0.0027397 k( 257) = ( 0.3737374 0.5073684 0.1596205), wk = 0.0027397 k( 258) = ( 0.3686869 0.5161161 0.1596205), wk = 0.0027397 k( 259) = ( 0.3636364 0.5248639 0.1596205), wk = 0.0027397 k( 260) = ( 0.3585859 0.5336116 0.1596205), wk = 0.0027397 k( 261) = ( 0.3535354 0.5423593 0.1596205), wk = 0.0027397 k( 262) = ( 0.3484849 0.5511071 0.1596205), wk = 0.0027397 k( 263) = ( 0.3434343 0.5598548 0.1596205), wk = 0.0027397 k( 264) = ( 0.3383838 0.5686025 0.1596205), wk = 0.0027397 k( 265) = ( 0.3333333 0.5773503 0.1596205), wk = 0.0027397 k( 266) = ( 0.3333333 0.5773503 0.1596205), wk = 0.0027397 k( 267) = ( 0.3282051 0.5684680 0.1596205), wk = 0.0027397 k( 268) = ( 0.3230769 0.5595856 0.1596205), wk = 0.0027397 k( 269) = ( 0.3179487 0.5507033 0.1596205), wk = 0.0027397 k( 270) = ( 0.3128205 0.5418210 0.1596205), wk = 0.0027397 k( 271) = ( 0.3076923 0.5329387 0.1596205), wk = 0.0027397 k( 272) = ( 0.3025641 0.5240564 0.1596205), wk = 0.0027397 k( 273) = ( 0.2974359 0.5151741 0.1596205), wk = 0.0027397 k( 274) = ( 0.2923077 0.5062918 0.1596205), wk = 0.0027397 k( 275) = ( 0.2871795 0.4974095 0.1596205), wk = 0.0027397 k( 276) = ( 0.2820513 0.4885271 0.1596205), wk = 0.0027397 k( 277) = ( 0.2769231 0.4796448 0.1596205), wk = 0.0027397 k( 278) = ( 0.2717949 0.4707625 0.1596205), wk = 0.0027397 k( 279) = ( 0.2666667 0.4618802 0.1596205), wk = 0.0027397 k( 280) = ( 0.2615385 0.4529979 0.1596205), wk = 0.0027397 k( 281) = ( 0.2564103 0.4441156 0.1596205), wk = 0.0027397 k( 282) = ( 0.2512820 0.4352333 0.1596205), wk = 0.0027397 k( 283) = ( 0.2461539 0.4263510 0.1596205), wk = 0.0027397 k( 284) = ( 0.2410256 0.4174687 0.1596205), wk = 0.0027397 k( 285) = ( 0.2358974 0.4085864 0.1596205), wk = 0.0027397 k( 286) = ( 0.2307692 0.3997040 0.1596205), wk = 0.0027397 k( 287) = ( 0.2256410 0.3908217 0.1596205), wk = 0.0027397 k( 288) = ( 0.2205128 0.3819394 0.1596205), wk = 0.0027397 k( 289) = ( 0.2153846 0.3730571 0.1596205), wk = 0.0027397 k( 290) = ( 0.2102564 0.3641748 0.1596205), wk = 0.0027397 k( 291) = ( 0.2051282 0.3552925 0.1596205), wk = 0.0027397 k( 292) = ( 0.2000000 0.3464102 0.1596205), wk = 0.0027397 k( 293) = ( 0.1948718 0.3375278 0.1596205), wk = 0.0027397 k( 294) = ( 0.1897436 0.3286455 0.1596205), wk = 0.0027397 k( 295) = ( 0.1846154 0.3197632 0.1596205), wk = 0.0027397 k( 296) = ( 0.1794872 0.3108809 0.1596205), wk = 0.0027397 k( 297) = ( 0.1743590 0.3019986 0.1596205), wk = 0.0027397 k( 298) = ( 0.1692308 0.2931163 0.1596205), wk = 0.0027397 k( 299) = ( 0.1641026 0.2842340 0.1596205), wk = 0.0027397 k( 300) = ( 0.1589744 0.2753517 0.1596205), wk = 0.0027397 k( 301) = ( 0.1538461 0.2664693 0.1596205), wk = 0.0027397 k( 302) = ( 0.1487179 0.2575870 0.1596205), wk = 0.0027397 k( 303) = ( 0.1435897 0.2487047 0.1596205), wk = 0.0027397 k( 304) = ( 0.1384615 0.2398224 0.1596205), wk = 0.0027397 k( 305) = ( 0.1333333 0.2309401 0.1596205), wk = 0.0027397 k( 306) = ( 0.1282051 0.2220578 0.1596205), wk = 0.0027397 k( 307) = ( 0.1230769 0.2131755 0.1596205), wk = 0.0027397 k( 308) = ( 0.1179487 0.2042932 0.1596205), wk = 0.0027397 k( 309) = ( 0.1128205 0.1954109 0.1596205), wk = 0.0027397 k( 310) = ( 0.1076923 0.1865286 0.1596205), wk = 0.0027397 k( 311) = ( 0.1025641 0.1776462 0.1596205), wk = 0.0027397 k( 312) = ( 0.0974359 0.1687639 0.1596205), wk = 0.0027397 k( 313) = ( 0.0923077 0.1598816 0.1596205), wk = 0.0027397 k( 314) = ( 0.0871795 0.1509993 0.1596205), wk = 0.0027397 k( 315) = ( 0.0820513 0.1421170 0.1596205), wk = 0.0027397 k( 316) = ( 0.0769231 0.1332347 0.1596205), wk = 0.0027397 k( 317) = ( 0.0717949 0.1243524 0.1596205), wk = 0.0027397 k( 318) = ( 0.0666667 0.1154701 0.1596205), wk = 0.0027397 k( 319) = ( 0.0615385 0.1065877 0.1596205), wk = 0.0027397 k( 320) = ( 0.0564103 0.0977054 0.1596205), wk = 0.0027397 k( 321) = ( 0.0512821 0.0888231 0.1596205), wk = 0.0027397 k( 322) = ( 0.0461539 0.0799408 0.1596205), wk = 0.0027397 k( 323) = ( 0.0410256 0.0710585 0.1596205), wk = 0.0027397 k( 324) = ( 0.0358974 0.0621762 0.1596205), wk = 0.0027397 k( 325) = ( 0.0307692 0.0532939 0.1596205), wk = 0.0027397 k( 326) = ( 0.0256410 0.0444116 0.1596205), wk = 0.0027397 k( 327) = ( 0.0205128 0.0355292 0.1596205), wk = 0.0027397 k( 328) = ( 0.0153846 0.0266469 0.1596205), wk = 0.0027397 k( 329) = ( 0.0102564 0.0177646 0.1596205), wk = 0.0027397 k( 330) = ( 0.0051282 0.0088823 0.1596205), wk = 0.0027397 k( 331) = ( 0.0000000 0.0000000 0.1596205), wk = 0.0027397 k( 332) = ( 0.5000000 0.2886751 0.1596205), wk = 0.0027397 k( 333) = ( 0.5000000 0.2886751 0.1496443), wk = 0.0027397 k( 334) = ( 0.5000000 0.2886751 0.1396680), wk = 0.0027397 k( 335) = ( 0.5000000 0.2886751 0.1296917), wk = 0.0027397 k( 336) = ( 0.5000000 0.2886751 0.1197154), wk = 0.0027397 k( 337) = ( 0.5000000 0.2886751 0.1097391), wk = 0.0027397 k( 338) = ( 0.5000000 0.2886751 0.0997628), wk = 0.0027397 k( 339) = ( 0.5000000 0.2886751 0.0897866), wk = 0.0027397 k( 340) = ( 0.5000000 0.2886751 0.0798103), wk = 0.0027397 k( 341) = ( 0.5000000 0.2886751 0.0698340), wk = 0.0027397 k( 342) = ( 0.5000000 0.2886751 0.0598577), wk = 0.0027397 k( 343) = ( 0.5000000 0.2886751 0.0498814), wk = 0.0027397 k( 344) = ( 0.5000000 0.2886751 0.0399051), wk = 0.0027397 k( 345) = ( 0.5000000 0.2886751 0.0299289), wk = 0.0027397 k( 346) = ( 0.5000000 0.2886751 0.0199526), wk = 0.0027397 k( 347) = ( 0.5000000 0.2886751 0.0099763), wk = 0.0027397 k( 348) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0027397 k( 349) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0027397 k( 350) = ( 0.3333333 0.5773503 0.0099763), wk = 0.0027397 k( 351) = ( 0.3333333 0.5773503 0.0199526), wk = 0.0027397 k( 352) = ( 0.3333333 0.5773503 0.0299289), wk = 0.0027397 k( 353) = ( 0.3333333 0.5773503 0.0399051), wk = 0.0027397 k( 354) = ( 0.3333333 0.5773503 0.0498814), wk = 0.0027397 k( 355) = ( 0.3333333 0.5773503 0.0598577), wk = 0.0027397 k( 356) = ( 0.3333333 0.5773503 0.0698340), wk = 0.0027397 k( 357) = ( 0.3333333 0.5773503 0.0798103), wk = 0.0027397 k( 358) = ( 0.3333333 0.5773503 0.0897866), wk = 0.0027397 k( 359) = ( 0.3333333 0.5773503 0.0997628), wk = 0.0027397 k( 360) = ( 0.3333333 0.5773503 0.1097391), wk = 0.0027397 k( 361) = ( 0.3333333 0.5773503 0.1197154), wk = 0.0027397 k( 362) = ( 0.3333333 0.5773503 0.1296917), wk = 0.0027397 k( 363) = ( 0.3333333 0.5773503 0.1396680), wk = 0.0027397 k( 364) = ( 0.3333333 0.5773503 0.1496443), wk = 0.0027397 k( 365) = ( 0.3333333 0.5773503 0.1596205), wk = 0.0027397 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 2) = ( 0.0089286 0.0000000 0.0000000), wk = 0.0027397 k( 3) = ( 0.0178571 0.0000000 0.0000000), wk = 0.0027397 k( 4) = ( 0.0267857 0.0000000 0.0000000), wk = 0.0027397 k( 5) = ( 0.0357143 -0.0000000 0.0000000), wk = 0.0027397 k( 6) = ( 0.0446429 0.0000000 0.0000000), wk = 0.0027397 k( 7) = ( 0.0535714 0.0000000 0.0000000), wk = 0.0027397 k( 8) = ( 0.0625000 0.0000000 0.0000000), wk = 0.0027397 k( 9) = ( 0.0714286 -0.0000000 0.0000000), wk = 0.0027397 k( 10) = ( 0.0803571 0.0000000 -0.0000000), wk = 0.0027397 k( 11) = ( 0.0892857 -0.0000000 0.0000000), wk = 0.0027397 k( 12) = ( 0.0982143 0.0000000 0.0000000), wk = 0.0027397 k( 13) = ( 0.1071429 0.0000000 0.0000000), wk = 0.0027397 k( 14) = ( 0.1160714 -0.0000000 -0.0000000), wk = 0.0027397 k( 15) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0027397 k( 16) = ( 0.1339286 0.0000000 0.0000000), wk = 0.0027397 k( 17) = ( 0.1428571 -0.0000000 0.0000000), wk = 0.0027397 k( 18) = ( 0.1517857 0.0000000 0.0000000), wk = 0.0027397 k( 19) = ( 0.1607143 0.0000000 0.0000000), wk = 0.0027397 k( 20) = ( 0.1696429 0.0000000 0.0000000), wk = 0.0027397 k( 21) = ( 0.1785714 0.0000000 0.0000000), wk = 0.0027397 k( 22) = ( 0.1875000 0.0000000 0.0000000), wk = 0.0027397 k( 23) = ( 0.1964286 0.0000000 0.0000000), wk = 0.0027397 k( 24) = ( 0.2053571 0.0000000 -0.0000000), wk = 0.0027397 k( 25) = ( 0.2142857 0.0000000 -0.0000000), wk = 0.0027397 k( 26) = ( 0.2232143 0.0000000 -0.0000000), wk = 0.0027397 k( 27) = ( 0.2321429 -0.0000000 -0.0000000), wk = 0.0027397 k( 28) = ( 0.2410714 0.0000000 0.0000000), wk = 0.0027397 k( 29) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0027397 k( 30) = ( 0.2589286 0.0000000 -0.0000000), wk = 0.0027397 k( 31) = ( 0.2678571 0.0000000 0.0000000), wk = 0.0027397 k( 32) = ( 0.2767857 0.0000000 0.0000000), wk = 0.0027397 k( 33) = ( 0.2857143 0.0000000 0.0000000), wk = 0.0027397 k( 34) = ( 0.2946429 0.0000000 0.0000000), wk = 0.0027397 k( 35) = ( 0.3035714 0.0000000 0.0000000), wk = 0.0027397 k( 36) = ( 0.3125000 0.0000000 0.0000000), wk = 0.0027397 k( 37) = ( 0.3214286 0.0000000 -0.0000000), wk = 0.0027397 k( 38) = ( 0.3303571 0.0000000 -0.0000000), wk = 0.0027397 k( 39) = ( 0.3392857 0.0000000 0.0000000), wk = 0.0027397 k( 40) = ( 0.3482143 0.0000000 0.0000000), wk = 0.0027397 k( 41) = ( 0.3571429 0.0000000 0.0000000), wk = 0.0027397 k( 42) = ( 0.3660714 0.0000000 0.0000000), wk = 0.0027397 k( 43) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0027397 k( 44) = ( 0.3839286 0.0000000 0.0000000), wk = 0.0027397 k( 45) = ( 0.3928571 0.0000000 0.0000000), wk = 0.0027397 k( 46) = ( 0.4017857 0.0000000 -0.0000000), wk = 0.0027397 k( 47) = ( 0.4107143 0.0000000 0.0000000), wk = 0.0027397 k( 48) = ( 0.4196429 0.0000000 0.0000000), wk = 0.0027397 k( 49) = ( 0.4285714 0.0000000 0.0000000), wk = 0.0027397 k( 50) = ( 0.4375000 0.0000000 0.0000000), wk = 0.0027397 k( 51) = ( 0.4464286 0.0000000 0.0000000), wk = 0.0027397 k( 52) = ( 0.4553571 0.0000000 0.0000000), wk = 0.0027397 k( 53) = ( 0.4642857 0.0000000 0.0000000), wk = 0.0027397 k( 54) = ( 0.4732143 0.0000000 0.0000000), wk = 0.0027397 k( 55) = ( 0.4821429 0.0000000 0.0000000), wk = 0.0027397 k( 56) = ( 0.4910714 0.0000000 -0.0000000), wk = 0.0027397 k( 57) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0027397 k( 58) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0027397 k( 59) = ( 0.4949495 0.0101010 -0.0000000), wk = 0.0027397 k( 60) = ( 0.4898990 0.0202020 -0.0000000), wk = 0.0027397 k( 61) = ( 0.4848485 0.0303030 -0.0000000), wk = 0.0027397 k( 62) = ( 0.4797980 0.0404040 -0.0000000), wk = 0.0027397 k( 63) = ( 0.4747475 0.0505050 0.0000000), wk = 0.0027397 k( 64) = ( 0.4696970 0.0606061 0.0000000), wk = 0.0027397 k( 65) = ( 0.4646465 0.0707071 -0.0000000), wk = 0.0027397 k( 66) = ( 0.4595960 0.0808081 -0.0000000), wk = 0.0027397 k( 67) = ( 0.4545455 0.0909091 0.0000000), wk = 0.0027397 k( 68) = ( 0.4494950 0.1010101 0.0000000), wk = 0.0027397 k( 69) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0027397 k( 70) = ( 0.4393939 0.1212121 -0.0000000), wk = 0.0027397 k( 71) = ( 0.4343434 0.1313131 0.0000000), wk = 0.0027397 k( 72) = ( 0.4292929 0.1414141 -0.0000000), wk = 0.0027397 k( 73) = ( 0.4242424 0.1515151 -0.0000000), wk = 0.0027397 k( 74) = ( 0.4191919 0.1616162 0.0000000), wk = 0.0027397 k( 75) = ( 0.4141414 0.1717172 0.0000000), wk = 0.0027397 k( 76) = ( 0.4090909 0.1818182 -0.0000000), wk = 0.0027397 k( 77) = ( 0.4040404 0.1919192 0.0000000), wk = 0.0027397 k( 78) = ( 0.3989899 0.2020202 -0.0000000), wk = 0.0027397 k( 79) = ( 0.3939394 0.2121212 0.0000000), wk = 0.0027397 k( 80) = ( 0.3888889 0.2222222 0.0000000), wk = 0.0027397 k( 81) = ( 0.3838384 0.2323232 0.0000000), wk = 0.0027397 k( 82) = ( 0.3787879 0.2424242 0.0000000), wk = 0.0027397 k( 83) = ( 0.3737374 0.2525252 -0.0000000), wk = 0.0027397 k( 84) = ( 0.3686869 0.2626263 0.0000000), wk = 0.0027397 k( 85) = ( 0.3636364 0.2727273 -0.0000000), wk = 0.0027397 k( 86) = ( 0.3585859 0.2828283 0.0000000), wk = 0.0027397 k( 87) = ( 0.3535354 0.2929293 0.0000000), wk = 0.0027397 k( 88) = ( 0.3484849 0.3030303 0.0000000), wk = 0.0027397 k( 89) = ( 0.3434343 0.3131313 -0.0000000), wk = 0.0027397 k( 90) = ( 0.3383838 0.3232323 0.0000000), wk = 0.0027397 k( 91) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0027397 k( 92) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0027397 k( 93) = ( 0.3282051 0.3282051 0.0000000), wk = 0.0027397 k( 94) = ( 0.3230769 0.3230769 -0.0000000), wk = 0.0027397 k( 95) = ( 0.3179487 0.3179487 0.0000000), wk = 0.0027397 k( 96) = ( 0.3128205 0.3128205 0.0000000), wk = 0.0027397 k( 97) = ( 0.3076923 0.3076923 -0.0000000), wk = 0.0027397 k( 98) = ( 0.3025641 0.3025641 -0.0000000), wk = 0.0027397 k( 99) = ( 0.2974359 0.2974359 0.0000000), wk = 0.0027397 k( 100) = ( 0.2923077 0.2923077 -0.0000000), wk = 0.0027397 k( 101) = ( 0.2871795 0.2871795 0.0000000), wk = 0.0027397 k( 102) = ( 0.2820513 0.2820513 0.0000000), wk = 0.0027397 k( 103) = ( 0.2769231 0.2769231 0.0000000), wk = 0.0027397 k( 104) = ( 0.2717949 0.2717949 -0.0000000), wk = 0.0027397 k( 105) = ( 0.2666667 0.2666667 0.0000000), wk = 0.0027397 k( 106) = ( 0.2615385 0.2615385 0.0000000), wk = 0.0027397 k( 107) = ( 0.2564103 0.2564103 -0.0000000), wk = 0.0027397 k( 108) = ( 0.2512820 0.2512820 -0.0000000), wk = 0.0027397 k( 109) = ( 0.2461539 0.2461539 0.0000000), wk = 0.0027397 k( 110) = ( 0.2410256 0.2410256 -0.0000000), wk = 0.0027397 k( 111) = ( 0.2358974 0.2358974 0.0000000), wk = 0.0027397 k( 112) = ( 0.2307692 0.2307692 0.0000000), wk = 0.0027397 k( 113) = ( 0.2256410 0.2256410 0.0000000), wk = 0.0027397 k( 114) = ( 0.2205128 0.2205128 -0.0000000), wk = 0.0027397 k( 115) = ( 0.2153846 0.2153846 0.0000000), wk = 0.0027397 k( 116) = ( 0.2102564 0.2102564 0.0000000), wk = 0.0027397 k( 117) = ( 0.2051282 0.2051282 0.0000000), wk = 0.0027397 k( 118) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0027397 k( 119) = ( 0.1948718 0.1948718 0.0000000), wk = 0.0027397 k( 120) = ( 0.1897436 0.1897436 0.0000000), wk = 0.0027397 k( 121) = ( 0.1846154 0.1846154 -0.0000000), wk = 0.0027397 k( 122) = ( 0.1794872 0.1794872 0.0000000), wk = 0.0027397 k( 123) = ( 0.1743590 0.1743590 -0.0000000), wk = 0.0027397 k( 124) = ( 0.1692308 0.1692308 0.0000000), wk = 0.0027397 k( 125) = ( 0.1641026 0.1641026 0.0000000), wk = 0.0027397 k( 126) = ( 0.1589744 0.1589744 0.0000000), wk = 0.0027397 k( 127) = ( 0.1538461 0.1538462 0.0000000), wk = 0.0027397 k( 128) = ( 0.1487179 0.1487179 0.0000000), wk = 0.0027397 k( 129) = ( 0.1435897 0.1435897 0.0000000), wk = 0.0027397 k( 130) = ( 0.1384615 0.1384615 0.0000000), wk = 0.0027397 k( 131) = ( 0.1333333 0.1333333 0.0000000), wk = 0.0027397 k( 132) = ( 0.1282051 0.1282051 -0.0000000), wk = 0.0027397 k( 133) = ( 0.1230769 0.1230769 0.0000000), wk = 0.0027397 k( 134) = ( 0.1179487 0.1179487 0.0000000), wk = 0.0027397 k( 135) = ( 0.1128205 0.1128205 -0.0000000), wk = 0.0027397 k( 136) = ( 0.1076923 0.1076923 0.0000000), wk = 0.0027397 k( 137) = ( 0.1025641 0.1025641 0.0000000), wk = 0.0027397 k( 138) = ( 0.0974359 0.0974359 0.0000000), wk = 0.0027397 k( 139) = ( 0.0923077 0.0923077 -0.0000000), wk = 0.0027397 k( 140) = ( 0.0871795 0.0871795 0.0000000), wk = 0.0027397 k( 141) = ( 0.0820513 0.0820513 0.0000000), wk = 0.0027397 k( 142) = ( 0.0769231 0.0769231 -0.0000000), wk = 0.0027397 k( 143) = ( 0.0717949 0.0717949 0.0000000), wk = 0.0027397 k( 144) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0027397 k( 145) = ( 0.0615385 0.0615385 0.0000000), wk = 0.0027397 k( 146) = ( 0.0564103 0.0564103 -0.0000000), wk = 0.0027397 k( 147) = ( 0.0512821 0.0512821 0.0000000), wk = 0.0027397 k( 148) = ( 0.0461539 0.0461539 -0.0000000), wk = 0.0027397 k( 149) = ( 0.0410256 0.0410256 0.0000000), wk = 0.0027397 k( 150) = ( 0.0358974 0.0358974 0.0000000), wk = 0.0027397 k( 151) = ( 0.0307692 0.0307692 0.0000000), wk = 0.0027397 k( 152) = ( 0.0256410 0.0256410 0.0000000), wk = 0.0027397 k( 153) = ( 0.0205128 0.0205128 0.0000000), wk = 0.0027397 k( 154) = ( 0.0153846 0.0153846 0.0000000), wk = 0.0027397 k( 155) = ( 0.0102564 0.0102564 0.0000000), wk = 0.0027397 k( 156) = ( 0.0051282 0.0051282 -0.0000000), wk = 0.0027397 k( 157) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 158) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027397 k( 159) = ( 0.0000000 0.0000000 0.0312500), wk = 0.0027397 k( 160) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0027397 k( 161) = ( 0.0000000 0.0000000 0.0937500), wk = 0.0027397 k( 162) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0027397 k( 163) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0027397 k( 164) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0027397 k( 165) = ( 0.0000000 0.0000000 0.2187500), wk = 0.0027397 k( 166) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0027397 k( 167) = ( 0.0000000 0.0000000 0.2812500), wk = 0.0027397 k( 168) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0027397 k( 169) = ( 0.0000000 0.0000000 0.3437500), wk = 0.0027397 k( 170) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0027397 k( 171) = ( 0.0000000 0.0000000 0.4062500), wk = 0.0027397 k( 172) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0027397 k( 173) = ( 0.0000000 0.0000000 0.4687500), wk = 0.0027397 k( 174) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027397 k( 175) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027397 k( 176) = ( 0.0089286 0.0000000 0.5000000), wk = 0.0027397 k( 177) = ( 0.0178571 0.0000000 0.5000000), wk = 0.0027397 k( 178) = ( 0.0267857 0.0000000 0.5000000), wk = 0.0027397 k( 179) = ( 0.0357143 -0.0000000 0.5000000), wk = 0.0027397 k( 180) = ( 0.0446429 0.0000000 0.5000000), wk = 0.0027397 k( 181) = ( 0.0535714 0.0000000 0.5000000), wk = 0.0027397 k( 182) = ( 0.0625000 0.0000000 0.5000000), wk = 0.0027397 k( 183) = ( 0.0714286 -0.0000000 0.5000000), wk = 0.0027397 k( 184) = ( 0.0803571 0.0000000 0.5000000), wk = 0.0027397 k( 185) = ( 0.0892857 -0.0000000 0.5000000), wk = 0.0027397 k( 186) = ( 0.0982143 0.0000000 0.5000000), wk = 0.0027397 k( 187) = ( 0.1071429 0.0000000 0.5000000), wk = 0.0027397 k( 188) = ( 0.1160714 -0.0000000 0.5000000), wk = 0.0027397 k( 189) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0027397 k( 190) = ( 0.1339286 0.0000000 0.5000000), wk = 0.0027397 k( 191) = ( 0.1428571 -0.0000000 0.5000000), wk = 0.0027397 k( 192) = ( 0.1517857 0.0000000 0.5000000), wk = 0.0027397 k( 193) = ( 0.1607143 0.0000000 0.5000000), wk = 0.0027397 k( 194) = ( 0.1696429 0.0000000 0.5000000), wk = 0.0027397 k( 195) = ( 0.1785714 0.0000000 0.5000000), wk = 0.0027397 k( 196) = ( 0.1875000 0.0000000 0.5000000), wk = 0.0027397 k( 197) = ( 0.1964286 0.0000000 0.5000000), wk = 0.0027397 k( 198) = ( 0.2053571 0.0000000 0.5000000), wk = 0.0027397 k( 199) = ( 0.2142857 0.0000000 0.5000000), wk = 0.0027397 k( 200) = ( 0.2232143 0.0000000 0.5000000), wk = 0.0027397 k( 201) = ( 0.2321429 -0.0000000 0.5000000), wk = 0.0027397 k( 202) = ( 0.2410714 0.0000000 0.5000000), wk = 0.0027397 k( 203) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0027397 k( 204) = ( 0.2589286 0.0000000 0.5000000), wk = 0.0027397 k( 205) = ( 0.2678571 0.0000000 0.5000000), wk = 0.0027397 k( 206) = ( 0.2767857 0.0000000 0.5000000), wk = 0.0027397 k( 207) = ( 0.2857143 0.0000000 0.5000000), wk = 0.0027397 k( 208) = ( 0.2946429 0.0000000 0.5000000), wk = 0.0027397 k( 209) = ( 0.3035714 0.0000000 0.5000000), wk = 0.0027397 k( 210) = ( 0.3125000 0.0000000 0.5000000), wk = 0.0027397 k( 211) = ( 0.3214286 0.0000000 0.5000000), wk = 0.0027397 k( 212) = ( 0.3303571 0.0000000 0.5000000), wk = 0.0027397 k( 213) = ( 0.3392857 0.0000000 0.5000000), wk = 0.0027397 k( 214) = ( 0.3482143 0.0000000 0.5000000), wk = 0.0027397 k( 215) = ( 0.3571429 0.0000000 0.5000000), wk = 0.0027397 k( 216) = ( 0.3660714 0.0000000 0.5000000), wk = 0.0027397 k( 217) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0027397 k( 218) = ( 0.3839286 0.0000000 0.5000000), wk = 0.0027397 k( 219) = ( 0.3928571 0.0000000 0.5000000), wk = 0.0027397 k( 220) = ( 0.4017857 0.0000000 0.5000000), wk = 0.0027397 k( 221) = ( 0.4107143 0.0000000 0.5000000), wk = 0.0027397 k( 222) = ( 0.4196429 0.0000000 0.5000000), wk = 0.0027397 k( 223) = ( 0.4285714 0.0000000 0.5000000), wk = 0.0027397 k( 224) = ( 0.4375000 0.0000000 0.5000000), wk = 0.0027397 k( 225) = ( 0.4464286 0.0000000 0.5000000), wk = 0.0027397 k( 226) = ( 0.4553571 0.0000000 0.5000000), wk = 0.0027397 k( 227) = ( 0.4642857 0.0000000 0.5000000), wk = 0.0027397 k( 228) = ( 0.4732143 0.0000000 0.5000000), wk = 0.0027397 k( 229) = ( 0.4821429 0.0000000 0.5000000), wk = 0.0027397 k( 230) = ( 0.4910714 0.0000000 0.5000000), wk = 0.0027397 k( 231) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027397 k( 232) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027397 k( 233) = ( 0.4949495 0.0101010 0.5000000), wk = 0.0027397 k( 234) = ( 0.4898990 0.0202020 0.5000000), wk = 0.0027397 k( 235) = ( 0.4848485 0.0303030 0.5000000), wk = 0.0027397 k( 236) = ( 0.4797980 0.0404040 0.5000000), wk = 0.0027397 k( 237) = ( 0.4747475 0.0505050 0.5000000), wk = 0.0027397 k( 238) = ( 0.4696970 0.0606061 0.5000000), wk = 0.0027397 k( 239) = ( 0.4646465 0.0707071 0.5000000), wk = 0.0027397 k( 240) = ( 0.4595960 0.0808081 0.5000000), wk = 0.0027397 k( 241) = ( 0.4545455 0.0909091 0.5000000), wk = 0.0027397 k( 242) = ( 0.4494950 0.1010101 0.5000000), wk = 0.0027397 k( 243) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0027397 k( 244) = ( 0.4393939 0.1212121 0.5000000), wk = 0.0027397 k( 245) = ( 0.4343434 0.1313131 0.5000000), wk = 0.0027397 k( 246) = ( 0.4292929 0.1414141 0.5000000), wk = 0.0027397 k( 247) = ( 0.4242424 0.1515151 0.5000000), wk = 0.0027397 k( 248) = ( 0.4191919 0.1616162 0.5000000), wk = 0.0027397 k( 249) = ( 0.4141414 0.1717172 0.5000000), wk = 0.0027397 k( 250) = ( 0.4090909 0.1818182 0.5000000), wk = 0.0027397 k( 251) = ( 0.4040404 0.1919192 0.5000000), wk = 0.0027397 k( 252) = ( 0.3989899 0.2020202 0.5000000), wk = 0.0027397 k( 253) = ( 0.3939394 0.2121212 0.5000000), wk = 0.0027397 k( 254) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0027397 k( 255) = ( 0.3838384 0.2323232 0.5000000), wk = 0.0027397 k( 256) = ( 0.3787879 0.2424242 0.5000000), wk = 0.0027397 k( 257) = ( 0.3737374 0.2525252 0.5000000), wk = 0.0027397 k( 258) = ( 0.3686869 0.2626263 0.5000000), wk = 0.0027397 k( 259) = ( 0.3636364 0.2727273 0.5000000), wk = 0.0027397 k( 260) = ( 0.3585859 0.2828283 0.5000000), wk = 0.0027397 k( 261) = ( 0.3535354 0.2929293 0.5000000), wk = 0.0027397 k( 262) = ( 0.3484849 0.3030303 0.5000000), wk = 0.0027397 k( 263) = ( 0.3434343 0.3131313 0.5000000), wk = 0.0027397 k( 264) = ( 0.3383838 0.3232323 0.5000000), wk = 0.0027397 k( 265) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0027397 k( 266) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0027397 k( 267) = ( 0.3282051 0.3282051 0.5000000), wk = 0.0027397 k( 268) = ( 0.3230769 0.3230769 0.5000000), wk = 0.0027397 k( 269) = ( 0.3179487 0.3179487 0.5000000), wk = 0.0027397 k( 270) = ( 0.3128205 0.3128205 0.5000000), wk = 0.0027397 k( 271) = ( 0.3076923 0.3076923 0.5000000), wk = 0.0027397 k( 272) = ( 0.3025641 0.3025641 0.5000000), wk = 0.0027397 k( 273) = ( 0.2974359 0.2974359 0.5000000), wk = 0.0027397 k( 274) = ( 0.2923077 0.2923077 0.5000000), wk = 0.0027397 k( 275) = ( 0.2871795 0.2871795 0.5000000), wk = 0.0027397 k( 276) = ( 0.2820513 0.2820513 0.5000000), wk = 0.0027397 k( 277) = ( 0.2769231 0.2769231 0.5000000), wk = 0.0027397 k( 278) = ( 0.2717949 0.2717949 0.5000000), wk = 0.0027397 k( 279) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0027397 k( 280) = ( 0.2615385 0.2615385 0.5000000), wk = 0.0027397 k( 281) = ( 0.2564103 0.2564103 0.5000000), wk = 0.0027397 k( 282) = ( 0.2512820 0.2512820 0.5000000), wk = 0.0027397 k( 283) = ( 0.2461539 0.2461539 0.5000000), wk = 0.0027397 k( 284) = ( 0.2410256 0.2410256 0.5000000), wk = 0.0027397 k( 285) = ( 0.2358974 0.2358974 0.5000000), wk = 0.0027397 k( 286) = ( 0.2307692 0.2307692 0.5000000), wk = 0.0027397 k( 287) = ( 0.2256410 0.2256410 0.5000000), wk = 0.0027397 k( 288) = ( 0.2205128 0.2205128 0.5000000), wk = 0.0027397 k( 289) = ( 0.2153846 0.2153846 0.5000000), wk = 0.0027397 k( 290) = ( 0.2102564 0.2102564 0.5000000), wk = 0.0027397 k( 291) = ( 0.2051282 0.2051282 0.5000000), wk = 0.0027397 k( 292) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0027397 k( 293) = ( 0.1948718 0.1948718 0.5000000), wk = 0.0027397 k( 294) = ( 0.1897436 0.1897436 0.5000000), wk = 0.0027397 k( 295) = ( 0.1846154 0.1846154 0.5000000), wk = 0.0027397 k( 296) = ( 0.1794872 0.1794872 0.5000000), wk = 0.0027397 k( 297) = ( 0.1743590 0.1743590 0.5000000), wk = 0.0027397 k( 298) = ( 0.1692308 0.1692308 0.5000000), wk = 0.0027397 k( 299) = ( 0.1641026 0.1641026 0.5000000), wk = 0.0027397 k( 300) = ( 0.1589744 0.1589744 0.5000000), wk = 0.0027397 k( 301) = ( 0.1538461 0.1538462 0.5000000), wk = 0.0027397 k( 302) = ( 0.1487179 0.1487179 0.5000000), wk = 0.0027397 k( 303) = ( 0.1435897 0.1435897 0.5000000), wk = 0.0027397 k( 304) = ( 0.1384615 0.1384615 0.5000000), wk = 0.0027397 k( 305) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0027397 k( 306) = ( 0.1282051 0.1282051 0.5000000), wk = 0.0027397 k( 307) = ( 0.1230769 0.1230769 0.5000000), wk = 0.0027397 k( 308) = ( 0.1179487 0.1179487 0.5000000), wk = 0.0027397 k( 309) = ( 0.1128205 0.1128205 0.5000000), wk = 0.0027397 k( 310) = ( 0.1076923 0.1076923 0.5000000), wk = 0.0027397 k( 311) = ( 0.1025641 0.1025641 0.5000000), wk = 0.0027397 k( 312) = ( 0.0974359 0.0974359 0.5000000), wk = 0.0027397 k( 313) = ( 0.0923077 0.0923077 0.5000000), wk = 0.0027397 k( 314) = ( 0.0871795 0.0871795 0.5000000), wk = 0.0027397 k( 315) = ( 0.0820513 0.0820513 0.5000000), wk = 0.0027397 k( 316) = ( 0.0769231 0.0769231 0.5000000), wk = 0.0027397 k( 317) = ( 0.0717949 0.0717949 0.5000000), wk = 0.0027397 k( 318) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0027397 k( 319) = ( 0.0615385 0.0615385 0.5000000), wk = 0.0027397 k( 320) = ( 0.0564103 0.0564103 0.5000000), wk = 0.0027397 k( 321) = ( 0.0512821 0.0512821 0.5000000), wk = 0.0027397 k( 322) = ( 0.0461539 0.0461539 0.5000000), wk = 0.0027397 k( 323) = ( 0.0410256 0.0410256 0.5000000), wk = 0.0027397 k( 324) = ( 0.0358974 0.0358974 0.5000000), wk = 0.0027397 k( 325) = ( 0.0307692 0.0307692 0.5000000), wk = 0.0027397 k( 326) = ( 0.0256410 0.0256410 0.5000000), wk = 0.0027397 k( 327) = ( 0.0205128 0.0205128 0.5000000), wk = 0.0027397 k( 328) = ( 0.0153846 0.0153846 0.5000000), wk = 0.0027397 k( 329) = ( 0.0102564 0.0102564 0.5000000), wk = 0.0027397 k( 330) = ( 0.0051282 0.0051282 0.5000000), wk = 0.0027397 k( 331) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027397 k( 332) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027397 k( 333) = ( 0.5000000 0.0000000 0.4687500), wk = 0.0027397 k( 334) = ( 0.5000000 0.0000000 0.4375000), wk = 0.0027397 k( 335) = ( 0.5000000 0.0000000 0.4062500), wk = 0.0027397 k( 336) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0027397 k( 337) = ( 0.5000000 0.0000000 0.3437500), wk = 0.0027397 k( 338) = ( 0.5000000 0.0000000 0.3125000), wk = 0.0027397 k( 339) = ( 0.5000000 0.0000000 0.2812500), wk = 0.0027397 k( 340) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0027397 k( 341) = ( 0.5000000 0.0000000 0.2187500), wk = 0.0027397 k( 342) = ( 0.5000000 0.0000000 0.1875000), wk = 0.0027397 k( 343) = ( 0.5000000 0.0000000 0.1562500), wk = 0.0027397 k( 344) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0027397 k( 345) = ( 0.5000000 0.0000000 0.0937500), wk = 0.0027397 k( 346) = ( 0.5000000 0.0000000 0.0625000), wk = 0.0027397 k( 347) = ( 0.5000000 0.0000000 0.0312500), wk = 0.0027397 k( 348) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0027397 k( 349) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0027397 k( 350) = ( 0.3333333 0.3333333 0.0312500), wk = 0.0027397 k( 351) = ( 0.3333333 0.3333333 0.0625000), wk = 0.0027397 k( 352) = ( 0.3333333 0.3333333 0.0937500), wk = 0.0027397 k( 353) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0027397 k( 354) = ( 0.3333333 0.3333333 0.1562500), wk = 0.0027397 k( 355) = ( 0.3333333 0.3333333 0.1875000), wk = 0.0027397 k( 356) = ( 0.3333333 0.3333333 0.2187500), wk = 0.0027397 k( 357) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0027397 k( 358) = ( 0.3333333 0.3333333 0.2812500), wk = 0.0027397 k( 359) = ( 0.3333333 0.3333333 0.3125000), wk = 0.0027397 k( 360) = ( 0.3333333 0.3333333 0.3437500), wk = 0.0027397 k( 361) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0027397 k( 362) = ( 0.3333333 0.3333333 0.4062500), wk = 0.0027397 k( 363) = ( 0.3333333 0.3333333 0.4375000), wk = 0.0027397 k( 364) = ( 0.3333333 0.3333333 0.4687500), wk = 0.0027397 k( 365) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0027397 Dense grid: 85353 G-vectors FFT dimensions: ( 40, 40, 125) Smooth grid: 30747 G-vectors FFT dimensions: ( 27, 27, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.21 Mb ( 240, 58) NL pseudopotentials 0.35 Mb ( 120, 192) Each V/rho on FFT grid 0.10 Mb ( 6400) Each G-vector array 0.02 Mb ( 2371) G-vector shells 0.01 Mb ( 1022) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.85 Mb ( 240, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.34 Mb ( 192, 2, 58) Check: negative/imaginary core charge= -0.000007 0.000000 The potential is recalculated from file : ./ScAlCO.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.8 secs Computing kpt #: 2 total cpu time spent up to now is 4.8 secs Computing kpt #: 3 total cpu time spent up to now is 5.9 secs Computing kpt #: 4 total cpu time spent up to now is 7.1 secs Computing kpt #: 5 total cpu time spent up to now is 8.2 secs Computing kpt #: 6 total cpu time spent up to now is 9.3 secs Computing kpt #: 7 total cpu time spent up to now is 10.5 secs Computing kpt #: 8 total cpu time spent up to now is 11.6 secs Computing kpt #: 9 total cpu time spent up to now is 12.7 secs Computing kpt #: 10 total cpu time spent up to now is 13.6 secs Computing kpt #: 11 total cpu time spent up to now is 14.4 secs Computing kpt #: 12 total cpu time spent up to now is 15.3 secs Computing kpt #: 13 total cpu time spent up to now is 16.2 secs Computing kpt #: 14 total cpu time spent up to now is 17.1 secs Computing kpt #: 15 total cpu time spent up to now is 17.9 secs Computing kpt #: 16 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 20.0 secs Computing kpt #: 17 total cpu time spent up to now is 21.1 secs Computing kpt #: 18 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 23.2 secs Computing kpt #: 19 total cpu time spent up to now is 24.4 secs Computing kpt #: 20 total cpu time spent up to now is 25.9 secs Computing kpt #: 21 total cpu time spent up to now is 27.6 secs Computing kpt #: 22 total cpu time spent up to now is 29.5 secs Computing kpt #: 23 total cpu time spent up to now is 30.4 secs Computing kpt #: 24 total cpu time spent up to now is 31.3 secs Computing kpt #: 25 total cpu time spent up to now is 32.2 secs Computing kpt #: 26 total cpu time spent up to now is 33.1 secs Computing kpt #: 27 total cpu time spent up to now is 33.9 secs Computing kpt #: 28 total cpu time spent up to now is 34.9 secs Computing kpt #: 29 total cpu time spent up to now is 35.7 secs Computing kpt #: 30 total cpu time spent up to now is 36.6 secs Computing kpt #: 31 total cpu time spent up to now is 37.6 secs Computing kpt #: 32 total cpu time spent up to now is 38.7 secs Computing kpt #: 33 total cpu time spent up to now is 39.7 secs Computing kpt #: 34 total cpu time spent up to now is 40.8 secs Computing kpt #: 35 total cpu time spent up to now is 41.9 secs Computing kpt #: 36 total cpu time spent up to now is 43.1 secs Computing kpt #: 37 total cpu time spent up to now is 44.3 secs Computing kpt #: 38 total cpu time spent up to now is 45.5 secs Computing kpt #: 39 total cpu time spent up to now is 46.6 secs Computing kpt #: 40 total cpu time spent up to now is 47.8 secs Computing kpt #: 41 total cpu time spent up to now is 48.9 secs Computing kpt #: 42 total cpu time spent up to now is 50.1 secs Computing kpt #: 43 total cpu time spent up to now is 51.3 secs Computing kpt #: 44 total cpu time spent up to now is 52.4 secs Computing kpt #: 45 total cpu time spent up to now is 53.6 secs Computing kpt #: 46 total cpu time spent up to now is 54.9 secs Computing kpt #: 47 total cpu time spent up to now is 56.1 secs Computing kpt #: 48 total cpu time spent up to now is 57.3 secs Computing kpt #: 49 total cpu time spent up to now is 58.5 secs Computing kpt #: 50 total cpu time spent up to now is 59.8 secs Computing kpt #: 51 total cpu time spent up to now is 61.0 secs Computing kpt #: 52 total cpu time spent up to now is 62.3 secs Computing kpt #: 53 total cpu time spent up to now is 63.5 secs Computing kpt #: 54 total cpu time spent up to now is 64.8 secs Computing kpt #: 55 total cpu time spent up to now is 65.9 secs Computing kpt #: 56 total cpu time spent up to now is 67.2 secs Computing kpt #: 57 total cpu time spent up to now is 68.5 secs Computing kpt #: 58 total cpu time spent up to now is 69.7 secs Computing kpt #: 59 total cpu time spent up to now is 70.9 secs Computing kpt #: 60 total cpu time spent up to now is 72.2 secs Computing kpt #: 61 total cpu time spent up to now is 73.6 secs Computing kpt #: 62 total cpu time spent up to now is 75.2 secs Computing kpt #: 63 total cpu time spent up to now is 76.9 secs Computing kpt #: 64 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 79.0 secs Computing kpt #: 65 total cpu time spent up to now is 80.6 secs Computing kpt #: 66 total cpu time spent up to now is 82.0 secs Computing kpt #: 67 total cpu time spent up to now is 83.3 secs Computing kpt #: 68 total cpu time spent up to now is 84.5 secs Computing kpt #: 69 total cpu time spent up to now is 85.8 secs Computing kpt #: 70 total cpu time spent up to now is 87.0 secs Computing kpt #: 71 total cpu time spent up to now is 88.2 secs Computing kpt #: 72 total cpu time spent up to now is 89.4 secs Computing kpt #: 73 total cpu time spent up to now is 90.6 secs Computing kpt #: 74 total cpu time spent up to now is 91.9 secs Computing kpt #: 75 total cpu time spent up to now is 93.1 secs Computing kpt #: 76 total cpu time spent up to now is 94.4 secs Computing kpt #: 77 total cpu time spent up to now is 95.5 secs Computing kpt #: 78 total cpu time spent up to now is 97.0 secs Computing kpt #: 79 total cpu time spent up to now is 98.5 secs Computing kpt #: 80 total cpu time spent up to now is 99.7 secs Computing kpt #: 81 total cpu time spent up to now is 101.0 secs Computing kpt #: 82 total cpu time spent up to now is 101.8 secs Computing kpt #: 83 total cpu time spent up to now is 103.4 secs Computing kpt #: 84 total cpu time spent up to now is 104.8 secs Computing kpt #: 85 total cpu time spent up to now is 106.2 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 108.2 secs Computing kpt #: 87 total cpu time spent up to now is 109.8 secs Computing kpt #: 88 total cpu time spent up to now is 111.2 secs Computing kpt #: 89 total cpu time spent up to now is 112.6 secs Computing kpt #: 90 total cpu time spent up to now is 113.5 secs Computing kpt #: 91 total cpu time spent up to now is 114.3 secs Computing kpt #: 92 total cpu time spent up to now is 115.2 secs Computing kpt #: 93 total cpu time spent up to now is 116.3 secs Computing kpt #: 94 total cpu time spent up to now is 117.4 secs Computing kpt #: 95 total cpu time spent up to now is 118.3 secs Computing kpt #: 96 total cpu time spent up to now is 119.3 secs Computing kpt #: 97 total cpu time spent up to now is 120.3 secs Computing kpt #: 98 total cpu time spent up to now is 121.6 secs Computing kpt #: 99 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 123.7 secs Computing kpt #: 100 total cpu time spent up to now is 125.1 secs Computing kpt #: 101 total cpu time spent up to now is 126.4 secs Computing kpt #: 102 total cpu time spent up to now is 127.7 secs Computing kpt #: 103 total cpu time spent up to now is 128.8 secs Computing kpt #: 104 total cpu time spent up to now is 129.9 secs Computing kpt #: 105 total cpu time spent up to now is 131.3 secs Computing kpt #: 106 total cpu time spent up to now is 132.5 secs Computing kpt #: 107 total cpu time spent up to now is 133.6 secs Computing kpt #: 108 total cpu time spent up to now is 134.8 secs Computing kpt #: 109 total cpu time spent up to now is 136.0 secs Computing kpt #: 110 total cpu time spent up to now is 137.1 secs Computing kpt #: 111 total cpu time spent up to now is 138.2 secs Computing kpt #: 112 total cpu time spent up to now is 139.5 secs Computing kpt #: 113 total cpu time spent up to now is 140.6 secs Computing kpt #: 114 total cpu time spent up to now is 141.7 secs Computing kpt #: 115 total cpu time spent up to now is 142.8 secs Computing kpt #: 116 total cpu time spent up to now is 143.9 secs Computing kpt #: 117 total cpu time spent up to now is 144.9 secs Computing kpt #: 118 total cpu time spent up to now is 146.0 secs Computing kpt #: 119 total cpu time spent up to now is 147.0 secs Computing kpt #: 120 total cpu time spent up to now is 148.1 secs Computing kpt #: 121 total cpu time spent up to now is 149.1 secs Computing kpt #: 122 total cpu time spent up to now is 150.2 secs Computing kpt #: 123 total cpu time spent up to now is 151.1 secs Computing kpt #: 124 total cpu time spent up to now is 152.1 secs Computing kpt #: 125 total cpu time spent up to now is 153.0 secs Computing kpt #: 126 total cpu time spent up to now is 154.1 secs Computing kpt #: 127 total cpu time spent up to now is 155.1 secs Computing kpt #: 128 total cpu time spent up to now is 156.2 secs Computing kpt #: 129 total cpu time spent up to now is 157.3 secs Computing kpt #: 130 total cpu time spent up to now is 158.6 secs Computing kpt #: 131 total cpu time spent up to now is 159.6 secs Computing kpt #: 132 total cpu time spent up to now is 160.7 secs Computing kpt #: 133 total cpu time spent up to now is 162.1 secs Computing kpt #: 134 total cpu time spent up to now is 163.6 secs Computing kpt #: 135 total cpu time spent up to now is 164.7 secs Computing kpt #: 136 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 166.7 secs Computing kpt #: 137 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 168.6 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 170.6 secs Computing kpt #: 139 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 172.5 secs Computing kpt #: 140 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 174.4 secs Computing kpt #: 141 total cpu time spent up to now is 175.5 secs Computing kpt #: 142 total cpu time spent up to now is 176.4 secs Computing kpt #: 143 total cpu time spent up to now is 177.5 secs Computing kpt #: 144 total cpu time spent up to now is 178.4 secs Computing kpt #: 145 total cpu time spent up to now is 179.5 secs Computing kpt #: 146 total cpu time spent up to now is 180.4 secs Computing kpt #: 147 total cpu time spent up to now is 181.2 secs Computing kpt #: 148 total cpu time spent up to now is 182.1 secs Computing kpt #: 149 total cpu time spent up to now is 182.9 secs Computing kpt #: 150 total cpu time spent up to now is 184.1 secs Computing kpt #: 151 total cpu time spent up to now is 186.0 secs Computing kpt #: 152 total cpu time spent up to now is 187.5 secs Computing kpt #: 153 total cpu time spent up to now is 188.6 secs Computing kpt #: 154 total cpu time spent up to now is 189.7 secs Computing kpt #: 155 total cpu time spent up to now is 190.8 secs Computing kpt #: 156 total cpu time spent up to now is 191.9 secs Computing kpt #: 157 total cpu time spent up to now is 192.9 secs Computing kpt #: 158 total cpu time spent up to now is 193.9 secs Computing kpt #: 159 total cpu time spent up to now is 195.0 secs Computing kpt #: 160 total cpu time spent up to now is 196.0 secs Computing kpt #: 161 total cpu time spent up to now is 197.1 secs Computing kpt #: 162 total cpu time spent up to now is 198.1 secs Computing kpt #: 163 total cpu time spent up to now is 199.1 secs Computing kpt #: 164 total cpu time spent up to now is 200.1 secs Computing kpt #: 165 total cpu time spent up to now is 201.3 secs Computing kpt #: 166 total cpu time spent up to now is 202.3 secs Computing kpt #: 167 total cpu time spent up to now is 203.4 secs Computing kpt #: 168 total cpu time spent up to now is 204.4 secs Computing kpt #: 169 total cpu time spent up to now is 205.2 secs Computing kpt #: 170 total cpu time spent up to now is 206.3 secs Computing kpt #: 171 total cpu time spent up to now is 207.5 secs Computing kpt #: 172 total cpu time spent up to now is 208.3 secs Computing kpt #: 173 total cpu time spent up to now is 209.2 secs Computing kpt #: 174 total cpu time spent up to now is 210.1 secs Computing kpt #: 175 total cpu time spent up to now is 211.0 secs Computing kpt #: 176 total cpu time spent up to now is 211.9 secs Computing kpt #: 177 total cpu time spent up to now is 212.8 secs Computing kpt #: 178 total cpu time spent up to now is 213.6 secs Computing kpt #: 179 total cpu time spent up to now is 214.5 secs Computing kpt #: 180 total cpu time spent up to now is 215.4 secs Computing kpt #: 181 total cpu time spent up to now is 216.3 secs Computing kpt #: 182 total cpu time spent up to now is 217.3 secs Computing kpt #: 183 total cpu time spent up to now is 218.2 secs Computing kpt #: 184 total cpu time spent up to now is 219.1 secs Computing kpt #: 185 total cpu time spent up to now is 220.0 secs Computing kpt #: 186 total cpu time spent up to now is 220.9 secs Computing kpt #: 187 total cpu time spent up to now is 221.8 secs Computing kpt #: 188 total cpu time spent up to now is 222.7 secs Computing kpt #: 189 total cpu time spent up to now is 223.6 secs Computing kpt #: 190 total cpu time spent up to now is 224.8 secs Computing kpt #: 191 total cpu time spent up to now is 226.0 secs Computing kpt #: 192 total cpu time spent up to now is 227.0 secs Computing kpt #: 193 total cpu time spent up to now is 228.0 secs Computing kpt #: 194 total cpu time spent up to now is 229.0 secs Computing kpt #: 195 total cpu time spent up to now is 229.9 secs Computing kpt #: 196 total cpu time spent up to now is 230.9 secs Computing kpt #: 197 total cpu time spent up to now is 231.9 secs Computing kpt #: 198 total cpu time spent up to now is 232.9 secs Computing kpt #: 199 total cpu time spent up to now is 233.9 secs Computing kpt #: 200 total cpu time spent up to now is 234.9 secs Computing kpt #: 201 total cpu time spent up to now is 235.9 secs Computing kpt #: 202 total cpu time spent up to now is 236.8 secs Computing kpt #: 203 total cpu time spent up to now is 237.7 secs Computing kpt #: 204 total cpu time spent up to now is 238.6 secs Computing kpt #: 205 total cpu time spent up to now is 239.7 secs Computing kpt #: 206 total cpu time spent up to now is 240.7 secs Computing kpt #: 207 total cpu time spent up to now is 241.8 secs Computing kpt #: 208 total cpu time spent up to now is 242.8 secs Computing kpt #: 209 total cpu time spent up to now is 243.9 secs Computing kpt #: 210 total cpu time spent up to now is 245.0 secs Computing kpt #: 211 total cpu time spent up to now is 246.1 secs Computing kpt #: 212 total cpu time spent up to now is 247.1 secs Computing kpt #: 213 total cpu time spent up to now is 248.2 secs Computing kpt #: 214 total cpu time spent up to now is 249.3 secs Computing kpt #: 215 total cpu time spent up to now is 250.5 secs Computing kpt #: 216 total cpu time spent up to now is 251.5 secs Computing kpt #: 217 total cpu time spent up to now is 252.6 secs Computing kpt #: 218 total cpu time spent up to now is 253.7 secs Computing kpt #: 219 total cpu time spent up to now is 254.8 secs Computing kpt #: 220 total cpu time spent up to now is 255.9 secs Computing kpt #: 221 total cpu time spent up to now is 257.1 secs Computing kpt #: 222 total cpu time spent up to now is 258.3 secs Computing kpt #: 223 total cpu time spent up to now is 259.4 secs Computing kpt #: 224 total cpu time spent up to now is 260.6 secs Computing kpt #: 225 total cpu time spent up to now is 261.8 secs Computing kpt #: 226 total cpu time spent up to now is 262.9 secs Computing kpt #: 227 total cpu time spent up to now is 264.1 secs Computing kpt #: 228 total cpu time spent up to now is 265.2 secs Computing kpt #: 229 total cpu time spent up to now is 266.3 secs Computing kpt #: 230 total cpu time spent up to now is 267.5 secs Computing kpt #: 231 total cpu time spent up to now is 268.6 secs Computing kpt #: 232 total cpu time spent up to now is 269.7 secs Computing kpt #: 233 total cpu time spent up to now is 270.9 secs Computing kpt #: 234 total cpu time spent up to now is 272.4 secs Computing kpt #: 235 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 274.4 secs Computing kpt #: 236 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 276.4 secs Computing kpt #: 237 total cpu time spent up to now is 277.8 secs Computing kpt #: 238 total cpu time spent up to now is 279.2 secs Computing kpt #: 239 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 281.3 secs Computing kpt #: 240 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 283.3 secs Computing kpt #: 241 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 285.3 secs Computing kpt #: 242 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 287.3 secs Computing kpt #: 243 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 289.4 secs Computing kpt #: 244 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 291.4 secs Computing kpt #: 245 total cpu time spent up to now is 292.9 secs Computing kpt #: 246 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 294.9 secs Computing kpt #: 247 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 296.9 secs Computing kpt #: 248 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 299.0 secs Computing kpt #: 249 total cpu time spent up to now is 300.9 secs Computing kpt #: 250 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 302.9 secs Computing kpt #: 251 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 305.0 secs Computing kpt #: 252 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 307.0 secs Computing kpt #: 253 total cpu time spent up to now is 308.8 secs Computing kpt #: 254 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 310.9 secs Computing kpt #: 255 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 312.9 secs Computing kpt #: 256 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 314.9 secs Computing kpt #: 257 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 316.9 secs Computing kpt #: 258 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 319.0 secs Computing kpt #: 259 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 321.0 secs Computing kpt #: 260 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 323.1 secs Computing kpt #: 261 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 325.1 secs Computing kpt #: 262 total cpu time spent up to now is 326.5 secs Computing kpt #: 263 total cpu time spent up to now is 327.3 secs Computing kpt #: 264 total cpu time spent up to now is 329.1 secs Computing kpt #: 265 total cpu time spent up to now is 330.3 secs Computing kpt #: 266 total cpu time spent up to now is 331.8 secs Computing kpt #: 267 total cpu time spent up to now is 333.5 secs Computing kpt #: 268 total cpu time spent up to now is 334.9 secs Computing kpt #: 269 total cpu time spent up to now is 336.3 secs Computing kpt #: 270 total cpu time spent up to now is 337.8 secs Computing kpt #: 271 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 339.8 secs Computing kpt #: 272 total cpu time spent up to now is 340.7 secs Computing kpt #: 273 total cpu time spent up to now is 342.3 secs Computing kpt #: 274 total cpu time spent up to now is 343.7 secs Computing kpt #: 275 total cpu time spent up to now is 345.1 secs Computing kpt #: 276 total cpu time spent up to now is 346.3 secs Computing kpt #: 277 total cpu time spent up to now is 347.4 secs Computing kpt #: 278 total cpu time spent up to now is 348.5 secs Computing kpt #: 279 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 350.5 secs Computing kpt #: 280 total cpu time spent up to now is 351.6 secs Computing kpt #: 281 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 353.6 secs Computing kpt #: 282 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 355.5 secs Computing kpt #: 283 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 357.5 secs Computing kpt #: 284 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 359.5 secs Computing kpt #: 285 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 361.5 secs Computing kpt #: 286 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 363.5 secs Computing kpt #: 287 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 365.4 secs Computing kpt #: 288 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 367.5 secs Computing kpt #: 289 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 369.5 secs Computing kpt #: 290 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 371.5 secs Computing kpt #: 291 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 373.5 secs Computing kpt #: 292 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 375.4 secs Computing kpt #: 293 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 377.4 secs Computing kpt #: 294 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 379.5 secs Computing kpt #: 295 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 381.4 secs Computing kpt #: 296 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 383.5 secs Computing kpt #: 297 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 385.5 secs Computing kpt #: 298 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 387.5 secs Computing kpt #: 299 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 389.4 secs Computing kpt #: 300 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 391.5 secs Computing kpt #: 301 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 393.4 secs Computing kpt #: 302 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 395.3 secs Computing kpt #: 303 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 397.2 secs Computing kpt #: 304 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 399.2 secs Computing kpt #: 305 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 401.1 secs Computing kpt #: 306 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 403.1 secs Computing kpt #: 307 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 405.0 secs Computing kpt #: 308 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 406.9 secs Computing kpt #: 309 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 408.9 secs Computing kpt #: 310 total cpu time spent up to now is 410.0 secs Computing kpt #: 311 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 411.9 secs Computing kpt #: 312 total cpu time spent up to now is 413.0 secs Computing kpt #: 313 total cpu time spent up to now is 414.0 secs Computing kpt #: 314 total cpu time spent up to now is 415.0 secs Computing kpt #: 315 total cpu time spent up to now is 415.9 secs Computing kpt #: 316 total cpu time spent up to now is 416.8 secs Computing kpt #: 317 total cpu time spent up to now is 417.8 secs Computing kpt #: 318 total cpu time spent up to now is 418.7 secs Computing kpt #: 319 total cpu time spent up to now is 419.6 secs Computing kpt #: 320 total cpu time spent up to now is 420.5 secs Computing kpt #: 321 total cpu time spent up to now is 421.4 secs Computing kpt #: 322 total cpu time spent up to now is 422.4 secs Computing kpt #: 323 total cpu time spent up to now is 423.3 secs Computing kpt #: 324 total cpu time spent up to now is 424.2 secs Computing kpt #: 325 total cpu time spent up to now is 425.0 secs Computing kpt #: 326 total cpu time spent up to now is 425.9 secs Computing kpt #: 327 total cpu time spent up to now is 426.8 secs Computing kpt #: 328 total cpu time spent up to now is 427.7 secs Computing kpt #: 329 total cpu time spent up to now is 428.6 secs Computing kpt #: 330 total cpu time spent up to now is 429.4 secs Computing kpt #: 331 total cpu time spent up to now is 430.3 secs Computing kpt #: 332 total cpu time spent up to now is 431.4 secs Computing kpt #: 333 total cpu time spent up to now is 432.9 secs Computing kpt #: 334 total cpu time spent up to now is 434.2 secs Computing kpt #: 335 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 436.2 secs Computing kpt #: 336 total cpu time spent up to now is 438.1 secs Computing kpt #: 337 total cpu time spent up to now is 439.4 secs Computing kpt #: 338 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 441.3 secs Computing kpt #: 339 total cpu time spent up to now is 442.7 secs Computing kpt #: 340 total cpu time spent up to now is 443.9 secs Computing kpt #: 341 total cpu time spent up to now is 445.2 secs Computing kpt #: 342 total cpu time spent up to now is 446.5 secs Computing kpt #: 343 total cpu time spent up to now is 447.8 secs Computing kpt #: 344 total cpu time spent up to now is 449.0 secs Computing kpt #: 345 total cpu time spent up to now is 450.1 secs Computing kpt #: 346 total cpu time spent up to now is 451.3 secs Computing kpt #: 347 total cpu time spent up to now is 452.5 secs Computing kpt #: 348 total cpu time spent up to now is 453.8 secs Computing kpt #: 349 total cpu time spent up to now is 454.6 secs Computing kpt #: 350 total cpu time spent up to now is 455.7 secs Computing kpt #: 351 total cpu time spent up to now is 456.6 secs Computing kpt #: 352 total cpu time spent up to now is 457.4 secs Computing kpt #: 353 total cpu time spent up to now is 458.2 secs Computing kpt #: 354 total cpu time spent up to now is 459.4 secs Computing kpt #: 355 total cpu time spent up to now is 460.4 secs Computing kpt #: 356 total cpu time spent up to now is 461.6 secs Computing kpt #: 357 total cpu time spent up to now is 463.0 secs Computing kpt #: 358 total cpu time spent up to now is 464.7 secs Computing kpt #: 359 total cpu time spent up to now is 466.3 secs Computing kpt #: 360 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 468.4 secs Computing kpt #: 361 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 470.5 secs Computing kpt #: 362 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 472.4 secs Computing kpt #: 363 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 474.4 secs Computing kpt #: 364 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 476.5 secs Computing kpt #: 365 total cpu time spent up to now is 478.0 secs ethr = 2.08E-08, avg # of iterations = 59.8 total cpu time spent up to now is 478.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3805 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9335 -17.9335 -17.9299 -17.9299 -17.4357 -17.4357 -17.4334 -17.4334 -17.2651 -17.2651 -17.2646 -17.2646 -8.9851 -8.9851 -8.9364 -8.9364 -1.5549 -1.5549 -1.2330 -1.2330 3.2440 3.2440 4.5900 4.5900 5.9305 5.9305 5.9493 5.9493 5.9721 5.9721 5.9909 5.9909 6.9138 6.9138 8.9588 8.9588 9.8169 9.8169 9.8256 9.8256 9.9955 9.9955 10.0046 10.0046 12.6690 12.6690 12.6807 12.6807 12.6818 12.6818 12.7589 12.7589 12.7603 12.7603 k = 0.0089 0.0052-0.0000 ( 3805 PWs) bands (ev): -38.9855 -38.9855 -38.9850 -38.9850 -17.9347 -17.9324 -17.9310 -17.9288 -17.4371 -17.4348 -17.4346 -17.4323 -17.2653 -17.2653 -17.2648 -17.2648 -8.9851 -8.9844 -8.9365 -8.9358 -1.5540 -1.5536 -1.2323 -1.2321 3.2450 3.2451 4.5896 4.5902 5.9300 5.9302 5.9488 5.9488 5.9694 5.9701 5.9890 5.9890 6.9188 6.9193 8.9568 8.9578 9.8122 9.8123 9.8218 9.8219 9.9916 9.9925 10.0016 10.0018 12.6696 12.6705 12.6776 12.6797 12.6830 12.6835 12.7595 12.7595 12.7617 12.7622 k = 0.0179 0.0103-0.0000 ( 3807 PWs) bands (ev): -38.9854 -38.9854 -38.9849 -38.9849 -17.9358 -17.9322 -17.9313 -17.9277 -17.4388 -17.4365 -17.4336 -17.4313 -17.2660 -17.2660 -17.2655 -17.2655 -8.9845 -8.9832 -8.9360 -8.9347 -1.5508 -1.5501 -1.2300 -1.2296 3.2479 3.2482 4.5889 4.5900 5.9282 5.9286 5.9473 5.9473 5.9601 5.9615 5.9857 5.9860 6.9342 6.9350 8.9519 8.9539 9.7948 9.7951 9.8140 9.8143 9.9780 9.9799 9.9954 9.9958 12.6629 12.6677 12.6798 12.6809 12.6883 12.6885 12.7595 12.7598 12.7676 12.7683 k = 0.0268 0.0155-0.0000 ( 3807 PWs) bands (ev): -38.9852 -38.9852 -38.9847 -38.9847 -17.9370 -17.9334 -17.9303 -17.9267 -17.4407 -17.4383 -17.4329 -17.4306 -17.2671 -17.2671 -17.2666 -17.2666 -8.9833 -8.9813 -8.9351 -8.9331 -1.5454 -1.5443 -1.2261 -1.2256 3.2529 3.2533 4.5878 4.5896 5.9246 5.9253 5.9400 5.9416 5.9476 5.9480 5.9842 5.9846 6.9589 6.9602 8.9439 8.9469 9.7642 9.7648 9.8035 9.8039 9.9536 9.9564 9.9875 9.9881 12.6484 12.6551 12.6896 12.6906 12.6972 12.6974 12.7590 12.7597 12.7775 12.7786 k = 0.0357 0.0206-0.0000 ( 3805 PWs) bands (ev): -38.9849 -38.9849 -38.9844 -38.9844 -17.9383 -17.9347 -17.9293 -17.9257 -17.4428 -17.4404 -17.4324 -17.4301 -17.2687 -17.2686 -17.2682 -17.2681 -8.9814 -8.9789 -8.9337 -8.9310 -1.5377 -1.5363 -1.2206 -1.2199 3.2599 3.2604 4.5864 4.5887 5.9121 5.9144 5.9224 5.9239 5.9450 5.9452 5.9840 5.9844 6.9917 6.9935 8.9326 8.9367 9.7221 9.7229 9.7897 9.7902 9.9195 9.9230 9.9772 9.9779 12.6306 12.6381 12.7029 12.7041 12.7096 12.7101 12.7577 12.7590 12.7913 12.7926 k = 0.0446 0.0258-0.0000 ( 3796 PWs) bands (ev): -38.9846 -38.9846 -38.9841 -38.9841 -17.9395 -17.9359 -17.9283 -17.9247 -17.4452 -17.4428 -17.4321 -17.4298 -17.2707 -17.2705 -17.2702 -17.2700 -8.9790 -8.9759 -8.9317 -8.9283 -1.5278 -1.5261 -1.2136 -1.2127 3.2688 3.2695 4.5847 4.5876 5.8822 5.8855 5.9140 5.9153 5.9438 5.9441 5.9845 5.9848 7.0312 7.0335 8.9179 8.9230 9.6697 9.6707 9.7726 9.7732 9.8763 9.8805 9.9643 9.9650 12.6107 12.6185 12.7183 12.7202 12.7252 12.7267 12.7552 12.7585 12.8087 12.8103 k = 0.0536 0.0309-0.0000 ( 3806 PWs) bands (ev): -38.9842 -38.9842 -38.9837 -38.9837 -17.9408 -17.9373 -17.9273 -17.9238 -17.4478 -17.4455 -17.4321 -17.4298 -17.2732 -17.2729 -17.2727 -17.2723 -8.9760 -8.9722 -8.9292 -8.9252 -1.5157 -1.5136 -1.2049 -1.2039 3.2797 3.2805 4.5825 4.5859 5.8471 5.8510 5.9045 5.9060 5.9430 5.9434 5.9852 5.9855 7.0763 7.0790 8.8994 8.9054 9.6082 9.6095 9.7524 9.7531 9.8247 9.8295 9.9487 9.9495 12.5890 12.5968 12.7325 12.7387 12.7430 12.7458 12.7519 12.7612 12.8293 12.8311 k = 0.0625 0.0361-0.0000 ( 3804 PWs) bands (ev): -38.9837 -38.9837 -38.9832 -38.9832 -17.9421 -17.9386 -17.9264 -17.9230 -17.4507 -17.4483 -17.4322 -17.4299 -17.2761 -17.2756 -17.2755 -17.2750 -8.9724 -8.9681 -8.9263 -8.9217 -1.5014 -1.4989 -1.1947 -1.1935 3.2925 3.2934 4.5798 4.5838 5.8092 5.8137 5.8934 5.8950 5.9427 5.9431 5.9860 5.9864 7.1256 7.1288 8.8767 8.8836 9.5390 9.5404 9.7293 9.7300 9.7658 9.7711 9.9305 9.9313 12.5660 12.5736 12.7369 12.7451 12.7601 12.7632 12.7688 12.7746 12.8530 12.8550 k = 0.0714 0.0412-0.0000 ( 3804 PWs) bands (ev): -38.9831 -38.9831 -38.9826 -38.9826 -17.9435 -17.9401 -17.9256 -17.9222 -17.4538 -17.4515 -17.4326 -17.4303 -17.2794 -17.2789 -17.2785 -17.2780 -8.9683 -8.9633 -8.9229 -8.9176 -1.4848 -1.4821 -1.1829 -1.1815 3.3072 3.3083 4.5766 4.5811 5.7696 5.7746 5.8805 5.8823 5.9427 5.9431 5.9872 5.9875 7.1782 7.1819 8.8491 8.8569 9.4633 9.4649 9.6990 9.7034 9.7059 9.7066 9.9098 9.9107 12.5418 12.5491 12.7326 12.7379 12.7831 12.7864 12.7925 12.7958 12.8794 12.8815 k = 0.0804 0.0464-0.0000 ( 3816 PWs) bands (ev): -38.9824 -38.9824 -38.9819 -38.9819 -17.9449 -17.9416 -17.9249 -17.9215 -17.4573 -17.4549 -17.4332 -17.4309 -17.2831 -17.2826 -17.2818 -17.2813 -8.9636 -8.9581 -8.9190 -8.9132 -1.4661 -1.4630 -1.1695 -1.1679 3.3238 3.3249 4.5725 4.5777 5.7291 5.7347 5.8660 5.8680 5.9427 5.9431 5.9884 5.9887 7.2332 7.2373 8.8160 8.8246 9.3823 9.3840 9.6292 9.6359 9.6762 9.6773 9.8867 9.8876 12.5164 12.5233 12.7246 12.7286 12.8074 12.8115 12.8183 12.8201 12.9082 12.9104 k = 0.0893 0.0515-0.0000 ( 3806 PWs) bands (ev): -38.9817 -38.9817 -38.9812 -38.9812 -17.9464 -17.9431 -17.9242 -17.9209 -17.4609 -17.4586 -17.4340 -17.4317 -17.2870 -17.2865 -17.2853 -17.2848 -8.9584 -8.9524 -8.9147 -8.9083 -1.4452 -1.4418 -1.1544 -1.1528 3.3421 3.3433 4.5679 4.5736 5.6883 5.6945 5.8502 5.8524 5.9429 5.9433 5.9898 5.9902 7.2900 7.2945 8.7765 8.7857 9.2973 9.2990 9.5548 9.5619 9.6466 9.6478 9.8614 9.8624 12.4900 12.4965 12.7140 12.7173 12.8318 12.8367 12.8465 12.8475 12.9391 12.9415 k = 0.0982 0.0567-0.0000 ( 3806 PWs) bands (ev): -38.9810 -38.9810 -38.9805 -38.9805 -17.9479 -17.9447 -17.9236 -17.9204 -17.4648 -17.4625 -17.4350 -17.4327 -17.2913 -17.2908 -17.2891 -17.2886 -8.9527 -8.9461 -8.9100 -8.9030 -1.4222 -1.4185 -1.1378 -1.1360 3.3622 3.3635 4.5625 4.5687 5.6478 5.6544 5.8331 5.8355 5.9431 5.9436 5.9912 5.9915 7.3478 7.3528 8.7296 8.7392 9.2092 9.2109 9.4781 9.4855 9.6155 9.6167 9.8341 9.8351 12.4625 12.4686 12.7009 12.7038 12.8556 12.8610 12.8773 12.8780 12.9720 12.9744 k = 0.1071 0.0619-0.0000 ( 3806 PWs) bands (ev): -38.9801 -38.9801 -38.9796 -38.9796 -17.9496 -17.9464 -17.9231 -17.9200 -17.4690 -17.4667 -17.4362 -17.4340 -17.2959 -17.2954 -17.2930 -17.2925 -8.9465 -8.9395 -8.9049 -8.8974 -1.3971 -1.3930 -1.1196 -1.1176 3.3839 3.3853 4.5562 4.5629 5.6078 5.6150 5.8148 5.8174 5.9434 5.9439 5.9925 5.9929 7.4061 7.4114 8.6745 8.6842 9.1189 9.1204 9.4011 9.4086 9.5831 9.5844 9.8049 9.8061 12.4341 12.4397 12.6856 12.6882 12.8787 12.8846 12.9102 12.9109 13.0065 13.0090 k = 0.1161 0.0670-0.0000 ( 3808 PWs) bands (ev): -38.9792 -38.9792 -38.9787 -38.9787 -17.9513 -17.9482 -17.9228 -17.9198 -17.4734 -17.4711 -17.4377 -17.4354 -17.3007 -17.3002 -17.2972 -17.2967 -8.9399 -8.9324 -8.8994 -8.8914 -1.3698 -1.3655 -1.0998 -1.0977 3.4072 3.4087 4.5489 4.5561 5.5688 5.5765 5.7955 5.7983 5.9437 5.9441 5.9939 5.9943 7.4642 7.4700 8.6106 8.6202 9.0266 9.0280 9.3258 9.3330 9.5497 9.5510 9.7742 9.7754 12.4047 12.4099 12.6681 12.6703 12.9012 12.9075 12.9449 12.9457 13.0423 13.0448 k = 0.1250 0.0722-0.0000 ( 3818 PWs) bands (ev): -38.9782 -38.9782 -38.9777 -38.9777 -17.9531 -17.9501 -17.9226 -17.9197 -17.4780 -17.4758 -17.4394 -17.4372 -17.3057 -17.3052 -17.3014 -17.3009 -8.9329 -8.9249 -8.8935 -8.8851 -1.3405 -1.3359 -1.0785 -1.0762 3.4320 3.4335 4.5407 4.5483 5.5309 5.5390 5.7752 5.7782 5.9439 5.9444 5.9952 5.9956 7.5216 7.5276 8.5378 8.5470 8.9323 8.9336 9.2538 9.2605 9.5155 9.5168 9.7421 9.7433 12.3744 12.3792 12.6483 12.6503 12.9232 12.9299 12.9811 12.9818 13.0791 13.0816 k = 0.1339 0.0773-0.0000 ( 3818 PWs) bands (ev): -38.9772 -38.9772 -38.9767 -38.9767 -17.9550 -17.9521 -17.9225 -17.9198 -17.4829 -17.4807 -17.4413 -17.4391 -17.3108 -17.3103 -17.3057 -17.3052 -8.9255 -8.9171 -8.8873 -8.8784 -1.3091 -1.3042 -1.0555 -1.0531 3.4582 3.4598 4.5314 4.5395 5.4943 5.5028 5.7542 5.7573 5.9441 5.9446 5.9965 5.9969 7.5774 7.5837 8.4567 8.4653 8.8359 8.8371 9.1865 9.1924 9.4807 9.4820 9.7088 9.7100 12.3432 12.3476 12.6263 12.6281 12.9446 12.9518 13.0184 13.0190 13.1154 13.1176 k = 0.1429 0.0825-0.0000 ( 3818 PWs) bands (ev): -38.9762 -38.9762 -38.9757 -38.9757 -17.9570 -17.9542 -17.9227 -17.9200 -17.4879 -17.4858 -17.4434 -17.4413 -17.3160 -17.3155 -17.3101 -17.3096 -8.9177 -8.9089 -8.8808 -8.8715 -1.2758 -1.2706 -1.0309 -1.0284 3.4858 3.4874 4.5212 4.5296 5.4590 5.4679 5.7324 5.7357 5.9443 5.9447 5.9977 5.9982 7.6306 7.6371 8.3686 8.3765 8.7373 8.7386 9.1244 9.1293 9.4456 9.4470 9.6745 9.6757 12.3110 12.3151 12.6020 12.6037 12.9654 12.9733 13.0565 13.0570 13.1428 13.1471 k = 0.1518 0.0876-0.0000 ( 3816 PWs) bands (ev): -38.9750 -38.9750 -38.9745 -38.9745 -17.9591 -17.9565 -17.9230 -17.9205 -17.4932 -17.4910 -17.4458 -17.4437 -17.3213 -17.3208 -17.3145 -17.3140 -8.9096 -8.9004 -8.8741 -8.8643 -1.2404 -1.2350 -1.0048 -1.0021 3.5146 3.5163 4.5099 4.5187 5.4249 5.4341 5.7100 5.7135 5.9443 5.9448 5.9989 5.9993 7.6796 7.6862 8.2755 8.2827 8.6373 8.6388 9.0674 9.0711 9.4104 9.4117 9.6395 9.6407 12.2780 12.2817 12.5756 12.5771 12.9856 12.9942 13.0951 13.0956 13.1692 13.1740 k = 0.1607 0.0928-0.0000 ( 3816 PWs) bands (ev): -38.9739 -38.9739 -38.9734 -38.9734 -17.9614 -17.9588 -17.9236 -17.9211 -17.4986 -17.4964 -17.4484 -17.4463 -17.3266 -17.3261 -17.3188 -17.3184 -8.9012 -8.8917 -8.8670 -8.8569 -1.2031 -1.1975 -0.9770 -0.9742 3.5445 3.5462 4.4978 4.5067 5.3921 5.4016 5.6871 5.6908 5.9443 5.9448 5.9999 6.0004 7.7215 7.7279 8.1797 8.1866 8.5379 8.5395 9.0148 9.0174 9.3751 9.3765 9.6038 9.6051 12.2442 12.2475 12.5471 12.5484 13.0051 13.0146 13.1342 13.1344 13.1951 13.1992 k = 0.1696 0.0979-0.0000 ( 3812 PWs) bands (ev): -38.9727 -38.9727 -38.9722 -38.9722 -17.9638 -17.9613 -17.9243 -17.9220 -17.5041 -17.5020 -17.4513 -17.4492 -17.3318 -17.3313 -17.3232 -17.3227 -8.8926 -8.8827 -8.8598 -8.8494 -1.1640 -1.1581 -0.9477 -0.9448 3.5754 3.5771 4.4847 4.4939 5.3604 5.3701 5.6638 5.6677 5.9442 5.9447 6.0008 6.0013 7.7509 7.7565 8.0851 8.0918 8.4424 8.4439 8.9660 8.9674 9.3400 9.3414 9.5678 9.5691 12.2095 12.2126 12.5165 12.5177 13.0240 13.0343 13.1733 13.1734 13.2208 13.2246 k = 0.1786 0.1031-0.0000 ( 3820 PWs) bands (ev): -38.9714 -38.9714 -38.9709 -38.9709 -17.9663 -17.9640 -17.9254 -17.9232 -17.5097 -17.5077 -17.4544 -17.4524 -17.3370 -17.3365 -17.3275 -17.3270 -8.8837 -8.8736 -8.8523 -8.8416 -1.1230 -1.1169 -0.9169 -0.9139 3.6072 3.6089 4.4708 4.4802 5.3295 5.3393 5.6400 5.6441 5.9439 5.9444 6.0015 6.0020 7.7569 7.7610 7.9979 8.0047 8.3574 8.3582 8.9200 8.9204 9.3052 9.3066 9.5316 9.5329 12.1741 12.1769 12.4839 12.4849 13.0420 13.0533 13.2121 13.2125 13.2463 13.2500 k = 0.1875 0.1083-0.0000 ( 3828 PWs) bands (ev): -38.9701 -38.9701 -38.9696 -38.9696 -17.9690 -17.9668 -17.9267 -17.9247 -17.5154 -17.5134 -17.4578 -17.4559 -17.3420 -17.3415 -17.3317 -17.3312 -8.8747 -8.8643 -8.8447 -8.8337 -1.0802 -1.0739 -0.8845 -0.8813 3.6396 3.6413 4.4563 4.4657 5.2992 5.3092 5.6160 5.6202 5.9434 5.9439 6.0020 6.0025 7.7246 7.7271 7.9246 7.9305 8.2923 8.2932 8.8759 8.8764 9.2708 9.2722 9.4954 9.4966 12.1380 12.1405 12.4494 12.4502 13.0593 13.0717 13.2502 13.2515 13.2720 13.2758 k = 0.1964 0.1134-0.0000 ( 3830 PWs) bands (ev): -38.9688 -38.9688 -38.9683 -38.9683 -17.9718 -17.9697 -17.9283 -17.9264 -17.5211 -17.5191 -17.4615 -17.4596 -17.3468 -17.3463 -17.3358 -17.3353 -8.8654 -8.8549 -8.8369 -8.8258 -1.0357 -1.0293 -0.8505 -0.8473 3.6727 3.6743 4.4412 4.4507 5.2693 5.2793 5.5917 5.5962 5.9428 5.9433 6.0024 6.0029 7.6535 7.6552 7.8565 7.8601 8.2567 8.2602 8.8333 8.8347 9.2369 9.2383 9.4593 9.4605 12.1012 12.1035 12.4131 12.4138 13.0759 13.0893 13.2868 13.2898 13.2985 13.3033 k = 0.2054 0.1186-0.0000 ( 3832 PWs) bands (ev): -38.9675 -38.9675 -38.9670 -38.9670 -17.9748 -17.9728 -17.9303 -17.9284 -17.5268 -17.5248 -17.4654 -17.4635 -17.3515 -17.3510 -17.3398 -17.3393 -8.8561 -8.8453 -8.8290 -8.8177 -0.9895 -0.9829 -0.8150 -0.8117 3.7062 3.7077 4.4259 4.4353 5.2394 5.2494 5.5672 5.5719 5.9421 5.9426 6.0026 6.0031 7.5605 7.5619 7.7770 7.7779 8.2522 8.2581 8.7924 8.7944 9.2037 9.2050 9.4234 9.4246 12.0640 12.0661 12.3753 12.3759 13.0919 13.1062 13.3192 13.3225 13.3307 13.3350 k = 0.2143 0.1237-0.0000 ( 3834 PWs) bands (ev): -38.9661 -38.9661 -38.9656 -38.9656 -17.9780 -17.9761 -17.9325 -17.9308 -17.5324 -17.5305 -17.4695 -17.4677 -17.3559 -17.3554 -17.3437 -17.3432 -8.8467 -8.8358 -8.8210 -8.8096 -0.9417 -0.9350 -0.7780 -0.7746 3.7399 3.7413 4.4103 4.4196 5.2091 5.2191 5.5427 5.5476 5.9411 5.9416 6.0026 6.0031 7.4581 7.4593 7.6830 7.6842 8.2694 8.2770 8.7530 8.7555 9.1711 9.1724 9.3879 9.3891 12.0262 12.0282 12.3362 12.3366 13.1075 13.1227 13.3478 13.3501 13.3683 13.3708 k = 0.2232 0.1289-0.0000 ( 3832 PWs) bands (ev): -38.9648 -38.9648 -38.9643 -38.9643 -17.9813 -17.9795 -17.9350 -17.9335 -17.5380 -17.5360 -17.4738 -17.4721 -17.3600 -17.3595 -17.3474 -17.3469 -8.8371 -8.8261 -8.8130 -8.8014 -0.8924 -0.8856 -0.7395 -0.7360 3.7736 3.7749 4.3948 4.4040 5.1781 5.1881 5.5181 5.5232 5.9399 5.9404 6.0025 6.0030 7.3514 7.3526 7.5808 7.5834 8.2987 8.3073 8.7148 8.7179 9.1392 9.1405 9.3530 9.3542 11.9882 11.9899 12.2959 12.2961 13.1228 13.1387 13.3756 13.3777 13.4061 13.4077 k = 0.2321 0.1340-0.0000 ( 3836 PWs) bands (ev): -38.9634 -38.9634 -38.9629 -38.9629 -17.9847 -17.9831 -17.9379 -17.9365 -17.5434 -17.5415 -17.4784 -17.4767 -17.3639 -17.3634 -17.3511 -17.3505 -8.8276 -8.8166 -8.8049 -8.7933 -0.8417 -0.8348 -0.6996 -0.6959 3.8072 3.8083 4.3793 4.3883 5.1462 5.1559 5.4935 5.4988 5.9385 5.9390 6.0021 6.0026 7.2426 7.2437 7.4756 7.4793 8.3340 8.3432 8.6780 8.6814 9.1081 9.1093 9.3187 9.3198 11.9498 11.9514 12.2547 12.2548 13.1381 13.1547 13.4036 13.4059 13.4437 13.4448 k = 0.2411 0.1392-0.0000 ( 3840 PWs) bands (ev): -38.9620 -38.9620 -38.9615 -38.9615 -17.9883 -17.9868 -17.9412 -17.9398 -17.5486 -17.5468 -17.4830 -17.4814 -17.3676 -17.3670 -17.3545 -17.3540 -8.8181 -8.8070 -8.7968 -8.7851 -0.7896 -0.7826 -0.6582 -0.6544 3.8403 3.8411 4.3642 4.3729 5.1128 5.1224 5.4689 5.4745 5.9369 5.9374 6.0015 6.0021 7.1324 7.1333 7.3709 7.3752 8.3720 8.3816 8.6424 8.6462 9.0778 9.0790 9.2852 9.2863 11.9114 11.9128 12.2128 12.2129 13.1536 13.1707 13.4321 13.4347 13.4809 13.4817 k = 0.2500 0.1443-0.0000 ( 3836 PWs) bands (ev): -38.9606 -38.9606 -38.9601 -38.9601 -17.9920 -17.9906 -17.9447 -17.9435 -17.5536 -17.5518 -17.4878 -17.4863 -17.3710 -17.3704 -17.3579 -17.3573 -8.8086 -8.7975 -8.7887 -8.7771 -0.7363 -0.7293 -0.6153 -0.6115 3.8726 3.8732 4.3495 4.3579 5.0779 5.0873 5.4445 5.4503 5.9351 5.9356 6.0008 6.0013 7.0209 7.0218 7.2686 7.2736 8.4110 8.4209 8.6082 8.6123 9.0484 9.0496 9.2525 9.2536 11.8729 11.8742 12.1704 12.1706 13.1696 13.1870 13.4611 13.4640 13.5178 13.5182 k = 0.2589 0.1495-0.0000 ( 3840 PWs) bands (ev): -38.9592 -38.9591 -38.9587 -38.9587 -17.9959 -17.9946 -17.9486 -17.9475 -17.5584 -17.5567 -17.4927 -17.4913 -17.3741 -17.3734 -17.3610 -17.3604 -8.7992 -8.7881 -8.7807 -8.7691 -0.6819 -0.6748 -0.5711 -0.5672 3.9039 3.9042 4.3354 4.3434 5.0413 5.0505 5.4202 5.4262 5.9330 5.9335 5.9999 6.0004 6.9082 6.9089 7.1705 7.1759 8.4498 8.4599 8.5755 8.5799 9.0198 9.0209 9.2208 9.2218 11.8345 11.8358 12.1278 12.1282 13.1862 13.2038 13.4906 13.4938 13.5543 13.5545 k = 0.2679 0.1546-0.0000 ( 3844 PWs) bands (ev): -38.9577 -38.9577 -38.9572 -38.9572 -17.9999 -17.9986 -17.9529 -17.9518 -17.5630 -17.5613 -17.4978 -17.4963 -17.3769 -17.3763 -17.3641 -17.3634 -8.7899 -8.7789 -8.7727 -8.7612 -0.6265 -0.6195 -0.5255 -0.5214 3.9336 3.9337 4.3220 4.3295 5.0030 5.0119 5.3960 5.4022 5.9307 5.9312 5.9988 5.9993 6.7944 6.7949 7.0776 7.0833 8.4877 8.4978 8.5445 8.5492 8.9920 8.9932 9.1901 9.1911 11.7963 11.7975 12.0852 12.0858 13.2037 13.2214 13.5205 13.5240 13.5904 13.5905 k = 0.2768 0.1598-0.0000 ( 3848 PWs) bands (ev): -38.9564 -38.9564 -38.9559 -38.9559 -18.0040 -18.0028 -17.9574 -17.9564 -17.5673 -17.5656 -17.5028 -17.5014 -17.3795 -17.3789 -17.3669 -17.3663 -8.7807 -8.7698 -8.7648 -8.7534 -0.5702 -0.5633 -0.4785 -0.4743 3.9610 3.9616 4.3094 4.3164 4.9631 4.9716 5.3720 5.3783 5.9282 5.9287 5.9976 5.9981 6.6796 6.6799 6.9908 6.9966 8.5126 8.5170 8.5270 8.5374 8.9652 8.9663 9.1605 9.1615 11.7585 11.7596 12.0429 12.0436 13.2222 13.2399 13.5506 13.5543 13.6260 13.6263 k = 0.2857 0.1650-0.0000 ( 3842 PWs) bands (ev): -38.9550 -38.9550 -38.9545 -38.9545 -18.0081 -18.0071 -17.9622 -17.9612 -17.5712 -17.5696 -17.5078 -17.5065 -17.3819 -17.3812 -17.3696 -17.3690 -8.7717 -8.7609 -8.7571 -8.7458 -0.5132 -0.5065 -0.4302 -0.4259 3.9858 3.9869 4.2979 4.3042 4.9220 4.9302 5.3481 5.3546 5.9255 5.9259 5.9963 5.9968 6.5643 6.5643 6.9102 6.9161 8.4863 8.4908 8.5609 8.5715 8.9393 8.9403 9.1322 9.1331 11.7212 11.7222 12.0011 12.0018 13.2418 13.2594 13.5807 13.5846 13.6612 13.6617 k = 0.2946 0.1701-0.0000 ( 3848 PWs) bands (ev): -38.9536 -38.9536 -38.9531 -38.9531 -18.0124 -18.0114 -17.9672 -17.9664 -17.5749 -17.5734 -17.5128 -17.5116 -17.3841 -17.3834 -17.3722 -17.3716 -8.7628 -8.7522 -8.7495 -8.7384 -0.4558 -0.4493 -0.3806 -0.3761 4.0071 4.0089 4.2875 4.2929 4.8803 4.8881 5.3242 5.3309 5.9226 5.9230 5.9948 5.9953 6.4485 6.4488 6.8358 6.8418 8.4605 8.4650 8.5946 8.6051 8.9142 8.9152 9.1051 9.1059 11.6844 11.6854 11.9598 11.9606 13.2626 13.2800 13.6107 13.6149 13.6960 13.6967 k = 0.3036 0.1753-0.0000 ( 3856 PWs) bands (ev): -38.9523 -38.9523 -38.9518 -38.9518 -18.0167 -18.0158 -17.9725 -17.9717 -17.5783 -17.5768 -17.5178 -17.5166 -17.3861 -17.3853 -17.3747 -17.3740 -8.7541 -8.7437 -8.7420 -8.7312 -0.3981 -0.3919 -0.3298 -0.3251 4.0241 4.0266 4.2784 4.2829 4.8388 4.8461 5.3004 5.3072 5.9194 5.9199 5.9932 5.9937 6.3332 6.3337 6.7677 6.7736 8.4366 8.4412 8.6267 8.6370 8.8899 8.8909 9.0792 9.0801 11.6483 11.6492 11.9192 11.9201 13.2846 13.3018 13.6405 13.6449 13.7304 13.7313 k = 0.3125 0.1804-0.0000 ( 3864 PWs) bands (ev): -38.9510 -38.9509 -38.9505 -38.9505 -18.0210 -18.0201 -17.9780 -17.9772 -17.5815 -17.5800 -17.5227 -17.5216 -17.3878 -17.3871 -17.3769 -17.3763 -8.7457 -8.7355 -8.7347 -8.7241 -0.3404 -0.3345 -0.2778 -0.2728 4.0354 4.0387 4.2709 4.2745 4.7987 4.8054 5.2765 5.2834 5.9161 5.9166 5.9915 5.9920 6.2188 6.2195 6.7054 6.7113 8.4147 8.4193 8.6568 8.6670 8.8666 8.8675 9.0547 9.0555 11.6131 11.6139 11.8796 11.8805 13.3081 13.3249 13.6699 13.6746 13.7644 13.7654 k = 0.3214 0.1856-0.0000 ( 3868 PWs) bands (ev): -38.9497 -38.9497 -38.9492 -38.9492 -18.0253 -18.0245 -17.9837 -17.9829 -17.5842 -17.5829 -17.5275 -17.5264 -17.3894 -17.3886 -17.3791 -17.3784 -8.7375 -8.7276 -8.7276 -8.7173 -0.2828 -0.2773 -0.2246 -0.2193 4.0399 4.0437 4.2655 4.2681 4.7611 4.7671 5.2524 5.2595 5.9127 5.9131 5.9897 5.9902 6.1058 6.1066 6.6489 6.6547 8.3951 8.3996 8.6850 8.6950 8.8442 8.8450 9.0316 9.0323 11.5788 11.5796 11.8409 11.8419 13.3328 13.3493 13.6989 13.7037 13.7979 13.7990 k = 0.3304 0.1907-0.0000 ( 3878 PWs) bands (ev): -38.9484 -38.9484 -38.9479 -38.9479 -18.0296 -18.0289 -17.9894 -17.9887 -17.5868 -17.5854 -17.5322 -17.5312 -17.3908 -17.3901 -17.3811 -17.3804 -8.7296 -8.7207 -8.7200 -8.7108 -0.2257 -0.2206 -0.1704 -0.1648 4.0361 4.0403 4.2621 4.2641 4.7274 4.7327 5.2282 5.2354 5.9092 5.9096 5.9867 5.9880 5.9958 5.9960 6.5975 6.6032 8.3776 8.3820 8.7111 8.7210 8.8227 8.8234 9.0098 9.0104 11.5455 11.5462 11.8033 11.8044 13.3589 13.3751 13.7272 13.7323 13.8308 13.8321 k = 0.3393 0.1959-0.0000 ( 3882 PWs) bands (ev): -38.9472 -38.9472 -38.9467 -38.9467 -18.0338 -18.0331 -17.9952 -17.9945 -17.5890 -17.5877 -17.5367 -17.5358 -17.3921 -17.3913 -17.3830 -17.3823 -8.7220 -8.7141 -8.7127 -8.7045 -0.1690 -0.1645 -0.1154 -0.1094 4.0233 4.0274 4.2609 4.2626 4.6987 4.7032 5.2038 5.2110 5.8857 5.8869 5.9057 5.9060 5.9863 5.9866 6.5511 6.5566 8.3625 8.3668 8.7352 8.7449 8.8021 8.8028 8.9893 8.9900 11.5134 11.5140 11.7669 11.7681 13.3864 13.4021 13.7549 13.7602 13.8631 13.8645 k = 0.3482 0.2010-0.0000 ( 3878 PWs) bands (ev): -38.9460 -38.9460 -38.9455 -38.9455 -18.0379 -18.0373 -18.0011 -18.0004 -17.5909 -17.5897 -17.5411 -17.5402 -17.3932 -17.3925 -17.3847 -17.3840 -8.7147 -8.7077 -8.7057 -8.6984 -0.1130 -0.1090 -0.0598 -0.0536 4.0013 4.0050 4.2617 4.2634 4.6757 4.6795 5.1792 5.1865 5.7801 5.7813 5.9020 5.9023 5.9844 5.9848 6.5092 6.5146 8.3496 8.3538 8.7570 8.7666 8.7827 8.7830 8.9703 8.9709 11.4825 11.4831 11.7319 11.7330 13.4151 13.4304 13.7818 13.7874 13.8947 13.8962 k = 0.3571 0.2062-0.0000 ( 3870 PWs) bands (ev): -38.9449 -38.9449 -38.9444 -38.9444 -18.0419 -18.0414 -18.0069 -18.0062 -17.5925 -17.5914 -17.5453 -17.5445 -17.3942 -17.3934 -17.3862 -17.3856 -8.7077 -8.7015 -8.6990 -8.6927 -0.0578 -0.0542 -0.0041 0.0023 3.9707 3.9737 4.2641 4.2661 4.6585 4.6616 5.1544 5.1617 5.6778 5.6791 5.8983 5.8986 5.9826 5.9830 6.4715 6.4767 8.3390 8.3431 8.7626 8.7641 8.7783 8.7864 8.9526 8.9531 11.4529 11.4535 11.6982 11.6993 13.4452 13.4600 13.8079 13.8138 13.9255 13.9271 k = 0.3661 0.2114-0.0000 ( 3868 PWs) bands (ev): -38.9438 -38.9438 -38.9433 -38.9433 -18.0458 -18.0453 -18.0127 -18.0120 -17.5939 -17.5929 -17.5494 -17.5486 -17.3950 -17.3943 -17.3877 -17.3870 -8.7010 -8.6957 -8.6928 -8.6873 -0.0034 -0.0001 0.0514 0.0578 3.9326 3.9349 4.2676 4.2702 4.6466 4.6490 5.1293 5.1366 5.5796 5.5808 5.8946 5.8950 5.9808 5.9812 6.4376 6.4425 8.3307 8.3346 8.7454 8.7463 8.7957 8.8040 8.9363 8.9367 11.4247 11.4253 11.6659 11.6671 13.4763 13.4907 13.8332 13.8394 13.9554 13.9570 k = 0.3750 0.2165-0.0000 ( 3866 PWs) bands (ev): -38.9428 -38.9428 -38.9423 -38.9423 -18.0495 -18.0490 -18.0184 -18.0177 -17.5950 -17.5941 -17.5534 -17.5526 -17.3958 -17.3951 -17.3890 -17.3884 -8.6947 -8.6901 -8.6868 -8.6822 0.0501 0.0530 0.1061 0.1126 3.8885 3.8902 4.2722 4.2753 4.6390 4.6407 5.1041 5.1114 5.4860 5.4872 5.8910 5.8913 5.9790 5.9794 6.4071 6.4118 8.3245 8.3283 8.7287 8.7295 8.8116 8.8195 8.9212 8.9216 11.3980 11.3986 11.6353 11.6364 13.5086 13.5225 13.8577 13.8640 13.9843 13.9859 k = 0.3839 0.2217-0.0000 ( 3864 PWs) bands (ev): -38.9418 -38.9418 -38.9413 -38.9413 -18.0530 -18.0525 -18.0239 -18.0232 -17.5960 -17.5951 -17.5571 -17.5564 -17.3964 -17.3957 -17.3903 -17.3896 -8.6887 -8.6848 -8.6813 -8.6774 0.1025 0.1051 0.1597 0.1661 3.8401 3.8411 4.2777 4.2812 4.6343 4.6355 5.0788 5.0861 5.3978 5.3989 5.8875 5.8878 5.9772 5.9776 6.3798 6.3842 8.3204 8.3240 8.7129 8.7136 8.8254 8.8331 8.9075 8.9078 11.3729 11.3734 11.6062 11.6073 13.5417 13.5552 13.8811 13.8877 14.0121 14.0137 k = 0.3929 0.2268-0.0000 ( 3864 PWs) bands (ev): -38.9409 -38.9409 -38.9404 -38.9404 -18.0563 -18.0558 -18.0293 -18.0286 -17.5967 -17.5958 -17.5607 -17.5600 -17.3970 -17.3963 -17.3914 -17.3908 -8.6832 -8.6798 -8.6762 -8.6729 0.1536 0.1559 0.2117 0.2179 3.7888 3.7895 4.2840 4.2879 4.6312 4.6318 5.0534 5.0608 5.3157 5.3167 5.8841 5.8843 5.9756 5.9759 6.3553 6.3594 8.3182 8.3215 8.6982 8.6988 8.8374 8.8446 8.8951 8.8952 11.3494 11.3498 11.5789 11.5799 13.5757 13.5887 13.9036 13.9104 14.0386 14.0402 k = 0.4018 0.2320-0.0000 ( 3866 PWs) bands (ev): -38.9401 -38.9401 -38.9396 -38.9396 -18.0594 -18.0588 -18.0345 -18.0338 -17.5972 -17.5964 -17.5641 -17.5635 -17.3975 -17.3968 -17.3924 -17.3918 -8.6781 -8.6751 -8.6716 -8.6688 0.2032 0.2052 0.2615 0.2676 3.7364 3.7366 4.2910 4.2952 4.6282 4.6283 5.0282 5.0356 5.2407 5.2416 5.8808 5.8810 5.9739 5.9743 6.3334 6.3373 8.3176 8.3208 8.6845 8.6851 8.8473 8.8541 8.8840 8.8840 11.3276 11.3280 11.5533 11.5543 13.6102 13.6227 13.9248 13.9318 14.0637 14.0653 k = 0.4107 0.2371-0.0000 ( 3866 PWs) bands (ev): -38.9393 -38.9393 -38.9388 -38.9388 -18.0622 -18.0616 -18.0395 -18.0387 -17.5974 -17.5967 -17.5674 -17.5668 -17.3979 -17.3972 -17.3933 -17.3927 -8.6733 -8.6708 -8.6673 -8.6650 0.2510 0.2527 0.3089 0.3147 3.6839 3.6839 4.2988 4.3031 4.6236 4.6240 5.0033 5.0107 5.1738 5.1745 5.8777 5.8779 5.9724 5.9727 6.3139 6.3175 8.3186 8.3215 8.6720 8.6725 8.8547 8.8611 8.8748 8.8748 11.3075 11.3078 11.5297 11.5306 13.6450 13.6570 13.9448 13.9519 14.0873 14.0889 k = 0.4196 0.2423-0.0000 ( 3862 PWs) bands (ev): -38.9386 -38.9386 -38.9381 -38.9381 -18.0646 -18.0641 -18.0442 -18.0434 -17.5975 -17.5969 -17.5705 -17.5699 -17.3982 -17.3975 -17.3942 -17.3936 -8.6690 -8.6667 -8.6635 -8.6616 0.2966 0.2980 0.3532 0.3588 3.6326 3.6327 4.3070 4.3115 4.6167 4.6175 4.9789 4.9862 5.1158 5.1164 5.8748 5.8750 5.9710 5.9713 6.2967 6.2999 8.3208 8.3235 8.6605 8.6610 8.8574 8.8609 8.8700 8.8722 11.2891 11.2894 11.5080 11.5088 13.6799 13.6914 13.9632 13.9703 14.1093 14.1107 k = 0.4286 0.2474-0.0000 ( 3852 PWs) bands (ev): -38.9379 -38.9379 -38.9374 -38.9374 -18.0668 -18.0662 -18.0485 -18.0478 -17.5974 -17.5968 -17.5733 -17.5728 -17.3984 -17.3978 -17.3949 -17.3943 -8.6651 -8.6630 -8.6602 -8.6584 0.3396 0.3407 0.3940 0.3993 3.5837 3.5839 4.3157 4.3201 4.6067 4.6080 4.9553 4.9624 5.0675 5.0679 5.8721 5.8723 5.9697 5.9700 6.2815 6.2844 8.3241 8.3264 8.6502 8.6506 8.8529 8.8543 8.8720 8.8757 11.2726 11.2729 11.4884 11.4891 13.7144 13.7254 13.9797 13.9870 14.1294 14.1308 k = 0.4375 0.2526-0.0000 ( 3850 PWs) bands (ev): -38.9373 -38.9373 -38.9368 -38.9368 -18.0686 -18.0680 -18.0526 -18.0518 -17.5971 -17.5965 -17.5761 -17.5755 -17.3986 -17.3980 -17.3956 -17.3950 -8.6617 -8.6597 -8.6573 -8.6557 0.3796 0.3804 0.4309 0.4358 3.5381 3.5383 4.3246 4.3288 4.5935 4.5950 4.9330 4.9398 5.0289 5.0292 5.8697 5.8698 5.9686 5.9688 6.2683 6.2709 8.3279 8.3300 8.6411 8.6414 8.8467 8.8475 8.8754 8.8791 11.2580 11.2582 11.4708 11.4715 13.7482 13.7586 13.9942 14.0014 14.1477 14.1489 k = 0.4464 0.2577-0.0000 ( 3854 PWs) bands (ev): -38.9368 -38.9368 -38.9363 -38.9363 -18.0701 -18.0694 -18.0563 -18.0556 -17.5967 -17.5961 -17.5786 -17.5781 -17.3987 -17.3982 -17.3962 -17.3956 -8.6587 -8.6567 -8.6548 -8.6533 0.4161 0.4165 0.4634 0.4679 3.4966 3.4969 4.3333 4.3372 4.5776 4.5793 4.9126 4.9189 4.9994 4.9995 5.8675 5.8677 5.9675 5.9677 6.2570 6.2593 8.3322 8.3340 8.6331 8.6334 8.8410 8.8416 8.8782 8.8816 11.2452 11.2454 11.4555 11.4561 13.7808 13.7905 14.0063 14.0134 14.1639 14.1649 k = 0.4554 0.2629-0.0000 ( 3854 PWs) bands (ev): -38.9364 -38.9364 -38.9359 -38.9359 -18.0712 -18.0704 -18.0597 -18.0589 -17.5961 -17.5955 -17.5811 -17.5805 -17.3988 -17.3983 -17.3967 -17.3962 -8.6561 -8.6541 -8.6528 -8.6513 0.4487 0.4488 0.4911 0.4952 3.4602 3.4604 4.3416 4.3451 4.5603 4.5620 4.8948 4.9003 4.9775 4.9776 5.8657 5.8658 5.9666 5.9668 6.2475 6.2494 8.3365 8.3380 8.6263 8.6266 8.8360 8.8365 8.8804 8.8832 11.2344 11.2345 11.4425 11.4430 13.8115 13.8205 14.0157 14.0225 14.1779 14.1788 k = 0.4643 0.2681-0.0000 ( 3858 PWs) bands (ev): -38.9360 -38.9360 -38.9355 -38.9355 -18.0719 -18.0711 -18.0627 -18.0619 -17.5953 -17.5948 -17.5833 -17.5828 -17.3988 -17.3983 -17.3972 -17.3967 -8.6539 -8.6520 -8.6513 -8.6497 0.4765 0.4767 0.5138 0.5173 3.4293 3.4295 4.3492 4.3522 4.5433 4.5448 4.8799 4.8845 4.9619 4.9620 5.8641 5.8642 5.9659 5.9660 6.2399 6.2414 8.3405 8.3417 8.6208 8.6210 8.8320 8.8323 8.8819 8.8842 11.2254 11.2256 11.4317 11.4321 13.8396 13.8476 14.0223 14.0286 14.1896 14.1903 k = 0.4732 0.2732-0.0000 ( 3854 PWs) bands (ev): -38.9358 -38.9358 -38.9353 -38.9353 -18.0722 -18.0714 -18.0653 -18.0645 -17.5944 -17.5939 -17.5854 -17.5849 -17.3988 -17.3983 -17.3976 -17.3971 -8.6522 -8.6502 -8.6502 -8.6484 0.4993 0.4997 0.5312 0.5342 3.4047 3.4049 4.3556 4.3580 4.5282 4.5294 4.8682 4.8718 4.9513 4.9514 5.8629 5.8630 5.9653 5.9654 6.2340 6.2351 8.3440 8.3449 8.6165 8.6166 8.8289 8.8291 8.8829 8.8847 11.2185 11.2186 11.4233 11.4236 13.8642 13.8710 14.0263 14.0318 14.1989 14.1994 k = 0.4821 0.2784-0.0000 ( 3848 PWs) bands (ev): -38.9356 -38.9356 -38.9351 -38.9351 -18.0721 -18.0713 -18.0675 -18.0666 -17.5933 -17.5928 -17.5873 -17.5868 -17.3987 -17.3982 -17.3979 -17.3974 -8.6508 -8.6495 -8.6488 -8.6477 0.5165 0.5170 0.5434 0.5456 3.3868 3.3870 4.3606 4.3623 4.5165 4.5174 4.8598 4.8622 4.9445 4.9446 5.8620 5.8621 5.9649 5.9649 6.2298 6.2306 8.3467 8.3473 8.6134 8.6135 8.8266 8.8268 8.8837 8.8848 11.2136 11.2136 11.4173 11.4175 13.8840 13.8891 14.0283 14.0325 14.2056 14.2060 k = 0.4911 0.2835-0.0000 ( 3844 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0715 -18.0707 -18.0692 -18.0684 -17.5920 -17.5915 -17.5890 -17.5885 -17.3986 -17.3982 -17.3981 -17.3977 -8.6499 -8.6492 -8.6479 -8.6473 0.5275 0.5279 0.5506 0.5519 3.3760 3.3760 4.3639 4.3648 4.5092 4.5097 4.8549 4.8561 4.9408 4.9409 5.8615 5.8615 5.9646 5.9647 6.2274 6.2278 8.3485 8.3488 8.6115 8.6116 8.8253 8.8254 8.8842 8.8848 11.2106 11.2106 11.4137 11.4138 13.8975 13.9003 14.0292 14.0316 14.2098 14.2100 k = 0.5000 0.2887-0.0000 ( 3850 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0706 -18.0706 -18.0698 -18.0698 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6493 -8.6493 -8.6474 -8.6474 0.5315 0.5315 0.5534 0.5534 3.3723 3.3723 4.3653 4.3653 4.5069 4.5069 4.8536 4.8536 4.9396 4.9396 5.8613 5.8613 5.9645 5.9645 6.2267 6.2267 8.3492 8.3492 8.6109 8.6109 8.8249 8.8249 8.8845 8.8845 11.2096 11.2096 11.4125 11.4125 13.9033 13.9033 14.0303 14.0303 14.2112 14.2112 k = 0.5000 0.2887-0.0000 ( 3850 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0706 -18.0706 -18.0698 -18.0698 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6493 -8.6493 -8.6474 -8.6474 0.5315 0.5315 0.5534 0.5534 3.3723 3.3723 4.3653 4.3653 4.5069 4.5069 4.8536 4.8536 4.9396 4.9396 5.8613 5.8613 5.9645 5.9645 6.2267 6.2267 8.3492 8.3492 8.6109 8.6109 8.8249 8.8249 8.8845 8.8845 11.2096 11.2096 11.4125 11.4125 13.9033 13.9033 14.0303 14.0303 14.2112 14.2112 k = 0.4949 0.2974-0.0000 ( 3846 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0718 -18.0713 -18.0689 -18.0685 -17.5917 -17.5912 -17.5894 -17.5889 -17.3992 -17.3987 -17.3980 -17.3976 -8.6495 -8.6491 -8.6474 -8.6471 0.5320 0.5320 0.5539 0.5540 3.3733 3.3734 4.3655 4.3661 4.5075 4.5076 4.8533 4.8535 4.9398 4.9400 5.8596 5.8606 5.9634 5.9642 6.2272 6.2283 8.3478 8.3486 8.6029 8.6030 8.8194 8.8206 8.8857 8.8861 11.2150 11.2151 11.4169 11.4172 13.9029 13.9032 14.0293 14.0295 14.2096 14.2099 k = 0.4899 0.3062-0.0000 ( 3846 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0730 -18.0725 -18.0673 -18.0669 -17.5928 -17.5923 -17.5882 -17.5877 -17.4003 -17.3998 -17.3981 -17.3976 -8.6495 -8.6489 -8.6471 -8.6465 0.5336 0.5336 0.5556 0.5557 3.3762 3.3764 4.3665 4.3678 4.5095 4.5097 4.8525 4.8528 4.9407 4.9411 5.8555 5.8573 5.9607 5.9623 6.2299 6.2320 8.3443 8.3458 8.5796 8.5798 8.8043 8.8065 8.8892 8.8899 11.2311 11.2314 11.4302 11.4309 13.9022 13.9028 14.0267 14.0269 14.2052 14.2056 k = 0.4848 0.3149-0.0000 ( 3847 PWs) bands (ev): -38.9353 -38.9353 -38.9348 -38.9348 -18.0740 -18.0736 -18.0656 -18.0652 -17.5939 -17.5934 -17.5869 -17.5865 -17.4018 -17.4014 -17.3986 -17.3981 -8.6493 -8.6486 -8.6465 -8.6458 0.5362 0.5363 0.5584 0.5587 3.3811 3.3814 4.3684 4.3703 4.5130 4.5132 4.8513 4.8517 4.9421 4.9427 5.8491 5.8517 5.9564 5.9588 6.2345 6.2376 8.3383 8.3406 8.5426 8.5426 8.7801 8.7834 8.8944 8.8953 11.2572 11.2577 11.4520 11.4531 13.9011 13.9019 14.0223 14.0225 14.1980 14.1984 k = 0.4798 0.3237-0.0000 ( 3853 PWs) bands (ev): -38.9352 -38.9352 -38.9347 -38.9347 -18.0750 -18.0745 -18.0638 -18.0634 -17.5950 -17.5945 -17.5857 -17.5852 -17.4037 -17.4033 -17.3995 -17.3990 -8.6490 -8.6483 -8.6456 -8.6449 0.5399 0.5400 0.5623 0.5627 3.3880 3.3883 4.3711 4.3735 4.5179 4.5182 4.8495 4.8500 4.9441 4.9450 5.8407 5.8440 5.9506 5.9538 6.2408 6.2447 8.3295 8.3326 8.4935 8.4936 8.7480 8.7524 8.9003 8.9012 11.2926 11.2932 11.4819 11.4832 13.8994 13.9004 14.0160 14.0163 14.1736 14.1750 k = 0.4747 0.3324-0.0000 ( 3857 PWs) bands (ev): -38.9351 -38.9351 -38.9346 -38.9346 -18.0759 -18.0754 -18.0619 -18.0614 -17.5960 -17.5956 -17.5843 -17.5839 -17.4060 -17.4055 -17.4008 -17.4003 -8.6486 -8.6478 -8.6446 -8.6438 0.5446 0.5447 0.5674 0.5678 3.3968 3.3972 4.3744 4.3774 4.5244 4.5247 4.8472 4.8479 4.9468 4.9478 5.8307 5.8346 5.9433 5.9473 6.2485 6.2532 8.3171 8.3209 8.4340 8.4344 8.7096 8.7151 8.9064 8.9072 11.3361 11.3367 11.5190 11.5206 13.8970 13.8982 14.0079 14.0081 14.1439 14.1452 k = 0.4697 0.3412-0.0000 ( 3863 PWs) bands (ev): -38.9350 -38.9350 -38.9345 -38.9345 -18.0766 -18.0761 -18.0598 -18.0594 -17.5971 -17.5966 -17.5829 -17.5825 -17.4086 -17.4081 -17.4025 -17.4020 -8.6480 -8.6471 -8.6434 -8.6425 0.5504 0.5505 0.5735 0.5740 3.4075 3.4080 4.3782 4.3818 4.5326 4.5330 4.8443 4.8452 4.9499 4.9513 5.8194 5.8237 5.9346 5.9394 6.2574 6.2626 8.2999 8.3045 8.3659 8.3666 8.6672 8.6736 8.9123 8.9130 11.3864 11.3870 11.5625 11.5644 13.8939 13.8952 13.9976 13.9978 14.1136 14.1145 k = 0.4646 0.3499-0.0000 ( 3863 PWs) bands (ev): -38.9348 -38.9348 -38.9343 -38.9343 -18.0772 -18.0767 -18.0577 -18.0572 -17.5982 -17.5977 -17.5815 -17.5810 -17.4115 -17.4110 -17.4046 -17.4041 -8.6472 -8.6464 -8.6420 -8.6411 0.5571 0.5572 0.5807 0.5813 3.4201 3.4207 4.3824 4.3866 4.5424 4.5430 4.8409 4.8418 4.9537 4.9553 5.8070 5.8116 5.9245 5.9300 6.2670 6.2727 8.2749 8.2804 8.2923 8.2928 8.6236 8.6307 8.9179 8.9183 11.4424 11.4430 11.6117 11.6138 13.8898 13.8912 13.9845 13.9852 14.0835 14.0840 k = 0.4596 0.3587-0.0000 ( 3861 PWs) bands (ev): -38.9346 -38.9346 -38.9341 -38.9341 -18.0777 -18.0772 -18.0554 -18.0549 -17.5993 -17.5988 -17.5800 -17.5795 -17.4147 -17.4142 -17.4070 -17.4065 -8.6463 -8.6454 -8.6404 -8.6396 0.5648 0.5649 0.5889 0.5896 3.4344 3.4351 4.3870 4.3917 4.5541 4.5547 4.8369 4.8379 4.9580 4.9598 5.7940 5.7988 5.9131 5.9192 6.2770 6.2832 8.2075 8.2096 8.2468 8.2512 8.5819 8.5894 8.9230 8.9232 11.5029 11.5035 11.6657 11.6679 13.8847 13.8861 13.9684 13.9699 14.0548 14.0553 k = 0.4545 0.3674-0.0000 ( 3863 PWs) bands (ev): -38.9344 -38.9344 -38.9339 -38.9339 -18.0781 -18.0776 -18.0530 -18.0526 -17.6004 -17.5999 -17.5784 -17.5779 -17.4181 -17.4176 -17.4098 -17.4092 -8.6453 -8.6444 -8.6387 -8.6379 0.5735 0.5736 0.5981 0.5989 3.4505 3.4513 4.3917 4.3969 4.5675 4.5684 4.8322 4.8334 4.9628 4.9649 5.7805 5.7854 5.9003 5.9071 6.2873 6.2937 8.1219 8.1241 8.2051 8.2094 8.5451 8.5524 8.9275 8.9276 11.5668 11.5674 11.7236 11.7260 13.8784 13.8797 13.9488 13.9515 14.0279 14.0296 k = 0.4495 0.3762-0.0000 ( 3863 PWs) bands (ev): -38.9342 -38.9342 -38.9337 -38.9337 -18.0784 -18.0780 -18.0506 -18.0501 -17.6016 -17.6011 -17.5768 -17.5763 -17.4217 -17.4212 -17.4128 -17.4123 -8.6441 -8.6432 -8.6369 -8.6361 0.5830 0.5831 0.6082 0.6091 3.4683 3.4691 4.3966 4.4022 4.5828 4.5839 4.8268 4.8281 4.9681 4.9704 5.7667 5.7718 5.8863 5.8937 6.2975 6.3041 8.0324 8.0349 8.1532 8.1567 8.5149 8.5216 8.9311 8.9315 11.6333 11.6339 11.7850 11.7875 13.8708 13.8719 13.9257 13.9296 14.0035 14.0064 k = 0.4444 0.3849-0.0000 ( 3859 PWs) bands (ev): -38.9340 -38.9340 -38.9335 -38.9335 -18.0787 -18.0782 -18.0481 -18.0476 -17.6028 -17.6023 -17.5751 -17.5746 -17.4254 -17.4250 -17.4162 -17.4157 -8.6428 -8.6419 -8.6350 -8.6342 0.5935 0.5936 0.6193 0.6202 3.4876 3.4885 4.4015 4.4075 4.5998 4.6011 4.8208 4.8222 4.9738 4.9764 5.7530 5.7580 5.8710 5.8790 6.3074 6.3142 7.9405 7.9432 8.0915 8.0939 8.4915 8.4974 8.9340 8.9346 11.7017 11.7021 11.8491 11.8516 13.8620 13.8627 13.8998 13.9048 13.9814 13.9854 k = 0.4394 0.3936-0.0000 ( 3861 PWs) bands (ev): -38.9337 -38.9337 -38.9332 -38.9332 -18.0788 -18.0784 -18.0455 -18.0451 -17.6041 -17.6036 -17.5733 -17.5729 -17.4293 -17.4289 -17.4199 -17.4193 -8.6414 -8.6404 -8.6330 -8.6322 0.6047 0.6048 0.6311 0.6322 3.5085 3.5094 4.4065 4.4129 4.6185 4.6201 4.8140 4.8155 4.9799 4.9829 5.7393 5.7443 5.8545 5.8630 6.3169 6.3238 7.8470 7.8500 8.0217 8.0229 8.4740 8.4789 8.9360 8.9369 11.7711 11.7715 11.9153 11.9180 13.8518 13.8519 13.8718 13.8781 13.9608 13.9657 k = 0.4343 0.4024-0.0000 ( 3865 PWs) bands (ev): -38.9335 -38.9335 -38.9330 -38.9330 -18.0789 -18.0785 -18.0430 -18.0425 -17.6055 -17.6050 -17.5715 -17.5711 -17.4333 -17.4329 -17.4238 -17.4232 -8.6399 -8.6389 -8.6310 -8.6301 0.6167 0.6168 0.6437 0.6448 3.5307 3.5317 4.4115 4.4182 4.6387 4.6405 4.8066 4.8082 4.9865 4.9897 5.7259 5.7307 5.8368 5.8457 6.3257 6.3327 7.7531 7.7563 7.9456 7.9457 8.4612 8.4653 8.9370 8.9381 11.8412 11.8415 11.9833 11.9860 13.8379 13.8408 13.8423 13.8518 13.9408 13.9463 k = 0.4293 0.4111-0.0000 ( 3865 PWs) bands (ev): -38.9332 -38.9332 -38.9327 -38.9327 -18.0790 -18.0785 -18.0403 -18.0399 -17.6069 -17.6065 -17.5696 -17.5692 -17.4374 -17.4369 -17.4279 -17.4272 -8.6383 -8.6374 -8.6289 -8.6280 0.6294 0.6295 0.6569 0.6581 3.5541 3.5552 4.4166 4.4235 4.6602 4.6624 4.7985 4.8002 4.9935 4.9970 5.7127 5.7174 5.8180 5.8272 6.3337 6.3408 7.6595 7.6630 7.8643 7.8652 8.4521 8.4554 8.9369 8.9383 11.9115 11.9117 12.0527 12.0554 13.8118 13.8144 13.8289 13.8328 13.9208 13.9268 k = 0.4242 0.4199-0.0000 ( 3863 PWs) bands (ev): -38.9329 -38.9329 -38.9324 -38.9324 -18.0790 -18.0785 -18.0377 -18.0372 -17.6085 -17.6080 -17.5677 -17.5673 -17.4415 -17.4410 -17.4321 -17.4315 -8.6366 -8.6357 -8.6267 -8.6259 0.6428 0.6429 0.6708 0.6720 3.5787 3.5799 4.4219 4.4289 4.6827 4.6853 4.7897 4.7915 5.0009 5.0047 5.6999 5.7043 5.7980 5.8075 6.3408 6.3479 7.5673 7.5709 7.7802 7.7821 8.4459 8.4486 8.9356 8.9373 11.9818 11.9818 12.1230 12.1257 13.7804 13.7847 13.8162 13.8187 13.9002 13.9068 k = 0.4192 0.4286-0.0000 ( 3863 PWs) bands (ev): -38.9326 -38.9326 -38.9321 -38.9321 -18.0789 -18.0785 -18.0351 -18.0346 -17.6101 -17.6096 -17.5657 -17.5653 -17.4455 -17.4450 -17.4365 -17.4358 -8.6349 -8.6340 -8.6245 -8.6237 0.6568 0.6569 0.6851 0.6864 3.6042 3.6054 4.4272 4.4344 4.7060 4.7090 4.7804 4.7822 5.0088 5.0129 5.6874 5.6916 5.7768 5.7865 6.3468 6.3539 7.4770 7.4808 7.6948 7.6975 8.4422 8.4444 8.9329 8.9349 12.0517 12.0518 12.1941 12.1968 13.7482 13.7531 13.8031 13.8050 13.8788 13.8859 k = 0.4141 0.4374-0.0000 ( 3863 PWs) bands (ev): -38.9323 -38.9323 -38.9318 -38.9318 -18.0789 -18.0784 -18.0325 -18.0320 -17.6118 -17.6113 -17.5637 -17.5632 -17.4495 -17.4490 -17.4409 -17.4403 -8.6332 -8.6323 -8.6223 -8.6215 0.6713 0.6713 0.6999 0.7012 3.6305 3.6318 4.4326 4.4400 4.7297 4.7330 4.7706 4.7724 5.0172 5.0217 5.6752 5.6792 5.7546 5.7643 6.3518 6.3588 7.3895 7.3934 7.6091 7.6125 8.4408 8.4425 8.9289 8.9310 12.1211 12.1213 12.2657 12.2683 13.7151 13.7205 13.7898 13.7913 13.8565 13.8640 k = 0.4091 0.4461-0.0000 ( 3859 PWs) bands (ev): -38.9321 -38.9321 -38.9316 -38.9316 -18.0788 -18.0783 -18.0300 -18.0295 -17.6136 -17.6131 -17.5616 -17.5612 -17.4535 -17.4530 -17.4453 -17.4447 -8.6315 -8.6306 -8.6202 -8.6194 0.6861 0.6862 0.7149 0.7163 3.6574 3.6587 4.4383 4.4457 4.7530 4.7566 4.7607 4.7626 5.0265 5.0312 5.6632 5.6670 5.7313 5.7409 6.3555 6.3625 7.3055 7.3095 7.5240 7.5281 8.4414 8.4428 8.9233 8.9257 12.1899 12.1902 12.3375 12.3400 13.6812 13.6868 13.7764 13.7778 13.8330 13.8410 k = 0.4040 0.4549-0.0000 ( 3871 PWs) bands (ev): -38.9318 -38.9318 -38.9313 -38.9313 -18.0787 -18.0783 -18.0275 -18.0270 -17.6155 -17.6150 -17.5595 -17.5590 -17.4574 -17.4569 -17.4497 -17.4490 -8.6297 -8.6289 -8.6180 -8.6172 0.7013 0.7013 0.7300 0.7315 3.6845 3.6858 4.4441 4.4516 4.7499 4.7517 4.7763 4.7801 5.0367 5.0416 5.6514 5.6548 5.7070 5.7164 6.3580 6.3649 7.2257 7.2296 7.4404 7.4450 8.4440 8.4452 8.9161 8.9187 12.2581 12.2584 12.4093 12.4117 13.6463 13.6522 13.7631 13.7643 13.8083 13.8168 k = 0.3990 0.4636-0.0000 ( 3871 PWs) bands (ev): -38.9315 -38.9315 -38.9310 -38.9310 -18.0786 -18.0782 -18.0251 -18.0247 -17.6174 -17.6170 -17.5573 -17.5569 -17.4613 -17.4608 -17.4539 -17.4532 -8.6280 -8.6271 -8.6159 -8.6151 0.7167 0.7167 0.7452 0.7467 3.7117 3.7131 4.4502 4.4577 4.7395 4.7413 4.7977 4.8015 5.0485 5.0534 5.6394 5.6426 5.6820 5.6910 6.3593 6.3661 7.1508 7.1546 7.3590 7.3641 8.4485 8.4495 8.9074 8.9102 12.3256 12.3260 12.4811 12.4833 13.6104 13.6166 13.7499 13.7510 13.7826 13.7916 k = 0.3939 0.4724-0.0000 ( 3869 PWs) bands (ev): -38.9312 -38.9312 -38.9307 -38.9307 -18.0786 -18.0781 -18.0229 -18.0224 -17.6194 -17.6189 -17.5551 -17.5547 -17.4653 -17.4648 -17.4578 -17.4571 -8.6263 -8.6255 -8.6139 -8.6131 0.7322 0.7322 0.7604 0.7619 3.7387 3.7401 4.4566 4.4641 4.7293 4.7311 4.8168 4.8204 5.0623 5.0669 5.6270 5.6302 5.6565 5.6647 6.3593 6.3660 7.0813 7.0849 7.2805 7.2861 8.4549 8.4559 8.8970 8.9000 12.3923 12.3927 12.5525 12.5545 13.5737 13.5801 13.7368 13.7379 13.7558 13.7653 k = 0.3889 0.4811-0.0000 ( 3853 PWs) bands (ev): -38.9309 -38.9309 -38.9304 -38.9304 -18.0785 -18.0780 -18.0207 -18.0202 -17.6214 -17.6209 -17.5528 -17.5524 -17.4693 -17.4688 -17.4612 -17.4606 -8.6246 -8.6238 -8.6119 -8.6111 0.7476 0.7477 0.7752 0.7767 3.7651 3.7665 4.4632 4.4706 4.7196 4.7214 4.8326 4.8359 5.0786 5.0828 5.6134 5.6173 5.6314 5.6379 6.3582 6.3647 7.0178 7.0210 7.2056 7.2116 8.4633 8.4642 8.8850 8.8881 12.4583 12.4587 12.6234 12.6252 13.5361 13.5427 13.7236 13.7246 13.7285 13.7386 k = 0.3838 0.4899-0.0000 ( 3855 PWs) bands (ev): -38.9306 -38.9306 -38.9301 -38.9301 -18.0784 -18.0779 -18.0187 -18.0182 -17.6234 -17.6229 -17.5506 -17.5501 -17.4734 -17.4729 -17.4643 -17.4637 -8.6230 -8.6222 -8.6100 -8.6093 0.7629 0.7630 0.7896 0.7912 3.7906 3.7920 4.4701 4.4774 4.7107 4.7124 4.8443 4.8469 5.0979 5.1013 5.5962 5.6034 5.6090 5.6111 6.3561 6.3623 6.9605 6.9634 7.1349 7.1413 8.4736 8.4744 8.8714 8.8746 12.5234 12.5238 12.6936 12.6952 13.4976 13.5044 13.6994 13.7064 13.7124 13.7152 k = 0.3788 0.4986-0.0000 ( 3855 PWs) bands (ev): -38.9304 -38.9304 -38.9299 -38.9299 -18.0784 -18.0779 -18.0168 -18.0164 -17.6254 -17.6249 -17.5483 -17.5479 -17.4775 -17.4770 -17.4670 -17.4664 -8.6215 -8.6208 -8.6083 -8.6075 0.7778 0.7780 0.8034 0.8050 3.8148 3.8162 4.4772 4.4844 4.7030 4.7046 4.8511 4.8529 5.1203 5.1228 5.5734 5.5833 5.5898 5.5918 6.3530 6.3589 6.9099 6.9123 7.0690 7.0757 8.4857 8.4866 8.8562 8.8595 12.5877 12.5880 12.7628 12.7641 13.4583 13.4654 13.6706 13.6799 13.6995 13.7007 k = 0.3737 0.5074-0.0000 ( 3853 PWs) bands (ev): -38.9301 -38.9301 -38.9296 -38.9296 -18.0783 -18.0779 -18.0152 -18.0147 -17.6273 -17.6268 -17.5461 -17.5456 -17.4815 -17.4811 -17.4693 -17.4687 -8.6201 -8.6194 -8.6066 -8.6059 0.7923 0.7926 0.8165 0.8180 3.8373 3.8386 4.4846 4.4915 4.6970 4.6985 4.8529 4.8538 5.1457 5.1471 5.5490 5.5575 5.5737 5.5757 6.3493 6.3548 6.8661 6.8680 7.0085 7.0153 8.4996 8.5006 8.8395 8.8428 12.6510 12.6511 12.8307 12.8317 13.4184 13.4257 13.6416 13.6516 13.6864 13.6879 k = 0.3687 0.5161-0.0000 ( 3849 PWs) bands (ev): -38.9299 -38.9299 -38.9294 -38.9294 -18.0783 -18.0779 -18.0137 -18.0132 -17.6291 -17.6286 -17.5439 -17.5434 -17.4854 -17.4850 -17.4712 -17.4707 -8.6188 -8.6181 -8.6051 -8.6044 0.8061 0.8064 0.8285 0.8300 3.8576 3.8589 4.4921 4.4988 4.6929 4.6943 4.8495 4.8496 5.1738 5.1741 5.5254 5.5327 5.5564 5.5587 6.3451 6.3501 6.8292 6.8305 6.9536 6.9606 8.5153 8.5164 8.8214 8.8247 12.7130 12.7133 12.8969 12.8976 13.3780 13.3855 13.6129 13.6234 13.6727 13.6749 k = 0.3636 0.5249-0.0000 ( 3849 PWs) bands (ev): -38.9297 -38.9297 -38.9292 -38.9292 -18.0784 -18.0779 -18.0124 -18.0119 -17.6307 -17.6302 -17.5417 -17.5413 -17.4891 -17.4887 -17.4728 -17.4723 -8.6176 -8.6169 -8.6037 -8.6031 0.8190 0.8195 0.8394 0.8408 3.8755 3.8767 4.4997 4.5060 4.6911 4.6924 4.8408 4.8414 5.2030 5.2039 5.5032 5.5096 5.5375 5.5404 6.3407 6.3451 6.7990 6.7997 6.9049 6.9118 8.5326 8.5338 8.8019 8.8052 12.7736 12.7742 12.9607 12.9611 13.3372 13.3449 13.5850 13.5960 13.6583 13.6615 k = 0.3586 0.5336-0.0000 ( 3845 PWs) bands (ev): -38.9296 -38.9296 -38.9291 -38.9291 -18.0784 -18.0779 -18.0113 -18.0109 -17.6322 -17.6317 -17.5397 -17.5392 -17.4925 -17.4921 -17.4741 -17.4736 -8.6166 -8.6159 -8.6026 -8.6019 0.8309 0.8315 0.8488 0.8502 3.8907 3.8917 4.5073 4.5131 4.6920 4.6933 4.8280 4.8291 5.2336 5.2355 5.4832 5.4887 5.5169 5.5204 6.3365 6.3402 6.7755 6.7755 6.8625 6.8692 8.5515 8.5529 8.7813 8.7845 12.8325 12.8336 13.0212 13.0212 13.2962 13.3041 13.5590 13.5704 13.6425 13.6471 k = 0.3535 0.5424-0.0000 ( 3851 PWs) bands (ev): -38.9294 -38.9294 -38.9289 -38.9289 -18.0784 -18.0780 -18.0105 -18.0100 -17.6334 -17.6330 -17.5379 -17.5374 -17.4955 -17.4951 -17.4751 -17.4747 -8.6157 -8.6151 -8.6016 -8.6010 0.8414 0.8422 0.8567 0.8579 3.9028 3.9037 4.5146 4.5197 4.6957 4.6969 4.8121 4.8134 5.2653 5.2682 5.4655 5.4703 5.4945 5.4988 6.3327 6.3357 6.7578 6.7585 6.8264 6.8330 8.5718 8.5734 8.7595 8.7626 12.8893 12.8910 13.0762 13.0765 13.2553 13.2636 13.5363 13.5480 13.6251 13.6311 k = 0.3485 0.5511-0.0000 ( 3851 PWs) bands (ev): -38.9293 -38.9293 -38.9288 -38.9288 -18.0785 -18.0780 -18.0099 -18.0094 -17.6344 -17.6340 -17.5363 -17.5358 -17.4980 -17.4976 -17.4759 -17.4755 -8.6150 -8.6144 -8.6008 -8.6002 0.8505 0.8514 0.8627 0.8638 3.9119 3.9126 4.5214 4.5257 4.7024 4.7037 4.7942 4.7952 5.2976 5.3013 5.4503 5.4546 5.4706 5.4757 6.3296 6.3318 6.7462 6.7476 6.7969 6.8031 8.5934 8.5952 8.7367 8.7397 12.9435 12.9460 13.1229 13.1232 13.2160 13.2246 13.5191 13.5310 13.6055 13.6131 k = 0.3434 0.5599-0.0000 ( 3863 PWs) bands (ev): -38.9292 -38.9292 -38.9287 -38.9287 -18.0786 -18.0781 -18.0094 -18.0090 -17.6352 -17.6347 -17.5351 -17.5346 -17.5000 -17.4995 -17.4765 -17.4760 -8.6145 -8.6139 -8.6002 -8.5996 0.8578 0.8590 0.8667 0.8677 3.9181 3.9185 4.5273 4.5304 4.7120 4.7132 4.7753 4.7758 5.3301 5.3345 5.4375 5.4417 5.4454 5.4518 6.3273 6.3288 6.7406 6.7425 6.7736 6.7797 8.6160 8.6181 8.7132 8.7160 12.9945 12.9979 13.1476 13.1494 13.1885 13.1959 13.5109 13.5225 13.5837 13.5927 k = 0.3384 0.5686-0.0000 ( 3869 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0092 -18.0087 -17.6357 -17.6352 -17.5343 -17.5338 -17.5012 -17.5007 -17.4768 -17.4763 -8.6142 -8.6136 -8.5999 -8.5993 0.8630 0.8645 0.8686 0.8693 3.9215 3.9217 4.5317 4.5335 4.7243 4.7254 4.7565 4.7571 5.3622 5.3667 5.4194 5.4229 5.4319 5.4322 6.3261 6.3268 6.7405 6.7425 6.7567 6.7629 8.6397 8.6421 8.6890 8.6916 13.0413 13.0456 13.1220 13.1288 13.1979 13.2001 13.5155 13.5259 13.5601 13.5704 k = 0.3333 0.5774-0.0000 ( 3861 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6140 -8.6135 -8.5997 -8.5992 0.8651 0.8673 0.8688 0.8691 3.9226 3.9226 4.5340 4.5340 4.7371 4.7374 4.7404 4.7437 5.3889 5.3892 5.3963 5.4060 5.4264 5.4264 6.3260 6.3260 6.7446 6.7447 6.7470 6.7553 8.6618 8.6667 8.6668 8.6669 13.0810 13.0811 13.0851 13.0987 13.2052 13.2052 13.5320 13.5377 13.5378 13.5520 k = 0.3333 0.5774-0.0000 ( 3861 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6140 -8.6135 -8.5997 -8.5992 0.8651 0.8673 0.8688 0.8691 3.9226 3.9226 4.5340 4.5340 4.7371 4.7374 4.7404 4.7437 5.3889 5.3892 5.3963 5.4060 5.4264 5.4264 6.3260 6.3260 6.7446 6.7447 6.7470 6.7553 8.6618 8.6667 8.6668 8.6669 13.0810 13.0811 13.0851 13.0987 13.2052 13.2052 13.5320 13.5377 13.5378 13.5520 k = 0.3282 0.5685-0.0000 ( 3869 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0092 -18.0087 -17.6357 -17.6352 -17.5343 -17.5338 -17.5012 -17.5007 -17.4768 -17.4763 -8.6142 -8.6136 -8.5999 -8.5993 0.8627 0.8643 0.8686 0.8693 3.9217 3.9219 4.5313 4.5333 4.7240 4.7272 4.7554 4.7573 5.3659 5.3697 5.4098 5.4110 5.4366 5.4426 6.3261 6.3267 6.7408 6.7430 6.7562 6.7626 8.6388 8.6413 8.6898 8.6925 13.0422 13.0486 13.1193 13.1285 13.1982 13.1999 13.5084 13.5180 13.5673 13.5766 k = 0.3231 0.5596-0.0000 ( 3863 PWs) bands (ev): -38.9292 -38.9292 -38.9287 -38.9287 -18.0785 -18.0781 -18.0094 -18.0089 -17.6352 -17.6347 -17.5350 -17.5345 -17.5000 -17.4996 -17.4765 -17.4760 -8.6145 -8.6139 -8.6003 -8.5997 0.8566 0.8577 0.8664 0.8676 3.9194 3.9199 4.5252 4.5292 4.7138 4.7190 4.7727 4.7748 5.3405 5.3450 5.4101 5.4103 5.4650 5.4727 6.3274 6.3285 6.7420 6.7443 6.7712 6.7777 8.6135 8.6156 8.7155 8.7186 13.0015 13.0086 13.1479 13.1581 13.1816 13.1848 13.4821 13.4921 13.6079 13.6155 k = 0.3179 0.5507-0.0000 ( 3861 PWs) bands (ev): -38.9293 -38.9293 -38.9288 -38.9288 -18.0784 -18.0779 -18.0097 -18.0092 -17.6344 -17.6339 -17.5360 -17.5355 -17.4983 -17.4979 -17.4760 -17.4756 -8.6151 -8.6145 -8.6009 -8.6003 0.8471 0.8480 0.8615 0.8630 3.9165 3.9171 4.5159 4.5216 4.7086 4.7153 4.7901 4.7924 5.3171 5.3217 5.4100 5.4102 5.4956 5.5039 6.3295 6.3310 6.7491 6.7511 6.7906 6.7975 8.5884 8.5901 8.7415 8.7449 12.9612 12.9685 13.1586 13.1626 13.1689 13.1800 13.4563 13.4661 13.6529 13.6594 k = 0.3128 0.5418-0.0000 ( 3857 PWs) bands (ev): -38.9295 -38.9295 -38.9290 -38.9290 -18.0782 -18.0777 -18.0101 -18.0096 -17.6333 -17.6328 -17.5371 -17.5367 -17.4961 -17.4956 -17.4754 -17.4749 -8.6160 -8.6153 -8.6019 -8.6012 0.8344 0.8350 0.8534 0.8552 3.9135 3.9143 4.5045 4.5115 4.7080 4.7158 4.8064 4.8091 5.2968 5.3012 5.4117 5.4117 5.5260 5.5347 6.3324 6.3341 6.7619 6.7636 6.8141 6.8214 8.5635 8.5650 8.7673 8.7711 12.9215 12.9290 13.1323 13.1374 13.1806 13.1926 13.4314 13.4407 13.6993 13.7052 k = 0.3077 0.5329-0.0000 ( 3853 PWs) bands (ev): -38.9297 -38.9297 -38.9292 -38.9292 -18.0778 -18.0774 -18.0105 -18.0100 -17.6319 -17.6314 -17.5384 -17.5379 -17.4935 -17.4930 -17.4746 -17.4741 -8.6171 -8.6164 -8.6031 -8.6024 0.8183 0.8188 0.8421 0.8442 3.9110 3.9120 4.4921 4.5000 4.7110 4.7197 4.8206 4.8238 5.2806 5.2846 5.4153 5.4156 5.5557 5.5648 6.3360 6.3377 6.7803 6.7816 6.8411 6.8490 8.5393 8.5404 8.7930 8.7970 12.8825 12.8902 13.1041 13.1097 13.1845 13.1965 13.4080 13.4162 13.7453 13.7509 k = 0.3026 0.5241-0.0000 ( 3863 PWs) bands (ev): -38.9299 -38.9299 -38.9294 -38.9294 -18.0774 -18.0770 -18.0110 -18.0105 -17.6303 -17.6298 -17.5396 -17.5391 -17.4907 -17.4902 -17.4737 -17.4732 -8.6185 -8.6178 -8.6046 -8.6039 0.7990 0.7992 0.8272 0.8296 3.9096 3.9106 4.4798 4.4883 4.7169 4.7259 4.8317 4.8354 5.2696 5.2731 5.4211 5.4217 5.5845 5.5939 6.3401 6.3419 6.8039 6.8049 6.8715 6.8799 8.5158 8.5166 8.8180 8.8224 12.8444 12.8522 13.0747 13.0808 13.1811 13.1925 13.3862 13.3930 13.7897 13.7951 k = 0.2974 0.5152-0.0000 ( 3863 PWs) bands (ev): -38.9302 -38.9302 -38.9297 -38.9297 -18.0769 -18.0764 -18.0114 -18.0109 -17.6284 -17.6279 -17.5408 -17.5403 -17.4876 -17.4871 -17.4726 -17.4721 -8.6202 -8.6194 -8.6064 -8.6057 0.7763 0.7763 0.8088 0.8115 3.9096 3.9107 4.4685 4.4773 4.7247 4.7340 4.8387 4.8430 5.2648 5.2675 5.4292 5.4301 5.6125 5.6220 6.3448 6.3465 6.8326 6.8335 6.9049 6.9137 8.4935 8.4938 8.8423 8.8470 12.8073 12.8151 13.0451 13.0515 13.1715 13.1817 13.3659 13.3710 13.8313 13.8369 k = 0.2923 0.5063-0.0000 ( 3859 PWs) bands (ev): -38.9305 -38.9305 -38.9300 -38.9300 -18.0762 -18.0757 -18.0117 -18.0113 -17.6263 -17.6258 -17.5418 -17.5413 -17.4844 -17.4838 -17.4714 -17.4709 -8.6222 -8.6213 -8.6085 -8.6077 0.7501 0.7502 0.7867 0.7897 3.9114 3.9125 4.4585 4.4674 4.7341 4.7435 4.8413 4.8461 5.2664 5.2684 5.4396 5.4408 5.6396 5.6492 6.3502 6.3517 6.8661 6.8668 6.9410 6.9501 8.4724 8.4724 8.8656 8.8707 12.7713 12.7791 13.0156 13.0222 13.1571 13.1657 13.3468 13.3502 13.8696 13.8754 k = 0.2872 0.4974-0.0000 ( 3865 PWs) bands (ev): -38.9309 -38.9309 -38.9304 -38.9304 -18.0753 -18.0749 -18.0120 -18.0115 -17.6240 -17.6235 -17.5427 -17.5422 -17.4810 -17.4804 -17.4700 -17.4695 -8.6245 -8.6235 -8.6109 -8.6101 0.7206 0.7210 0.7610 0.7643 3.9154 3.9164 4.4500 4.4590 4.7447 4.7541 4.8395 4.8448 5.2744 5.2757 5.4524 5.4540 5.6659 5.6755 6.3563 6.3576 6.9041 6.9046 6.9794 6.9889 8.4525 8.4529 8.8877 8.8932 12.7364 12.7443 12.9867 12.9934 13.1389 13.1460 13.3285 13.3302 13.9036 13.9099 k = 0.2821 0.4885-0.0000 ( 3869 PWs) bands (ev): -38.9314 -38.9314 -38.9309 -38.9309 -18.0743 -18.0738 -18.0121 -18.0117 -17.6216 -17.6211 -17.5434 -17.5429 -17.4776 -17.4770 -17.4685 -17.4680 -8.6270 -8.6261 -8.6136 -8.6128 0.6881 0.6887 0.7317 0.7352 3.9216 3.9225 4.4430 4.4520 4.7564 4.7657 4.8342 4.8398 5.2882 5.2889 5.4676 5.4696 5.6915 5.7010 6.3631 6.3641 6.9463 6.9466 7.0198 7.0295 8.4344 8.4352 8.9084 8.9142 12.7027 12.7107 12.9585 12.9653 13.1181 13.1237 13.3107 13.3109 13.9328 13.9397 k = 0.2769 0.4796-0.0000 ( 3883 PWs) bands (ev): -38.9319 -38.9319 -38.9314 -38.9314 -18.0731 -18.0727 -18.0121 -18.0116 -17.6191 -17.6186 -17.5439 -17.5434 -17.4741 -17.4734 -17.4669 -17.4663 -8.6299 -8.6289 -8.6166 -8.6158 0.6526 0.6534 0.6987 0.7026 3.9301 3.9309 4.4372 4.4461 4.7692 4.7785 4.8262 4.8319 5.3067 5.3069 5.4852 5.4875 5.7166 5.7259 6.3708 6.3715 6.9923 6.9925 7.0619 7.0718 8.4184 8.4195 8.9274 8.9335 12.6704 12.6784 12.9313 12.9383 13.0955 13.0998 13.2920 13.2930 13.9563 13.9641 k = 0.2718 0.4708-0.0000 ( 3887 PWs) bands (ev): -38.9325 -38.9325 -38.9320 -38.9320 -18.0717 -18.0713 -18.0119 -18.0114 -17.6164 -17.6160 -17.5442 -17.5437 -17.4706 -17.4699 -17.4650 -17.4643 -8.6330 -8.6321 -8.6198 -8.6191 0.6143 0.6153 0.6624 0.6666 3.9410 3.9416 4.4322 4.4410 4.7834 4.7925 4.8167 4.8223 5.3289 5.3291 5.5050 5.5077 5.7413 5.7503 6.3795 6.3799 7.0419 7.0420 7.1054 7.1155 8.4046 8.4062 8.9445 8.9511 12.6395 12.6474 12.9053 12.9124 13.0718 13.0749 13.2734 13.2754 13.9740 13.9826 k = 0.2667 0.4619-0.0000 ( 3887 PWs) bands (ev): -38.9331 -38.9331 -38.9326 -38.9326 -18.0702 -18.0697 -18.0115 -18.0110 -17.6138 -17.6133 -17.5442 -17.5437 -17.4673 -17.4666 -17.4627 -17.4620 -8.6364 -8.6355 -8.6234 -8.6227 0.5735 0.5747 0.6227 0.6272 3.9541 3.9545 4.4276 4.4361 4.7991 4.8066 4.8081 4.8120 5.3539 5.3545 5.5269 5.5300 5.7661 5.7747 6.3893 6.3894 7.0948 7.0948 7.1502 7.1603 8.3934 8.3953 8.9597 8.9666 12.6100 12.6180 12.8808 12.8878 13.0476 13.0497 13.2550 13.2577 13.9854 13.9951 k = 0.2615 0.4530-0.0000 ( 3879 PWs) bands (ev): -38.9337 -38.9337 -38.9332 -38.9332 -18.0684 -18.0679 -18.0108 -18.0103 -17.6110 -17.6106 -17.5440 -17.5435 -17.4642 -17.4635 -17.4599 -17.4592 -8.6401 -8.6393 -8.6272 -8.6266 0.5303 0.5318 0.5799 0.5847 3.9693 3.9693 4.4228 4.4310 4.7966 4.8018 4.8168 4.8254 5.3811 5.3819 5.5505 5.5540 5.7913 5.7994 6.4001 6.4003 7.1506 7.1507 7.1959 7.2060 8.3850 8.3872 8.9726 8.9798 12.5820 12.5900 12.8578 12.8648 13.0232 13.0245 13.2365 13.2399 13.9906 14.0014 k = 0.2564 0.4441-0.0000 ( 3879 PWs) bands (ev): -38.9344 -38.9344 -38.9340 -38.9339 -18.0664 -18.0659 -18.0098 -18.0094 -17.6084 -17.6079 -17.5435 -17.5431 -17.4614 -17.4609 -17.4565 -17.4560 -8.6441 -8.6434 -8.6314 -8.6308 0.4851 0.4867 0.5342 0.5393 3.9859 3.9863 4.4174 4.4252 4.7877 4.7924 4.8364 4.8446 5.4099 5.4109 5.5753 5.5793 5.8175 5.8249 6.4122 6.4127 7.2091 7.2093 7.2422 7.2523 8.3796 8.3821 8.9831 8.9907 12.5557 12.5637 12.8364 12.8434 12.9990 12.9996 13.2182 13.2220 13.9900 14.0017 k = 0.2513 0.4352-0.0000 ( 3887 PWs) bands (ev): -38.9352 -38.9352 -38.9347 -38.9347 -18.0642 -18.0637 -18.0087 -18.0082 -17.6057 -17.6053 -17.5428 -17.5424 -17.4589 -17.4584 -17.4528 -17.4523 -8.6484 -8.6478 -8.6358 -8.6352 0.4380 0.4398 0.4859 0.4913 4.0040 4.0048 4.4108 4.4181 4.7805 4.7846 4.8582 4.8660 5.4396 5.4408 5.6008 5.6054 5.8453 5.8519 6.4259 6.4267 7.2700 7.2704 7.2891 7.2990 8.3773 8.3800 8.9912 8.9990 12.5311 12.5390 12.8167 12.8237 12.9751 12.9752 13.1998 13.2039 13.9839 13.9966 k = 0.2462 0.4264-0.0000 ( 3883 PWs) bands (ev): -38.9360 -38.9360 -38.9355 -38.9355 -18.0618 -18.0613 -18.0072 -18.0067 -17.6031 -17.6027 -17.5418 -17.5414 -17.4564 -17.4559 -17.4489 -17.4484 -8.6531 -8.6525 -8.6406 -8.6400 0.3892 0.3913 0.4351 0.4407 4.0232 4.0244 4.4026 4.4094 4.7753 4.7788 4.8822 4.8897 5.4700 5.4713 5.6263 5.6314 5.8754 5.8813 6.4413 6.4423 7.3331 7.3337 7.3363 7.3461 8.3784 8.3813 8.9966 9.0047 12.5082 12.5161 12.7988 12.8058 12.9514 12.9518 13.1814 13.1859 13.9732 13.9867 k = 0.2410 0.4175-0.0000 ( 3885 PWs) bands (ev): -38.9369 -38.9369 -38.9364 -38.9364 -18.0592 -18.0588 -18.0054 -18.0050 -17.6006 -17.6002 -17.5405 -17.5401 -17.4539 -17.4534 -17.4449 -17.4444 -8.6581 -8.6575 -8.6457 -8.6449 0.3391 0.3413 0.3822 0.3880 4.0430 4.0448 4.3927 4.3989 4.7727 4.7755 4.9085 4.9155 5.5006 5.5020 5.6511 5.6568 5.9087 5.9137 6.4586 6.4599 7.3836 7.3923 7.3989 7.3990 8.3829 8.3859 8.9992 9.0077 12.4871 12.4951 12.7828 12.7898 12.9284 12.9291 13.1632 13.1677 13.9586 13.9729 k = 0.2359 0.4086-0.0000 ( 3885 PWs) bands (ev): -38.9378 -38.9378 -38.9374 -38.9373 -18.0564 -18.0560 -18.0034 -18.0029 -17.5982 -17.5978 -17.5390 -17.5385 -17.4513 -17.4508 -17.4408 -17.4403 -8.6635 -8.6627 -8.6512 -8.6501 0.2878 0.2902 0.3273 0.3334 4.0633 4.0657 4.3808 4.3864 4.7729 4.7749 4.9368 4.9434 5.5311 5.5326 5.6746 5.6808 5.9458 5.9500 6.4780 6.4797 7.4310 7.4397 7.4655 7.4658 8.3909 8.3939 8.9991 9.0078 12.4679 12.4759 12.7686 12.7756 12.9062 12.9073 13.1450 13.1497 13.9410 13.9560 k = 0.2308 0.3997-0.0000 ( 3885 PWs) bands (ev): -38.9388 -38.9388 -38.9383 -38.9383 -18.0535 -18.0530 -18.0011 -18.0006 -17.5959 -17.5954 -17.5371 -17.5367 -17.4486 -17.4481 -17.4367 -17.4362 -8.6693 -8.6681 -8.6570 -8.6555 0.2357 0.2382 0.2707 0.2771 4.0835 4.0865 4.3667 4.3717 4.7762 4.7773 4.9669 4.9731 5.5614 5.5629 5.6963 5.7029 5.9874 5.9907 6.4998 6.5017 7.4785 7.4867 7.5337 7.5342 8.4023 8.4054 8.9961 9.0051 12.4506 12.4586 12.7564 12.7633 12.8850 12.8864 13.1270 13.1317 13.9212 13.9368 k = 0.2256 0.3908-0.0000 ( 3889 PWs) bands (ev): -38.9398 -38.9398 -38.9393 -38.9393 -18.0504 -18.0499 -17.9985 -17.9981 -17.5937 -17.5931 -17.5350 -17.5346 -17.4458 -17.4453 -17.4325 -17.4320 -8.6755 -8.6738 -8.6631 -8.6611 0.1828 0.1855 0.2128 0.2193 4.1033 4.1070 4.3506 4.3550 4.7827 4.7830 4.9985 5.0044 5.5910 5.5926 5.7161 5.7229 6.0337 6.0362 6.5242 6.5263 7.5259 7.5336 7.6032 7.6037 8.4173 8.4203 8.9903 8.9995 12.4354 12.4433 12.7460 12.7528 12.8648 12.8663 13.1093 13.1140 13.8999 13.9159 k = 0.2205 0.3819-0.0000 ( 3881 PWs) bands (ev): -38.9409 -38.9409 -38.9404 -38.9404 -18.0471 -18.0466 -17.9957 -17.9952 -17.5915 -17.5909 -17.5326 -17.5322 -17.4428 -17.4423 -17.4282 -17.4277 -8.6819 -8.6797 -8.6695 -8.6670 0.1295 0.1323 0.1537 0.1604 4.1225 4.1269 4.3324 4.3362 4.7919 4.7925 5.0313 5.0368 5.6200 5.6216 5.7339 5.7409 6.0847 6.0867 6.5515 6.5538 7.5734 7.5804 7.6737 7.6742 8.4357 8.4385 8.9818 8.9910 12.4221 12.4301 12.7374 12.7442 12.8455 12.8472 13.0918 13.0965 13.8775 13.8940 k = 0.2154 0.3731-0.0000 ( 3873 PWs) bands (ev): -38.9420 -38.9420 -38.9415 -38.9415 -18.0437 -18.0432 -17.9926 -17.9921 -17.5893 -17.5887 -17.5300 -17.5295 -17.4398 -17.4392 -17.4240 -17.4235 -8.6887 -8.6859 -8.6762 -8.6730 0.0759 0.0788 0.0936 0.1005 4.1409 4.1459 4.3122 4.3155 4.8040 4.8055 5.0649 5.0701 5.6479 5.6496 5.7499 5.7569 6.1405 6.1420 6.5818 6.5843 7.6209 7.6273 7.7450 7.7454 8.4573 8.4599 8.9705 8.9798 12.4109 12.4190 12.7307 12.7374 12.8273 12.8291 13.0748 13.0794 13.8546 13.8715 k = 0.2103 0.3642-0.0000 ( 3869 PWs) bands (ev): -38.9432 -38.9432 -38.9427 -38.9427 -18.0401 -18.0396 -17.9893 -17.9888 -17.5872 -17.5865 -17.5272 -17.5267 -17.4366 -17.4361 -17.4197 -17.4192 -8.6958 -8.6923 -8.6832 -8.6793 0.0222 0.0251 0.0330 0.0398 4.1584 4.1641 4.2901 4.2929 4.8192 4.8215 5.0989 5.1038 5.6748 5.6764 5.7645 5.7714 6.2007 6.2019 6.6155 6.6182 7.6686 7.6743 7.8166 7.8170 8.4820 8.4844 8.9565 8.9660 12.4018 12.4099 12.7258 12.7324 12.8100 12.8119 13.0583 13.0627 13.8314 13.8487 k = 0.2051 0.3553-0.0000 ( 3861 PWs) bands (ev): -38.9444 -38.9444 -38.9439 -38.9439 -18.0364 -18.0359 -17.9858 -17.9853 -17.5850 -17.5843 -17.5242 -17.5236 -17.4333 -17.4327 -17.4154 -17.4149 -8.7032 -8.6990 -8.6905 -8.6858 -0.0314 -0.0295 -0.0272 -0.0213 4.1750 4.1813 4.2662 4.2685 4.8372 4.8404 5.1329 5.1376 5.7004 5.7020 5.7779 5.7846 6.2653 6.2662 6.6527 6.6556 7.7166 7.7216 7.8884 7.8886 8.5094 8.5116 8.9402 8.9496 12.3948 12.4029 12.7225 12.7291 12.7937 12.7957 13.0423 13.0467 13.8081 13.8258 k = 0.2000 0.3464-0.0000 ( 3865 PWs) bands (ev): -38.9456 -38.9456 -38.9451 -38.9451 -18.0327 -18.0321 -17.9821 -17.9816 -17.5829 -17.5820 -17.5210 -17.5204 -17.4298 -17.4293 -17.4111 -17.4106 -8.7109 -8.7059 -8.6980 -8.6925 -0.0903 -0.0848 -0.0828 -0.0813 4.1906 4.1975 4.2406 4.2426 4.8577 4.8616 5.1668 5.1713 5.7246 5.7261 5.7903 5.7968 6.3340 6.3346 6.6937 6.6966 7.7651 7.7693 7.9600 7.9600 8.5394 8.5412 8.9216 8.9310 12.3898 12.3980 12.7209 12.7275 12.7782 12.7803 13.0271 13.0313 13.7850 13.8030 k = 0.1949 0.3375-0.0000 ( 3863 PWs) bands (ev): -38.9469 -38.9469 -38.9464 -38.9464 -18.0289 -18.0283 -17.9783 -17.9778 -17.5806 -17.5797 -17.5177 -17.5170 -17.4263 -17.4257 -17.4068 -17.4063 -8.7188 -8.7130 -8.7057 -8.6995 -0.1519 -0.1444 -0.1378 -0.1343 4.2043 4.2109 4.2155 4.2163 4.8803 4.8849 5.2001 5.2045 5.7473 5.7488 5.8021 5.8083 6.4064 6.4069 6.7386 6.7416 7.8141 7.8176 8.0307 8.0309 8.5717 8.5731 8.9013 8.9104 12.3869 12.3952 12.7209 12.7274 12.7636 12.7657 13.0126 13.0167 13.7620 13.7803 k = 0.1897 0.3286-0.0000 ( 3873 PWs) bands (ev): -38.9482 -38.9482 -38.9477 -38.9477 -18.0250 -18.0244 -17.9745 -17.9739 -17.5782 -17.5772 -17.5142 -17.5135 -17.4226 -17.4220 -17.4025 -17.4020 -8.7270 -8.7204 -8.7136 -8.7066 -0.2135 -0.2060 -0.1903 -0.1868 4.1846 4.1853 4.2208 4.2281 4.9046 4.9098 5.2327 5.2369 5.7685 5.7699 5.8135 5.8194 6.4825 6.4828 6.7874 6.7905 7.8640 7.8667 8.1001 8.1007 8.6059 8.6070 8.8796 8.8884 12.3860 12.3943 12.7223 12.7288 12.7498 12.7518 12.9991 13.0029 13.7392 13.7577 k = 0.1846 0.3198-0.0000 ( 3869 PWs) bands (ev): -38.9495 -38.9495 -38.9490 -38.9490 -18.0211 -18.0204 -17.9705 -17.9699 -17.5757 -17.5746 -17.5106 -17.5099 -17.4187 -17.4182 -17.3982 -17.3977 -8.7354 -8.7280 -8.7218 -8.7138 -0.2749 -0.2673 -0.2421 -0.2386 4.1548 4.1554 4.2346 4.2425 4.9301 4.9359 5.2645 5.2686 5.7882 5.7895 5.8246 5.8301 6.5620 6.5623 6.8404 6.8435 7.9147 7.9167 8.1675 8.1686 8.6417 8.6425 8.8575 8.8657 12.3869 12.3954 12.7250 12.7316 12.7367 12.7386 12.9865 12.9902 13.7166 13.7353 k = 0.1795 0.3109-0.0000 ( 3869 PWs) bands (ev): -38.9508 -38.9508 -38.9503 -38.9503 -18.0172 -18.0164 -17.9665 -17.9659 -17.5730 -17.5718 -17.5070 -17.5061 -17.4148 -17.4142 -17.3939 -17.3934 -8.7441 -8.7359 -8.7300 -8.7213 -0.3359 -0.3283 -0.2932 -0.2897 4.1238 4.1241 4.2484 4.2567 4.9564 4.9627 5.2952 5.2992 5.8064 5.8076 5.8355 5.8406 6.6447 6.6449 6.8974 6.9006 7.9665 7.9678 8.2317 8.2335 8.6790 8.6794 8.8359 8.8434 12.3897 12.3984 12.7239 12.7261 12.7294 12.7357 12.9750 12.9785 13.6941 13.7130 k = 0.1744 0.3020-0.0000 ( 3867 PWs) bands (ev): -38.9522 -38.9522 -38.9517 -38.9517 -18.0132 -18.0123 -17.9626 -17.9619 -17.5701 -17.5688 -17.5032 -17.5023 -17.4106 -17.4101 -17.3896 -17.3891 -8.7530 -8.7440 -8.7384 -8.7289 -0.3964 -0.3888 -0.3435 -0.3399 4.0917 4.0918 4.2621 4.2707 4.9832 4.9900 5.3248 5.3288 5.8231 5.8242 5.8463 5.8510 6.7303 6.7306 6.9584 6.9616 8.0194 8.0202 8.2910 8.2938 8.7173 8.7174 8.8167 8.8231 12.3943 12.4031 12.7121 12.7140 12.7345 12.7409 12.9646 12.9679 13.6716 13.6906 k = 0.1692 0.2931-0.0000 ( 3869 PWs) bands (ev): -38.9536 -38.9536 -38.9531 -38.9531 -18.0093 -18.0083 -17.9587 -17.9580 -17.5670 -17.5657 -17.4994 -17.4984 -17.4064 -17.4059 -17.3853 -17.3847 -8.7620 -8.7524 -8.7467 -8.7367 -0.4562 -0.4486 -0.3928 -0.3892 4.0585 4.0588 4.2760 4.2849 5.0102 5.0174 5.3533 5.3572 5.8383 5.8393 5.8570 5.8613 6.8187 6.8190 7.0234 7.0265 8.0735 8.0737 8.3426 8.3468 8.7563 8.7565 8.8026 8.8076 12.4005 12.4094 12.7005 12.7025 12.7407 12.7472 12.9554 12.9585 13.6492 13.6683 k = 0.1641 0.2842-0.0000 ( 3873 PWs) bands (ev): -38.9550 -38.9550 -38.9545 -38.9545 -18.0054 -18.0043 -17.9549 -17.9541 -17.5637 -17.5623 -17.4956 -17.4944 -17.4020 -17.4015 -17.3809 -17.3804 -8.7712 -8.7611 -8.7552 -8.7445 -0.5152 -0.5077 -0.4411 -0.4374 4.0245 4.0250 4.2901 4.2992 5.0371 5.0447 5.3808 5.3847 5.8522 5.8531 5.8675 5.8715 6.9096 6.9101 7.0921 7.0952 8.1287 8.1290 8.3828 8.3888 8.7954 8.7963 8.7979 8.8007 12.4081 12.4172 12.6894 12.6913 12.7477 12.7542 12.9473 12.9502 13.6268 13.6458 k = 0.1590 0.2754-0.0000 ( 3877 PWs) bands (ev): -38.9564 -38.9564 -38.9559 -38.9559 -18.0016 -18.0004 -17.9513 -17.9503 -17.5602 -17.5586 -17.4918 -17.4905 -17.3975 -17.3970 -17.3766 -17.3761 -8.7805 -8.7701 -8.7635 -8.7525 -0.5734 -0.5659 -0.4883 -0.4846 3.9899 3.9906 4.3044 4.3137 5.0637 5.0716 5.4073 5.4111 5.8648 5.8657 5.8778 5.8815 7.0028 7.0034 7.1642 7.1672 8.1849 8.1856 8.4074 8.4155 8.8057 8.8066 8.8358 8.8366 12.4171 12.4263 12.6787 12.6806 12.7554 12.7619 12.9403 12.9431 13.6044 13.6233 k = 0.1538 0.2665-0.0000 ( 3869 PWs) bands (ev): -38.9578 -38.9578 -38.9573 -38.9573 -17.9978 -17.9965 -17.9477 -17.9467 -17.5564 -17.5548 -17.4879 -17.4865 -17.3929 -17.3923 -17.3722 -17.3717 -8.7899 -8.7792 -8.7719 -8.7606 -0.6305 -0.6230 -0.5343 -0.5307 3.9548 3.9557 4.3191 4.3285 5.0899 5.0982 5.4328 5.4367 5.8763 5.8772 5.8879 5.8913 7.0980 7.0988 7.2395 7.2424 8.2425 8.2436 8.4147 8.4244 8.8284 8.8293 8.8760 8.8771 12.4272 12.4366 12.6683 12.6702 12.7634 12.7700 12.9345 12.9372 13.5819 13.6007 k = 0.1487 0.2576-0.0000 ( 3877 PWs) bands (ev): -38.9592 -38.9592 -38.9587 -38.9587 -17.9941 -17.9928 -17.9444 -17.9433 -17.5524 -17.5507 -17.4840 -17.4826 -17.3881 -17.3876 -17.3679 -17.3674 -8.7995 -8.7886 -8.7803 -8.7688 -0.6865 -0.6791 -0.5791 -0.5755 3.9193 3.9204 4.3341 4.3436 5.1157 5.1242 5.4576 5.4614 5.8867 5.8877 5.8975 5.9008 7.1949 7.1960 7.3174 7.3202 8.3015 8.3028 8.4062 8.4170 8.8646 8.8667 8.9163 8.9177 12.4384 12.4478 12.6582 12.6602 12.7717 12.7783 12.9297 12.9322 13.5594 13.5779 k = 0.1436 0.2487-0.0000 ( 3869 PWs) bands (ev): -38.9607 -38.9607 -38.9602 -38.9602 -17.9905 -17.9890 -17.9412 -17.9400 -17.5481 -17.5464 -17.4801 -17.4787 -17.3831 -17.3826 -17.3635 -17.3630 -8.8090 -8.7980 -8.7886 -8.7770 -0.7412 -0.7339 -0.6226 -0.6190 3.8837 3.8849 4.3493 4.3590 5.1411 5.1498 5.4816 5.4855 5.8961 5.8972 5.9068 5.9099 7.2933 7.2947 7.3974 7.4000 8.3616 8.3630 8.3866 8.3976 8.9115 8.9142 8.9567 8.9583 12.4503 12.4599 12.6485 12.6505 12.7798 12.7864 12.9258 12.9283 13.5368 13.5549 k = 0.1385 0.2398-0.0000 ( 3857 PWs) bands (ev): -38.9621 -38.9621 -38.9616 -38.9616 -17.9869 -17.9854 -17.9383 -17.9370 -17.5435 -17.5418 -17.4763 -17.4748 -17.3780 -17.3775 -17.3591 -17.3586 -8.8186 -8.8076 -8.7969 -8.7852 -0.7947 -0.7875 -0.6648 -0.6613 3.8479 3.8492 4.3649 4.3746 5.1661 5.1751 5.5051 5.5089 5.9046 5.9057 5.9156 5.9186 7.3928 7.3945 7.4786 7.4809 8.3596 8.3707 8.4230 8.4247 8.9652 8.9681 8.9970 8.9988 12.4629 12.4725 12.6391 12.6412 12.7875 12.7941 12.9228 12.9252 13.5141 13.5318 k = 0.1333 0.2309-0.0000 ( 3849 PWs) bands (ev): -38.9635 -38.9635 -38.9630 -38.9630 -17.9835 -17.9819 -17.9356 -17.9341 -17.5388 -17.5370 -17.4726 -17.4710 -17.3728 -17.3723 -17.3546 -17.3541 -8.8283 -8.8172 -8.8051 -8.7935 -0.8469 -0.8398 -0.7056 -0.7021 3.8122 3.8136 4.3806 4.3904 5.1909 5.2001 5.5280 5.5319 5.9121 5.9133 5.9240 5.9268 7.4931 7.4952 7.5595 7.5615 8.3297 8.3405 8.4854 8.4871 9.0227 9.0254 9.0374 9.0392 12.4759 12.4856 12.6301 12.6323 12.7946 12.8011 12.9204 12.9229 13.4912 13.5083 k = 0.1282 0.2221-0.0000 ( 3849 PWs) bands (ev): -38.9649 -38.9649 -38.9644 -38.9644 -17.9803 -17.9785 -17.9332 -17.9316 -17.5340 -17.5321 -17.4690 -17.4673 -17.3675 -17.3670 -17.3502 -17.3497 -8.8379 -8.8269 -8.8134 -8.8018 -0.8976 -0.8906 -0.7450 -0.7416 3.7766 3.7781 4.3964 4.4063 5.2156 5.2249 5.5506 5.5544 5.9188 5.9199 5.9319 5.9345 7.5938 7.5964 7.6379 7.6394 8.3007 8.3107 8.5487 8.5503 9.0762 9.0789 9.0826 9.0860 12.4891 12.4989 12.6214 12.6238 12.8006 12.8071 12.9187 12.9211 13.4679 13.4844 k = 0.1231 0.2132-0.0000 ( 3841 PWs) bands (ev): -38.9663 -38.9663 -38.9658 -38.9658 -17.9771 -17.9752 -17.9310 -17.9293 -17.5289 -17.5270 -17.4655 -17.4637 -17.3620 -17.3615 -17.3457 -17.3452 -8.8474 -8.8365 -8.8215 -8.8100 -0.9467 -0.9399 -0.7830 -0.7797 3.7413 3.7429 4.4122 4.4221 5.2404 5.2498 5.5729 5.5766 5.9246 5.9257 5.9392 5.9416 7.6941 7.6975 7.7106 7.7109 8.2771 8.2860 8.6129 8.6142 9.1165 9.1192 9.1426 9.1457 12.5025 12.5123 12.6132 12.6157 12.8055 12.8119 12.9174 12.9198 13.4442 13.4598 k = 0.1179 0.2043-0.0000 ( 3835 PWs) bands (ev): -38.9676 -38.9676 -38.9671 -38.9671 -17.9741 -17.9721 -17.9291 -17.9273 -17.5237 -17.5218 -17.4621 -17.4602 -17.3565 -17.3560 -17.3412 -17.3407 -8.8569 -8.8461 -8.8295 -8.8182 -0.9943 -0.9877 -0.8196 -0.8163 3.7065 3.7081 4.4279 4.4377 5.2654 5.2749 5.5949 5.5986 5.9297 5.9307 5.9460 5.9481 7.7692 7.7695 7.7954 7.7987 8.2656 8.2730 8.6778 8.6788 9.1562 9.1590 9.2028 9.2059 12.5157 12.5255 12.6055 12.6082 12.8090 12.8153 12.9164 12.9189 13.4197 13.4343 k = 0.1128 0.1954-0.0000 ( 3835 PWs) bands (ev): -38.9690 -38.9690 -38.9685 -38.9685 -17.9712 -17.9691 -17.9274 -17.9255 -17.5185 -17.5165 -17.4588 -17.4569 -17.3509 -17.3504 -17.3367 -17.3362 -8.8662 -8.8557 -8.8375 -8.8263 -1.0403 -1.0338 -0.8546 -0.8515 3.6721 3.6738 4.4432 4.4530 5.2910 5.3006 5.6166 5.6203 5.9340 5.9350 5.9521 5.9540 7.8072 7.8095 7.8944 7.8986 8.2746 8.2799 8.7433 8.7438 9.1958 9.1986 9.2626 9.2655 12.5287 12.5385 12.5983 12.6013 12.8109 12.8172 12.9155 12.9181 13.3940 13.4075 k = 0.1077 0.1865-0.0000 ( 3831 PWs) bands (ev): -38.9703 -38.9703 -38.9698 -38.9698 -17.9685 -17.9663 -17.9260 -17.9240 -17.5132 -17.5112 -17.4557 -17.4537 -17.3452 -17.3447 -17.3322 -17.3317 -8.8755 -8.8651 -8.8453 -8.8343 -1.0845 -1.0782 -0.8882 -0.8851 3.6385 3.6402 4.4581 4.4678 5.3174 5.3269 5.6382 5.6418 5.9376 5.9386 5.9576 5.9593 7.8187 7.8230 7.9921 7.9970 8.3098 8.3128 8.8092 8.8094 9.2353 9.2382 9.3214 9.3242 12.5414 12.5512 12.5917 12.5950 12.8114 12.8176 12.9146 12.9173 13.3669 13.3794 k = 0.1026 0.1776-0.0000 ( 3831 PWs) bands (ev): -38.9715 -38.9715 -38.9710 -38.9710 -17.9659 -17.9636 -17.9249 -17.9227 -17.5079 -17.5058 -17.4528 -17.4508 -17.3395 -17.3390 -17.3277 -17.3272 -8.8845 -8.8744 -8.8529 -8.8422 -1.1270 -1.1209 -0.9203 -0.9173 3.6056 3.6073 4.4725 4.4820 5.3446 5.3541 5.6596 5.6632 5.9406 5.9415 5.9625 5.9640 7.8058 7.8115 8.0877 8.0934 8.3692 8.3705 8.8751 8.8760 9.2748 9.2777 9.3790 9.3816 12.5536 12.5633 12.5858 12.5894 12.8104 12.8166 12.9136 12.9164 13.3383 13.3493 k = 0.0974 0.1688-0.0000 ( 3829 PWs) bands (ev): -38.9728 -38.9728 -38.9723 -38.9723 -17.9634 -17.9610 -17.9240 -17.9217 -17.5026 -17.5005 -17.4500 -17.4480 -17.3337 -17.3332 -17.3231 -17.3227 -8.8934 -8.8835 -8.8603 -8.8500 -1.1677 -1.1618 -0.9508 -0.9479 3.5736 3.5753 4.4862 4.4955 5.3730 5.3823 5.6808 5.6843 5.9431 5.9438 5.9668 5.9681 7.7755 7.7820 8.1804 8.1869 8.4456 8.4458 8.9414 8.9432 9.3144 9.3172 9.4351 9.4376 12.5652 12.5748 12.5808 12.5846 12.8082 12.8143 12.9123 12.9152 13.3078 13.3180 k = 0.0923 0.1599-0.0000 ( 3825 PWs) bands (ev): -38.9740 -38.9740 -38.9735 -38.9735 -17.9611 -17.9585 -17.9233 -17.9209 -17.4973 -17.4952 -17.4474 -17.4454 -17.3280 -17.3275 -17.3186 -17.3181 -8.9020 -8.8924 -8.8676 -8.8575 -1.2065 -1.2009 -0.9797 -0.9770 3.5425 3.5443 4.4991 4.5082 5.4028 5.4119 5.7018 5.7052 5.9449 5.9457 5.9705 5.9717 7.7341 7.7409 8.2695 8.2769 8.5322 8.5327 9.0082 9.0109 9.3540 9.3567 9.4894 9.4918 12.5756 12.5760 12.5814 12.5863 12.8048 12.8109 12.9106 12.9137 13.2751 13.2802 k = 0.0872 0.1510-0.0000 ( 3825 PWs) bands (ev): -38.9751 -38.9751 -38.9746 -38.9746 -17.9589 -17.9562 -17.9228 -17.9203 -17.4922 -17.4900 -17.4451 -17.4429 -17.3223 -17.3218 -17.3141 -17.3136 -8.9103 -8.9011 -8.8746 -8.8649 -1.2435 -1.2381 -1.0072 -1.0045 3.5126 3.5143 4.5111 4.5199 5.4339 5.4428 5.7224 5.7257 5.9463 5.9470 5.9737 5.9747 7.6858 7.6926 8.3544 8.3625 8.6251 8.6259 9.0756 9.0794 9.3936 9.3962 9.5417 9.5440 12.5726 12.5768 12.5876 12.5965 12.8007 12.8067 12.9083 12.9115 13.2389 13.2398 k = 0.0821 0.1421-0.0000 ( 3819 PWs) bands (ev): -38.9762 -38.9762 -38.9757 -38.9757 -17.9568 -17.9540 -17.9226 -17.9199 -17.4871 -17.4849 -17.4429 -17.4407 -17.3168 -17.3163 -17.3097 -17.3092 -8.9184 -8.9095 -8.8813 -8.8720 -1.2785 -1.2734 -1.0330 -1.0305 3.4839 3.4855 4.5222 4.5306 5.4665 5.4751 5.7427 5.7459 5.9473 5.9479 5.9763 5.9772 7.6332 7.6399 8.4341 8.4430 8.7217 8.7227 9.1438 9.1485 9.4333 9.4356 9.5920 9.5941 12.5702 12.5750 12.5972 12.6062 12.7959 12.8020 12.9054 12.9086 13.1996 13.2000 k = 0.0769 0.1332-0.0000 ( 3815 PWs) bands (ev): -38.9773 -38.9773 -38.9768 -38.9768 -17.9548 -17.9519 -17.9225 -17.9197 -17.4822 -17.4800 -17.4408 -17.4387 -17.3113 -17.3108 -17.3053 -17.3048 -8.9261 -8.9177 -8.8878 -8.8789 -1.3116 -1.3067 -1.0573 -1.0549 3.4564 3.4580 4.5323 4.5403 5.5007 5.5089 5.7626 5.7657 5.9479 5.9484 5.9785 5.9792 7.5778 7.5842 8.5083 8.5176 8.8200 8.8212 9.2127 9.2184 9.4728 9.4749 9.6399 9.6419 12.5689 12.5742 12.6063 12.6152 12.7909 12.7970 12.9016 12.9049 13.1611 13.1615 k = 0.0718 0.1244-0.0000 ( 3815 PWs) bands (ev): -38.9783 -38.9783 -38.9778 -38.9778 -17.9529 -17.9500 -17.9225 -17.9197 -17.4774 -17.4752 -17.4390 -17.4369 -17.3060 -17.3055 -17.3009 -17.3004 -8.9334 -8.9255 -8.8939 -8.8855 -1.3427 -1.3381 -1.0801 -1.0778 3.4303 3.4319 4.5414 4.5491 5.5363 5.5442 5.7820 5.7849 5.9481 5.9486 5.9802 5.9808 7.5206 7.5268 8.5762 8.5860 8.9188 8.9200 9.2825 9.2890 9.5120 9.5138 9.6853 9.6873 12.5688 12.5746 12.6148 12.6236 12.7858 12.7919 12.8968 12.9002 13.1230 13.1239 k = 0.0667 0.1155-0.0000 ( 3815 PWs) bands (ev): -38.9793 -38.9793 -38.9788 -38.9788 -17.9511 -17.9481 -17.9228 -17.9198 -17.4729 -17.4707 -17.4375 -17.4353 -17.3009 -17.3004 -17.2967 -17.2962 -8.9404 -8.9329 -8.8997 -8.8918 -1.3717 -1.3674 -1.1012 -1.0991 3.4056 3.4071 4.5495 4.5567 5.5734 5.5808 5.8007 5.8034 5.9481 5.9486 5.9815 5.9821 7.4625 7.4682 8.6377 8.6476 9.0170 9.0182 9.3527 9.3599 9.5508 9.5522 9.7282 9.7300 12.5701 12.5763 12.6227 12.6312 12.7808 12.7869 12.8910 12.8943 13.0821 13.0858 k = 0.0615 0.1066-0.0000 ( 3807 PWs) bands (ev): -38.9802 -38.9802 -38.9797 -38.9797 -17.9494 -17.9463 -17.9231 -17.9200 -17.4686 -17.4663 -17.4361 -17.4338 -17.2960 -17.2955 -17.2926 -17.2921 -8.9469 -8.9399 -8.9052 -8.8977 -1.3987 -1.3947 -1.1208 -1.1188 3.3825 3.3839 4.5567 4.5634 5.6117 5.6187 5.8187 5.8212 5.9478 5.9483 5.9825 5.9830 7.4039 7.4092 8.6926 8.7025 9.1136 9.1149 9.4229 9.4305 9.5889 9.5900 9.7682 9.7699 12.5728 12.5795 12.6300 12.6383 12.7762 12.7823 12.8839 12.8870 13.0399 13.0424 k = 0.0564 0.0977-0.0000 ( 3801 PWs) bands (ev): -38.9810 -38.9810 -38.9805 -38.9805 -17.9478 -17.9446 -17.9236 -17.9204 -17.4645 -17.4622 -17.4349 -17.4326 -17.2913 -17.2908 -17.2887 -17.2882 -8.9531 -8.9465 -8.9103 -8.9033 -1.4236 -1.4199 -1.1388 -1.1370 3.3610 3.3623 4.5629 4.5691 5.6510 5.6576 5.8358 5.8382 5.9475 5.9479 5.9832 5.9837 7.3454 7.3504 8.7412 8.7508 9.2079 9.2091 9.4922 9.4999 9.6263 9.6272 9.8054 9.8070 12.5770 12.5841 12.6367 12.6446 12.7719 12.7781 12.8755 12.8783 12.9970 12.9987 k = 0.0513 0.0888-0.0000 ( 3801 PWs) bands (ev): -38.9818 -38.9818 -38.9813 -38.9813 -17.9463 -17.9430 -17.9242 -17.9209 -17.4606 -17.4584 -17.4339 -17.4316 -17.2870 -17.2865 -17.2850 -17.2845 -8.9587 -8.9527 -8.9149 -8.9086 -1.4464 -1.4430 -1.1553 -1.1536 3.3411 3.3424 4.5683 4.5739 5.6911 5.6971 5.8519 5.8541 5.9469 5.9474 5.9837 5.9841 7.2876 7.2921 8.7836 8.7927 9.2988 9.3000 9.5591 9.5666 9.6633 9.6641 9.8396 9.8410 12.5828 12.5902 12.6428 12.6504 12.7680 12.7743 12.8656 12.8679 12.9542 12.9551 k = 0.0462 0.0799-0.0000 ( 3801 PWs) bands (ev): -38.9825 -38.9825 -38.9820 -38.9820 -17.9448 -17.9415 -17.9249 -17.9215 -17.4570 -17.4547 -17.4331 -17.4309 -17.2830 -17.2825 -17.2815 -17.2810 -8.9638 -8.9584 -8.9192 -8.9134 -1.4670 -1.4640 -1.1701 -1.1686 3.3230 3.3241 4.5728 4.5780 5.7314 5.7369 5.8669 5.8690 5.9464 5.9467 5.9839 5.9843 7.2310 7.2351 8.8202 8.8287 9.3856 9.3867 9.6211 9.6279 9.7011 9.7021 9.8706 9.8719 12.5900 12.5978 12.6484 12.6555 12.7647 12.7710 12.8541 12.8559 12.9122 12.9124 k = 0.0410 0.0711-0.0000 ( 3795 PWs) bands (ev): -38.9831 -38.9831 -38.9826 -38.9826 -17.9434 -17.9400 -17.9256 -17.9222 -17.4537 -17.4514 -17.4325 -17.4303 -17.2793 -17.2788 -17.2783 -17.2778 -8.9685 -8.9635 -8.9230 -8.9178 -1.4856 -1.4828 -1.1834 -1.1820 3.3066 3.3076 4.5767 4.5813 5.7716 5.7765 5.8807 5.8826 5.9459 5.9462 5.9839 5.9843 7.1762 7.1798 8.8516 8.8593 9.4673 9.4683 9.6742 9.6794 9.7422 9.7443 9.8984 9.8996 12.5988 12.6068 12.6534 12.6600 12.7616 12.7682 12.8407 12.8421 12.8715 12.8719 k = 0.0359 0.0622-0.0000 ( 3787 PWs) bands (ev): -38.9837 -38.9837 -38.9832 -38.9832 -17.9420 -17.9385 -17.9264 -17.9230 -17.4505 -17.4482 -17.4322 -17.4299 -17.2760 -17.2755 -17.2753 -17.2748 -8.9726 -8.9682 -8.9264 -8.9218 -1.5019 -1.4995 -1.1951 -1.1939 3.2921 3.2930 4.5799 4.5839 5.8109 5.8153 5.8931 5.8947 5.9455 5.9458 5.9839 5.9843 7.1238 7.1270 8.8781 8.8850 9.5429 9.5439 9.7152 9.7185 9.7885 9.7918 9.9229 9.9240 12.6089 12.6171 12.6579 12.6639 12.7587 12.7658 12.8226 12.8247 12.8365 12.8367 k = 0.0308 0.0533-0.0000 ( 3801 PWs) bands (ev): -38.9842 -38.9842 -38.9837 -38.9837 -17.9407 -17.9372 -17.9273 -17.9238 -17.4477 -17.4454 -17.4321 -17.4298 -17.2732 -17.2727 -17.2727 -17.2722 -8.9761 -8.9724 -8.9293 -8.9253 -1.5161 -1.5140 -1.2052 -1.2042 3.2794 3.2801 4.5826 4.5860 5.8485 5.8523 5.9038 5.9053 5.9452 5.9456 5.9837 5.9841 7.0749 7.0776 8.9003 8.9062 9.6115 9.6125 9.7460 9.7480 9.8368 9.8406 9.9440 9.9449 12.6201 12.6284 12.6619 12.6672 12.7550 12.7638 12.7917 12.7963 12.8160 12.8167 k = 0.0256 0.0444-0.0000 ( 3803 PWs) bands (ev): -38.9846 -38.9846 -38.9841 -38.9841 -17.9395 -17.9359 -17.9283 -17.9247 -17.4451 -17.4428 -17.4321 -17.4298 -17.2707 -17.2705 -17.2702 -17.2700 -8.9791 -8.9759 -8.9317 -8.9284 -1.5281 -1.5263 -1.2138 -1.2129 3.2686 3.2692 4.5848 4.5876 5.8834 5.8866 5.9130 5.9141 5.9454 5.9457 5.9836 5.9840 7.0302 7.0324 8.9184 8.9234 9.6721 9.6729 9.7700 9.7712 9.8824 9.8861 9.9617 9.9626 12.6322 12.6403 12.6653 12.6698 12.7459 12.7571 12.7647 12.7724 12.8009 12.8018 k = 0.0205 0.0355-0.0000 ( 3803 PWs) bands (ev): -38.9849 -38.9849 -38.9844 -38.9844 -17.9382 -17.9346 -17.9293 -17.9257 -17.4428 -17.4404 -17.4324 -17.4301 -17.2687 -17.2686 -17.2682 -17.2681 -8.9815 -8.9789 -8.9337 -8.9310 -1.5379 -1.5365 -1.2208 -1.2201 3.2597 3.2602 4.5865 4.5888 5.9140 5.9163 5.9208 5.9214 5.9462 5.9465 5.9837 5.9840 6.9909 6.9927 8.9329 8.9369 9.7236 9.7243 9.7888 9.7896 9.9223 9.9256 9.9761 9.9768 12.6447 12.6524 12.6682 12.6718 12.7262 12.7306 12.7619 12.7635 12.7874 12.7884 k = 0.0154 0.0266-0.0000 ( 3807 PWs) bands (ev): -38.9852 -38.9852 -38.9847 -38.9847 -17.9370 -17.9334 -17.9303 -17.9267 -17.4407 -17.4383 -17.4329 -17.4306 -17.2671 -17.2671 -17.2666 -17.2665 -8.9833 -8.9814 -8.9351 -8.9331 -1.5455 -1.5444 -1.2262 -1.2257 3.2528 3.2532 4.5878 4.5896 5.9249 5.9256 5.9391 5.9407 5.9486 5.9493 5.9841 5.9845 6.9584 6.9597 8.9440 8.9470 9.7650 9.7655 9.8033 9.8039 9.9547 9.9574 9.9871 9.9877 12.6571 12.6636 12.6704 12.6728 12.7059 12.7080 12.7609 12.7609 12.7759 12.7769 k = 0.0103 0.0178-0.0000 ( 3805 PWs) bands (ev): -38.9854 -38.9854 -38.9849 -38.9849 -17.9358 -17.9322 -17.9313 -17.9277 -17.4388 -17.4364 -17.4336 -17.4313 -17.2660 -17.2660 -17.2655 -17.2655 -8.9845 -8.9832 -8.9361 -8.9347 -1.5509 -1.5501 -1.2300 -1.2297 3.2479 3.2481 4.5889 4.5900 5.9283 5.9287 5.9472 5.9473 5.9603 5.9617 5.9857 5.9860 6.9340 6.9348 8.9519 8.9540 9.7951 9.7954 9.8141 9.8143 9.9783 9.9802 9.9953 9.9958 12.6682 12.6702 12.6727 12.6742 12.6908 12.6919 12.7599 12.7602 12.7671 12.7679 k = 0.0051 0.0089-0.0000 ( 3805 PWs) bands (ev): -38.9855 -38.9855 -38.9850 -38.9850 -17.9347 -17.9324 -17.9310 -17.9288 -17.4371 -17.4348 -17.4346 -17.4323 -17.2653 -17.2653 -17.2648 -17.2648 -8.9851 -8.9844 -8.9365 -8.9358 -1.5540 -1.5537 -1.2323 -1.2321 3.2449 3.2451 4.5896 4.5902 5.9300 5.9302 5.9488 5.9488 5.9695 5.9701 5.9890 5.9890 6.9188 6.9192 8.9568 8.9578 9.8122 9.8124 9.8218 9.8219 9.9916 9.9925 10.0016 10.0018 12.6699 12.6705 12.6770 12.6797 12.6831 12.6837 12.7595 12.7596 12.7616 12.7621 k = 0.0000 0.0000 0.0000 ( 3805 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9335 -17.9335 -17.9299 -17.9299 -17.4357 -17.4357 -17.4334 -17.4334 -17.2651 -17.2651 -17.2646 -17.2646 -8.9851 -8.9851 -8.9364 -8.9364 -1.5549 -1.5549 -1.2330 -1.2330 3.2440 3.2440 4.5900 4.5900 5.9305 5.9305 5.9493 5.9493 5.9721 5.9721 5.9909 5.9909 6.9138 6.9138 8.9588 8.9588 9.8169 9.8169 9.8256 9.8256 9.9955 9.9955 10.0046 10.0046 12.6690 12.6690 12.6807 12.6807 12.6818 12.6818 12.7589 12.7589 12.7603 12.7603 k = 0.0000 0.0000 0.0000 ( 3805 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9335 -17.9335 -17.9299 -17.9299 -17.4357 -17.4357 -17.4334 -17.4334 -17.2651 -17.2651 -17.2646 -17.2646 -8.9851 -8.9851 -8.9364 -8.9364 -1.5549 -1.5549 -1.2330 -1.2330 3.2440 3.2440 4.5900 4.5900 5.9305 5.9305 5.9493 5.9493 5.9721 5.9721 5.9909 5.9909 6.9138 6.9138 8.9588 8.9588 9.8169 9.8169 9.8256 9.8256 9.9955 9.9955 10.0046 10.0046 12.6690 12.6690 12.6807 12.6807 12.6818 12.6818 12.7589 12.7589 12.7603 12.7603 k = 0.0000 0.0000 0.0100 ( 3805 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9335 -17.9335 -17.9299 -17.9299 -17.4357 -17.4357 -17.4334 -17.4334 -17.2651 -17.2651 -17.2646 -17.2646 -8.9849 -8.9849 -8.9365 -8.9365 -1.5542 -1.5542 -1.2338 -1.2338 3.2465 3.2465 4.5849 4.5849 5.9306 5.9306 5.9494 5.9494 5.9720 5.9720 5.9908 5.9908 6.9201 6.9201 8.9539 8.9539 9.8174 9.8174 9.8260 9.8260 9.9951 9.9951 10.0041 10.0041 12.6693 12.6693 12.6808 12.6808 12.6819 12.6819 12.7587 12.7587 12.7601 12.7601 k = 0.0000 0.0000 0.0200 ( 3811 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9335 -17.9335 -17.9299 -17.9299 -17.4357 -17.4357 -17.4334 -17.4334 -17.2651 -17.2651 -17.2646 -17.2646 -8.9846 -8.9846 -8.9369 -8.9369 -1.5521 -1.5521 -1.2364 -1.2364 3.2539 3.2539 4.5697 4.5697 5.9309 5.9309 5.9497 5.9497 5.9716 5.9716 5.9905 5.9905 6.9389 6.9389 8.9393 8.9393 9.8186 9.8186 9.8272 9.8272 9.9938 9.9938 10.0028 10.0028 12.6703 12.6703 12.6813 12.6813 12.6823 12.6823 12.7580 12.7580 12.7595 12.7595 k = 0.0000 0.0000 0.0299 ( 3817 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9335 -17.9335 -17.9300 -17.9300 -17.4357 -17.4357 -17.4335 -17.4335 -17.2651 -17.2651 -17.2646 -17.2646 -8.9840 -8.9840 -8.9375 -8.9375 -1.5486 -1.5486 -1.2407 -1.2407 3.2662 3.2662 4.5450 4.5450 5.9314 5.9314 5.9502 5.9502 5.9711 5.9711 5.9900 5.9900 6.9697 6.9697 8.9151 8.9151 9.8207 9.8207 9.8293 9.8293 9.9916 9.9916 10.0006 10.0006 12.6720 12.6720 12.6820 12.6820 12.6830 12.6830 12.7569 12.7569 12.7584 12.7584 k = 0.0000 0.0000 0.0399 ( 3823 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9335 -17.9335 -17.9301 -17.9301 -17.4357 -17.4357 -17.4335 -17.4335 -17.2651 -17.2651 -17.2646 -17.2646 -8.9832 -8.9832 -8.9383 -8.9383 -1.5438 -1.5438 -1.2465 -1.2465 3.2832 3.2832 4.5117 4.5117 5.9320 5.9320 5.9508 5.9508 5.9704 5.9704 5.9892 5.9892 7.0116 7.0116 8.8819 8.8819 9.8236 9.8236 9.8322 9.8322 9.9886 9.9886 9.9976 9.9976 12.6744 12.6744 12.6831 12.6831 12.6840 12.6840 12.7554 12.7554 12.7570 12.7570 k = 0.0000 0.0000 0.0499 ( 3806 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9333 -17.9333 -17.9301 -17.9301 -17.4356 -17.4356 -17.4335 -17.4335 -17.2650 -17.2650 -17.2645 -17.2645 -8.9822 -8.9822 -8.9393 -8.9393 -1.5376 -1.5376 -1.2540 -1.2540 3.3050 3.3050 4.4708 4.4708 5.9330 5.9330 5.9518 5.9518 5.9695 5.9695 5.9884 5.9884 7.0635 7.0635 8.8399 8.8399 9.8273 9.8273 9.8359 9.8359 9.9848 9.9848 9.9938 9.9938 12.6775 12.6775 12.6844 12.6844 12.6853 12.6853 12.7535 12.7535 12.7552 12.7552 k = 0.0000 0.0000 0.0599 ( 3806 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9333 -17.9333 -17.9302 -17.9302 -17.4355 -17.4355 -17.4336 -17.4336 -17.2650 -17.2650 -17.2645 -17.2645 -8.9810 -8.9810 -8.9405 -8.9405 -1.5301 -1.5301 -1.2628 -1.2628 3.3314 3.3314 4.4235 4.4235 5.9340 5.9340 5.9528 5.9528 5.9685 5.9685 5.9873 5.9873 7.1242 7.1242 8.7898 8.7898 9.8317 9.8317 9.8404 9.8404 9.9802 9.9802 9.9892 9.9892 12.6811 12.6811 12.6861 12.6861 12.6868 12.6868 12.7512 12.7512 12.7531 12.7531 k = 0.0000 0.0000 0.0698 ( 3806 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9331 -17.9331 -17.9303 -17.9303 -17.4355 -17.4355 -17.4337 -17.4337 -17.2650 -17.2650 -17.2645 -17.2645 -8.9796 -8.9796 -8.9420 -8.9420 -1.5214 -1.5214 -1.2731 -1.2731 3.3623 3.3623 4.3707 4.3707 5.9352 5.9352 5.9540 5.9540 5.9672 5.9672 5.9861 5.9861 7.1927 7.1927 8.7322 8.7322 9.8368 9.8368 9.8455 9.8455 9.9749 9.9749 9.9839 9.9839 12.6853 12.6853 12.6880 12.6880 12.6886 12.6886 12.7486 12.7486 12.7507 12.7507 k = 0.0000 0.0000 0.0798 ( 3794 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9330 -17.9330 -17.9304 -17.9304 -17.4354 -17.4354 -17.4337 -17.4337 -17.2650 -17.2650 -17.2645 -17.2645 -8.9780 -8.9780 -8.9436 -8.9436 -1.5116 -1.5116 -1.2845 -1.2845 3.3975 3.3975 4.3137 4.3137 5.9365 5.9365 5.9553 5.9553 5.9659 5.9659 5.9847 5.9847 7.2677 7.2677 8.6678 8.6678 9.8427 9.8427 9.8513 9.8513 9.9689 9.9689 9.9779 9.9779 12.6900 12.6900 12.6902 12.6902 12.6907 12.6907 12.7456 12.7456 12.7481 12.7481 k = 0.0000 0.0000 0.0898 ( 3788 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9329 -17.9329 -17.9305 -17.9305 -17.4353 -17.4353 -17.4338 -17.4338 -17.2650 -17.2650 -17.2645 -17.2645 -8.9763 -8.9763 -8.9454 -8.9454 -1.5006 -1.5006 -1.2970 -1.2970 3.4367 3.4367 4.2534 4.2534 5.9381 5.9381 5.9569 5.9569 5.9643 5.9643 5.9832 5.9832 7.3481 7.3481 8.5972 8.5972 9.8491 9.8491 9.8578 9.8578 9.9623 9.9623 9.9713 9.9713 12.6927 12.6927 12.6930 12.6930 12.6952 12.6952 12.7424 12.7424 12.7454 12.7454 k = 0.0000 0.0000 0.0998 ( 3788 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9327 -17.9327 -17.9306 -17.9306 -17.4352 -17.4352 -17.4339 -17.4339 -17.2650 -17.2650 -17.2645 -17.2645 -8.9743 -8.9743 -8.9473 -8.9473 -1.4887 -1.4887 -1.3104 -1.3104 3.4798 3.4798 4.1908 4.1908 5.9397 5.9397 5.9585 5.9585 5.9627 5.9627 5.9815 5.9815 7.4331 7.4331 8.5212 8.5212 9.8560 9.8560 9.8647 9.8647 9.9552 9.9552 9.9642 9.9642 12.6954 12.6954 12.6956 12.6956 12.7005 12.7005 12.7390 12.7390 12.7426 12.7426 k = 0.0000 0.0000 0.1097 ( 3788 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9326 -17.9326 -17.9308 -17.9308 -17.4351 -17.4351 -17.4340 -17.4340 -17.2650 -17.2650 -17.2645 -17.2645 -8.9723 -8.9723 -8.9494 -8.9494 -1.4758 -1.4758 -1.3247 -1.3247 3.5265 3.5265 4.1266 4.1266 5.9414 5.9414 5.9602 5.9602 5.9609 5.9609 5.9798 5.9798 7.5216 7.5216 8.4405 8.4405 9.8634 9.8634 9.8722 9.8722 9.9476 9.9476 9.9566 9.9566 12.6983 12.6983 12.6984 12.6984 12.7060 12.7060 12.7354 12.7354 12.7400 12.7400 k = 0.0000 0.0000 0.1197 ( 3800 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9325 -17.9325 -17.9310 -17.9310 -17.4351 -17.4351 -17.4341 -17.4341 -17.2650 -17.2650 -17.2645 -17.2645 -8.9702 -8.9702 -8.9515 -8.9515 -1.4622 -1.4622 -1.3395 -1.3395 3.5766 3.5766 4.0615 4.0615 5.9432 5.9432 5.9590 5.9590 5.9620 5.9620 5.9779 5.9779 7.6127 7.6127 8.3558 8.3558 9.8713 9.8713 9.8800 9.8800 9.9396 9.9396 9.9485 9.9485 12.7012 12.7012 12.7016 12.7016 12.7110 12.7110 12.7316 12.7316 12.7381 12.7381 k = 0.0000 0.0000 0.1297 ( 3800 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9323 -17.9323 -17.9312 -17.9312 -17.4350 -17.4350 -17.4342 -17.4342 -17.2650 -17.2650 -17.2645 -17.2645 -8.9680 -8.9680 -8.9538 -8.9538 -1.4479 -1.4479 -1.3549 -1.3549 3.6298 3.6298 3.9963 3.9963 5.9451 5.9451 5.9571 5.9571 5.9639 5.9639 5.9760 5.9760 7.7059 7.7059 8.2678 8.2678 9.8795 9.8795 9.8883 9.8883 9.9313 9.9313 9.9402 9.9402 12.7042 12.7042 12.7050 12.7050 12.7147 12.7147 12.7278 12.7278 12.7376 12.7376 k = 0.0000 0.0000 0.1397 ( 3800 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9321 -17.9321 -17.9313 -17.9313 -17.4349 -17.4349 -17.4343 -17.4343 -17.2650 -17.2650 -17.2645 -17.2645 -8.9656 -8.9656 -8.9561 -8.9561 -1.4330 -1.4330 -1.3705 -1.3705 3.6859 3.6859 3.9316 3.9316 5.9470 5.9470 5.9551 5.9551 5.9659 5.9659 5.9740 5.9740 7.8003 7.8003 8.1770 8.1770 9.8879 9.8879 9.8967 9.8967 9.9228 9.9228 9.9317 9.9317 12.7073 12.7073 12.7085 12.7085 12.7162 12.7162 12.7238 12.7238 12.7396 12.7396 k = 0.0000 0.0000 0.1496 ( 3836 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9321 -17.9321 -17.9315 -17.9315 -17.4349 -17.4349 -17.4344 -17.4344 -17.2651 -17.2651 -17.2646 -17.2646 -8.9633 -8.9633 -8.9585 -8.9585 -1.4177 -1.4177 -1.3863 -1.3863 3.7444 3.7444 3.8676 3.8676 5.9489 5.9489 5.9530 5.9530 5.9678 5.9678 5.9719 5.9719 7.8952 7.8952 8.0843 8.0843 9.8965 9.8965 9.9054 9.9054 9.9140 9.9140 9.9229 9.9229 12.7103 12.7103 12.7122 12.7122 12.7153 12.7153 12.7199 12.7199 12.7440 12.7440 k = 0.0000 0.0000 0.1596 ( 3824 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9320 -17.9320 -17.9316 -17.9316 -17.4349 -17.4349 -17.4344 -17.4344 -17.2650 -17.2650 -17.2645 -17.2645 -8.9612 -8.9612 -8.9606 -8.9606 -1.4022 -1.4022 -1.4020 -1.4020 3.8050 3.8050 3.8053 3.8053 5.9508 5.9508 5.9513 5.9513 5.9697 5.9697 5.9701 5.9701 7.9900 7.9900 7.9902 7.9902 9.9052 9.9052 9.9054 9.9054 9.9140 9.9140 9.9143 9.9143 12.7130 12.7130 12.7133 12.7133 12.7159 12.7159 12.7162 12.7162 12.7499 12.7499 k = 0.0000 0.0000 0.1596 ( 3824 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9320 -17.9320 -17.9316 -17.9316 -17.4349 -17.4349 -17.4344 -17.4344 -17.2650 -17.2650 -17.2645 -17.2645 -8.9612 -8.9612 -8.9606 -8.9606 -1.4022 -1.4022 -1.4020 -1.4020 3.8050 3.8050 3.8053 3.8053 5.9508 5.9508 5.9513 5.9513 5.9697 5.9697 5.9701 5.9701 7.9900 7.9900 7.9902 7.9902 9.9052 9.9052 9.9054 9.9054 9.9140 9.9140 9.9143 9.9143 12.7130 12.7130 12.7133 12.7133 12.7159 12.7159 12.7162 12.7162 12.7499 12.7499 k = 0.0089 0.0052 0.1596 ( 3826 PWs) bands (ev): -38.9855 -38.9855 -38.9850 -38.9850 -17.9332 -17.9327 -17.9309 -17.9305 -17.4363 -17.4358 -17.4337 -17.4332 -17.2653 -17.2653 -17.2648 -17.2648 -8.9612 -8.9607 -8.9606 -8.9600 -1.4013 -1.4011 -1.4011 -1.4009 3.8054 3.8055 3.8057 3.8058 5.9499 5.9502 5.9504 5.9507 5.9690 5.9690 5.9694 5.9694 7.9906 7.9908 7.9912 7.9914 9.9010 9.9012 9.9013 9.9016 9.9107 9.9108 9.9110 9.9111 12.7078 12.7081 12.7131 12.7132 12.7174 12.7176 12.7177 12.7180 12.7506 12.7508 k = 0.0179 0.0103 0.1596 ( 3818 PWs) bands (ev): -38.9854 -38.9854 -38.9849 -38.9849 -17.9343 -17.9339 -17.9298 -17.9294 -17.4379 -17.4374 -17.4327 -17.4323 -17.2659 -17.2659 -17.2654 -17.2654 -8.9607 -8.9601 -8.9594 -8.9588 -1.3986 -1.3983 -1.3980 -1.3978 3.8069 3.8071 3.8072 3.8074 5.9474 5.9478 5.9479 5.9484 5.9673 5.9674 5.9678 5.9679 7.9929 7.9932 7.9941 7.9943 9.8859 9.8862 9.8867 9.8870 9.9037 9.9039 9.9040 9.9042 12.6995 12.6998 12.7070 12.7072 12.7230 12.7233 12.7235 12.7238 12.7581 12.7582 k = 0.0268 0.0155 0.1596 ( 3814 PWs) bands (ev): -38.9852 -38.9852 -38.9847 -38.9847 -17.9355 -17.9351 -17.9288 -17.9283 -17.4398 -17.4393 -17.4320 -17.4315 -17.2671 -17.2670 -17.2666 -17.2665 -8.9596 -8.9591 -8.9577 -8.9571 -1.3938 -1.3936 -1.3930 -1.3928 3.8094 3.8096 3.8097 3.8099 5.9422 5.9426 5.9431 5.9436 5.9655 5.9657 5.9660 5.9662 7.9969 7.9971 7.9985 7.9988 9.8591 9.8594 9.8603 9.8606 9.8944 9.8946 9.8948 9.8951 12.6893 12.6896 12.6974 12.6976 12.7325 12.7328 12.7331 12.7334 12.7697 12.7699 k = 0.0357 0.0206 0.1596 ( 3808 PWs) bands (ev): -38.9849 -38.9849 -38.9844 -38.9844 -17.9367 -17.9363 -17.9277 -17.9273 -17.4419 -17.4414 -17.4315 -17.4310 -17.2687 -17.2686 -17.2682 -17.2681 -8.9580 -8.9574 -8.9554 -8.9548 -1.3871 -1.3869 -1.3861 -1.3858 3.8128 3.8132 3.8132 3.8135 5.9339 5.9344 5.9352 5.9357 5.9643 5.9646 5.9648 5.9651 8.0022 8.0024 8.0044 8.0046 9.8219 9.8221 9.8234 9.8237 9.8822 9.8825 9.8827 9.8830 12.6775 12.6778 12.6855 12.6858 12.7456 12.7459 12.7464 12.7467 12.7840 12.7842 k = 0.0446 0.0258 0.1596 ( 3808 PWs) bands (ev): -38.9846 -38.9846 -38.9841 -38.9841 -17.9380 -17.9376 -17.9268 -17.9263 -17.4442 -17.4438 -17.4312 -17.4308 -17.2707 -17.2705 -17.2702 -17.2700 -8.9558 -8.9552 -8.9525 -8.9520 -1.3785 -1.3783 -1.3772 -1.3770 3.8173 3.8176 3.8177 3.8180 5.9226 5.9230 5.9242 5.9246 5.9638 5.9641 5.9643 5.9646 8.0086 8.0089 8.0114 8.0116 9.7751 9.7753 9.7769 9.7772 9.8670 9.8673 9.8677 9.8679 12.6640 12.6643 12.6718 12.6720 12.7622 12.7625 12.7631 12.7634 12.8004 12.8006 k = 0.0536 0.0309 0.1596 ( 3816 PWs) bands (ev): -38.9842 -38.9842 -38.9837 -38.9837 -17.9393 -17.9389 -17.9259 -17.9254 -17.4469 -17.4464 -17.4312 -17.4307 -17.2732 -17.2728 -17.2727 -17.2723 -8.9531 -8.9525 -8.9492 -8.9486 -1.3680 -1.3678 -1.3664 -1.3662 3.8226 3.8229 3.8231 3.8234 5.9085 5.9090 5.9104 5.9109 5.9637 5.9641 5.9642 5.9645 8.0159 8.0161 8.0192 8.0194 9.7197 9.7199 9.7218 9.7221 9.8489 9.8492 9.8497 9.8499 12.6488 12.6491 12.6562 12.6565 12.7821 12.7824 12.7831 12.7834 12.8184 12.8186 k = 0.0625 0.0361 0.1596 ( 3816 PWs) bands (ev): -38.9837 -38.9837 -38.9832 -38.9832 -17.9407 -17.9402 -17.9250 -17.9245 -17.4498 -17.4493 -17.4313 -17.4309 -17.2761 -17.2756 -17.2755 -17.2750 -8.9498 -8.9492 -8.9453 -8.9447 -1.3555 -1.3553 -1.3536 -1.3534 3.8288 3.8291 3.8294 3.8297 5.8921 5.8926 5.8943 5.8947 5.9640 5.9644 5.9645 5.9648 8.0235 8.0237 8.0273 8.0275 9.6567 9.6569 9.6591 9.6593 9.8281 9.8284 9.8290 9.8293 12.6319 12.6322 12.6390 12.6392 12.8050 12.8053 12.8062 12.8065 12.8376 12.8378 k = 0.0714 0.0412 0.1596 ( 3828 PWs) bands (ev): -38.9831 -38.9831 -38.9826 -38.9826 -17.9421 -17.9416 -17.9242 -17.9238 -17.4530 -17.4525 -17.4317 -17.4313 -17.2794 -17.2789 -17.2785 -17.2780 -8.9460 -8.9455 -8.9409 -8.9404 -1.3411 -1.3409 -1.3390 -1.3388 3.8359 3.8362 3.8366 3.8369 5.8737 5.8741 5.8761 5.8765 5.9645 5.9648 5.9649 5.9653 8.0309 8.0311 8.0353 8.0355 9.5871 9.5874 9.5898 9.5901 9.8048 9.8051 9.8058 9.8060 12.6133 12.6136 12.6200 12.6203 12.8306 12.8309 12.8319 12.8322 12.8577 12.8579 k = 0.0804 0.0464 0.1596 ( 3830 PWs) bands (ev): -38.9824 -38.9824 -38.9819 -38.9819 -17.9435 -17.9431 -17.9235 -17.9230 -17.4564 -17.4559 -17.4323 -17.4319 -17.2831 -17.2826 -17.2818 -17.2813 -8.9417 -8.9412 -8.9361 -8.9355 -1.3248 -1.3246 -1.3224 -1.3222 3.8438 3.8441 3.8446 3.8449 5.8535 5.8539 5.8561 5.8565 5.9651 5.9655 5.9655 5.9659 8.0376 8.0378 8.0425 8.0427 9.5122 9.5124 9.5151 9.5154 9.7793 9.7796 9.7803 9.7806 12.5932 12.5934 12.5995 12.5998 12.8584 12.8587 12.8600 12.8602 12.8785 12.8787 k = 0.0893 0.0515 0.1596 ( 3828 PWs) bands (ev): -38.9817 -38.9817 -38.9812 -38.9812 -17.9450 -17.9446 -17.9228 -17.9224 -17.4600 -17.4596 -17.4331 -17.4327 -17.2870 -17.2865 -17.2853 -17.2848 -8.9370 -8.9364 -8.9308 -8.9302 -1.3066 -1.3064 -1.3040 -1.3037 3.8525 3.8528 3.8534 3.8537 5.8317 5.8321 5.8346 5.8350 5.9658 5.9662 5.9663 5.9666 8.0428 8.0430 8.0482 8.0484 9.4331 9.4333 9.4363 9.4365 9.7517 9.7520 9.7528 9.7531 12.5715 12.5717 12.5775 12.5778 12.8872 12.8875 12.8895 12.8898 12.9006 12.9008 k = 0.0982 0.0567 0.1596 ( 3838 PWs) bands (ev): -38.9810 -38.9810 -38.9805 -38.9805 -17.9466 -17.9462 -17.9223 -17.9219 -17.4640 -17.4635 -17.4342 -17.4337 -17.2914 -17.2909 -17.2891 -17.2886 -8.9318 -8.9312 -8.9250 -8.9244 -1.2865 -1.2863 -1.2836 -1.2834 3.8619 3.8622 3.8629 3.8632 5.8087 5.8091 5.8118 5.8122 5.9665 5.9669 5.9670 5.9674 8.0457 8.0459 8.0515 8.0518 9.3512 9.3514 9.3545 9.3547 9.7224 9.7226 9.7235 9.7238 12.5484 12.5486 12.5541 12.5544 12.9132 12.9133 12.9181 12.9183 12.9273 12.9276 k = 0.1071 0.0619 0.1596 ( 3838 PWs) bands (ev): -38.9801 -38.9801 -38.9796 -38.9796 -17.9483 -17.9479 -17.9219 -17.9214 -17.4681 -17.4677 -17.4354 -17.4349 -17.2959 -17.2954 -17.2931 -17.2926 -8.9261 -8.9256 -8.9188 -8.9183 -1.2645 -1.2643 -1.2614 -1.2612 3.8720 3.8723 3.8731 3.8734 5.7846 5.7850 5.7880 5.7884 5.9673 5.9677 5.9678 5.9682 8.0454 8.0456 8.0516 8.0519 9.2678 9.2680 9.2713 9.2715 9.6915 9.6918 9.6927 9.6929 12.5240 12.5242 12.5294 12.5297 12.9345 12.9347 12.9416 12.9418 12.9599 12.9602 k = 0.1161 0.0670 0.1596 ( 3838 PWs) bands (ev): -38.9792 -38.9792 -38.9787 -38.9787 -17.9500 -17.9496 -17.9216 -17.9211 -17.4725 -17.4721 -17.4369 -17.4364 -17.3007 -17.3002 -17.2972 -17.2967 -8.9201 -8.9195 -8.9123 -8.9117 -1.2407 -1.2404 -1.2374 -1.2371 3.8826 3.8829 3.8838 3.8841 5.7597 5.7601 5.7633 5.7637 5.9681 5.9685 5.9686 5.9690 8.0408 8.0410 8.0473 8.0475 9.1847 9.1849 9.1881 9.1884 9.6594 9.6596 9.6606 9.6608 12.4983 12.4986 12.5035 12.5037 12.9541 12.9543 12.9619 12.9621 12.9953 12.9956 k = 0.1250 0.0722 0.1596 ( 3834 PWs) bands (ev): -38.9782 -38.9782 -38.9778 -38.9777 -17.9519 -17.9514 -17.9214 -17.9210 -17.4772 -17.4767 -17.4385 -17.4381 -17.3057 -17.3052 -17.3014 -17.3009 -8.9136 -8.9130 -8.9054 -8.9048 -1.2150 -1.2148 -1.2115 -1.2112 3.8938 3.8941 3.8951 3.8954 5.7341 5.7345 5.7380 5.7384 5.9689 5.9693 5.9694 5.9698 8.0305 8.0307 8.0372 8.0374 9.1034 9.1036 9.1068 9.1070 9.6262 9.6264 9.6274 9.6277 12.4714 12.4717 12.4763 12.4765 12.9727 12.9729 12.9809 12.9811 13.0322 13.0325 k = 0.1339 0.0773 0.1596 ( 3846 PWs) bands (ev): -38.9772 -38.9772 -38.9767 -38.9767 -17.9538 -17.9534 -17.9215 -17.9210 -17.4821 -17.4816 -17.4405 -17.4400 -17.3108 -17.3103 -17.3057 -17.3053 -8.9068 -8.9062 -8.8981 -8.8976 -1.1875 -1.1873 -1.1837 -1.1835 3.9054 3.9057 3.9068 3.9071 5.7080 5.7084 5.7121 5.7124 5.9696 5.9700 5.9701 5.9705 8.0131 8.0133 8.0198 8.0200 9.0258 9.0260 9.0290 9.0292 9.5921 9.5923 9.5934 9.5936 12.4433 12.4436 12.4479 12.4482 12.9905 12.9907 12.9991 12.9992 13.0703 13.0706 k = 0.1429 0.0825 0.1596 ( 3844 PWs) bands (ev): -38.9762 -38.9762 -38.9757 -38.9757 -17.9559 -17.9555 -17.9217 -17.9212 -17.4871 -17.4867 -17.4426 -17.4422 -17.3160 -17.3156 -17.3101 -17.3096 -8.8997 -8.8991 -8.8906 -8.8900 -1.1582 -1.1579 -1.1542 -1.1540 3.9174 3.9177 3.9189 3.9192 5.6815 5.6819 5.6858 5.6862 5.9703 5.9707 5.9707 5.9712 7.9871 7.9873 7.9937 7.9938 8.9539 8.9541 8.9567 8.9569 9.5574 9.5577 9.5587 9.5590 12.4141 12.4143 12.4184 12.4186 13.0078 13.0080 13.0166 13.0168 13.1092 13.1095 k = 0.1518 0.0876 0.1596 ( 3844 PWs) bands (ev): -38.9750 -38.9750 -38.9745 -38.9745 -17.9581 -17.9576 -17.9220 -17.9216 -17.4924 -17.4919 -17.4450 -17.4446 -17.3213 -17.3208 -17.3145 -17.3140 -8.8922 -8.8917 -8.8828 -8.8822 -1.1271 -1.1268 -1.1229 -1.1227 3.9297 3.9300 3.9313 3.9316 5.6547 5.6551 5.6593 5.6597 5.9708 5.9713 5.9713 5.9718 7.9512 7.9514 7.9574 7.9576 8.8893 8.8894 8.8915 8.8917 9.5223 9.5225 9.5236 9.5238 12.3837 12.3840 12.3878 12.3880 13.0248 13.0249 13.0338 13.0339 13.1487 13.1491 k = 0.1607 0.0928 0.1596 ( 3842 PWs) bands (ev): -38.9739 -38.9739 -38.9734 -38.9734 -17.9604 -17.9599 -17.9226 -17.9222 -17.4978 -17.4974 -17.4477 -17.4472 -17.3266 -17.3261 -17.3189 -17.3184 -8.8845 -8.8839 -8.8747 -8.8741 -1.0942 -1.0940 -1.0899 -1.0897 3.9423 3.9426 3.9439 3.9442 5.6278 5.6282 5.6326 5.6330 5.9713 5.9718 5.9718 5.9723 7.9045 7.9047 7.9102 7.9103 8.8332 8.8333 8.8346 8.8348 9.4869 9.4872 9.4882 9.4885 12.3523 12.3525 12.3560 12.3562 13.0415 13.0417 13.0507 13.0509 13.1887 13.1890 k = 0.1696 0.0979 0.1596 ( 3842 PWs) bands (ev): -38.9727 -38.9727 -38.9722 -38.9722 -17.9628 -17.9624 -17.9235 -17.9230 -17.5033 -17.5029 -17.4506 -17.4501 -17.3318 -17.3313 -17.3232 -17.3227 -8.8766 -8.8760 -8.8664 -8.8659 -1.0596 -1.0594 -1.0551 -1.0549 3.9549 3.9552 3.9567 3.9570 5.6008 5.6011 5.6058 5.6061 5.9717 5.9722 5.9722 5.9726 7.8468 7.8470 7.8517 7.8519 8.7861 8.7862 8.7866 8.7868 9.4515 9.4517 9.4528 9.4530 12.3197 12.3199 12.3231 12.3233 13.0584 13.0585 13.0677 13.0679 13.2288 13.2291 k = 0.1786 0.1031 0.1596 ( 3826 PWs) bands (ev): -38.9714 -38.9714 -38.9709 -38.9709 -17.9654 -17.9649 -17.9246 -17.9241 -17.5089 -17.5085 -17.4537 -17.4532 -17.3369 -17.3365 -17.3275 -17.3270 -8.8684 -8.8678 -8.8580 -8.8574 -1.0233 -1.0231 -1.0187 -1.0185 3.9677 3.9680 3.9696 3.9699 5.5737 5.5741 5.5789 5.5793 5.9719 5.9724 5.9724 5.9729 7.7787 7.7789 7.7828 7.7829 8.7473 8.7475 8.7477 8.7479 9.4161 9.4163 9.4174 9.4176 12.2861 12.2863 12.2892 12.2894 13.0755 13.0757 13.0850 13.0852 13.2690 13.2693 k = 0.1875 0.1083 0.1596 ( 3830 PWs) bands (ev): -38.9701 -38.9701 -38.9696 -38.9696 -17.9681 -17.9677 -17.9259 -17.9255 -17.5146 -17.5142 -17.4571 -17.4567 -17.3420 -17.3415 -17.3317 -17.3312 -8.8600 -8.8594 -8.8494 -8.8488 -0.9854 -0.9852 -0.9806 -0.9804 3.9805 3.9808 3.9825 3.9828 5.5465 5.5468 5.5519 5.5522 5.9720 5.9724 5.9725 5.9729 7.7014 7.7015 7.7046 7.7047 8.7158 8.7160 8.7172 8.7174 9.3809 9.3811 9.3822 9.3824 12.2514 12.2516 12.2543 12.2545 13.0933 13.0934 13.1028 13.1030 13.3092 13.3095 k = 0.1964 0.1134 0.1596 ( 3830 PWs) bands (ev): -38.9688 -38.9688 -38.9683 -38.9683 -17.9710 -17.9706 -17.9276 -17.9271 -17.5203 -17.5199 -17.4608 -17.4603 -17.3468 -17.3463 -17.3358 -17.3353 -8.8515 -8.8509 -8.8406 -8.8401 -0.9458 -0.9456 -0.9409 -0.9407 3.9931 3.9934 3.9952 3.9955 5.5191 5.5195 5.5248 5.5251 5.9718 5.9723 5.9723 5.9728 7.6165 7.6166 7.6188 7.6190 8.6908 8.6910 8.6932 8.6934 9.3460 9.3462 9.3473 9.3475 12.2159 12.2161 12.2184 12.2186 13.1117 13.1119 13.1213 13.1215 13.3492 13.3508 k = 0.2054 0.1186 0.1596 ( 3826 PWs) bands (ev): -38.9675 -38.9675 -38.9670 -38.9670 -17.9740 -17.9736 -17.9296 -17.9291 -17.5260 -17.5256 -17.4647 -17.4642 -17.3514 -17.3510 -17.3398 -17.3393 -8.8429 -8.8423 -8.8318 -8.8313 -0.9047 -0.9044 -0.8996 -0.8994 4.0056 4.0059 4.0078 4.0081 5.4916 5.4920 5.4975 5.4978 5.9715 5.9720 5.9720 5.9725 7.5257 7.5259 7.5272 7.5274 8.6712 8.6713 8.6744 8.6745 9.3115 9.3118 9.3128 9.3130 12.1795 12.1797 12.1818 12.1820 13.1311 13.1313 13.1407 13.1409 13.3889 13.3898 k = 0.2143 0.1237 0.1596 ( 3842 PWs) bands (ev): -38.9661 -38.9661 -38.9656 -38.9656 -17.9773 -17.9768 -17.9319 -17.9314 -17.5317 -17.5312 -17.4688 -17.4684 -17.3559 -17.3554 -17.3437 -17.3432 -8.8342 -8.8336 -8.8230 -8.8224 -0.8620 -0.8617 -0.8568 -0.8566 4.0179 4.0182 4.0202 4.0205 5.4638 5.4642 5.4698 5.4702 5.9710 5.9714 5.9715 5.9720 7.4307 7.4309 7.4315 7.4316 8.6555 8.6557 8.6595 8.6597 9.2776 9.2778 9.2789 9.2791 12.1424 12.1426 12.1444 12.1446 13.1516 13.1518 13.1612 13.1614 13.4283 13.4287 k = 0.2232 0.1289 0.1596 ( 3840 PWs) bands (ev): -38.9648 -38.9648 -38.9643 -38.9643 -17.9806 -17.9802 -17.9345 -17.9340 -17.5372 -17.5368 -17.4732 -17.4727 -17.3600 -17.3596 -17.3475 -17.3470 -8.8254 -8.8248 -8.8141 -8.8135 -0.8178 -0.8176 -0.8125 -0.8123 4.0298 4.0301 4.0322 4.0325 5.4356 5.4360 5.4419 5.4422 5.9703 5.9708 5.9708 5.9713 7.3329 7.3330 7.3331 7.3332 8.6429 8.6431 8.6476 8.6478 9.2443 9.2446 9.2456 9.2458 12.1047 12.1049 12.1064 12.1066 13.1733 13.1735 13.1828 13.1830 13.4673 13.4682 k = 0.2321 0.1340 0.1596 ( 3846 PWs) bands (ev): -38.9634 -38.9634 -38.9629 -38.9629 -17.9841 -17.9837 -17.9375 -17.9370 -17.5426 -17.5422 -17.4777 -17.4773 -17.3639 -17.3635 -17.3511 -17.3506 -8.8166 -8.8160 -8.8052 -8.8047 -0.7722 -0.7719 -0.7668 -0.7666 4.0412 4.0415 4.0437 4.0440 5.4069 5.4073 5.4133 5.4137 5.9694 5.9698 5.9699 5.9704 7.2331 7.2332 7.2336 7.2338 8.6326 8.6327 8.6378 8.6380 9.2118 9.2120 9.2130 9.2132 12.0666 12.0668 12.0681 12.0683 13.1963 13.1965 13.2057 13.2059 13.5058 13.5069 k = 0.2411 0.1392 0.1596 ( 3846 PWs) bands (ev): -38.9620 -38.9620 -38.9615 -38.9615 -17.9878 -17.9873 -17.9407 -17.9403 -17.5479 -17.5475 -17.4825 -17.4820 -17.3676 -17.3671 -17.3545 -17.3540 -8.8078 -8.8072 -8.7964 -8.7958 -0.7252 -0.7249 -0.7197 -0.7195 4.0522 4.0525 4.0548 4.0551 5.3775 5.3779 5.3841 5.3844 5.9683 5.9687 5.9688 5.9693 7.1328 7.1330 7.1339 7.1341 8.6239 8.6240 8.6296 8.6298 9.1800 9.1802 9.1812 9.1814 12.0282 12.0284 12.0295 12.0296 13.2206 13.2207 13.2298 13.2300 13.5435 13.5443 k = 0.2500 0.1443 0.1596 ( 3848 PWs) bands (ev): -38.9606 -38.9606 -38.9601 -38.9601 -17.9916 -17.9911 -17.9444 -17.9439 -17.5529 -17.5525 -17.4873 -17.4869 -17.3709 -17.3704 -17.3578 -17.3574 -8.7990 -8.7984 -8.7876 -8.7870 -0.6769 -0.6766 -0.6714 -0.6711 4.0625 4.0628 4.0652 4.0655 5.3473 5.3476 5.3540 5.3543 5.9670 5.9674 5.9675 5.9680 7.0332 7.0333 7.0348 7.0349 8.6164 8.6165 8.6225 8.6227 9.1491 9.1493 9.1502 9.1504 11.9897 11.9899 11.9907 11.9909 13.2461 13.2463 13.2552 13.2554 13.5808 13.5815 k = 0.2589 0.1495 0.1596 ( 3846 PWs) bands (ev): -38.9591 -38.9591 -38.9587 -38.9587 -17.9955 -17.9950 -17.9483 -17.9478 -17.5578 -17.5573 -17.4922 -17.4918 -17.3740 -17.3735 -17.3610 -17.3605 -8.7903 -8.7897 -8.7789 -8.7783 -0.6273 -0.6271 -0.6218 -0.6216 4.0722 4.0724 4.0749 4.0752 5.3160 5.3164 5.3229 5.3232 5.9655 5.9659 5.9660 5.9665 6.9349 6.9351 6.9370 6.9371 8.6098 8.6100 8.6163 8.6165 9.1191 9.1193 9.1202 9.1204 11.9513 11.9514 11.9521 11.9523 13.2729 13.2730 13.2818 13.2820 13.6176 13.6184 k = 0.2679 0.1546 0.1596 ( 3846 PWs) bands (ev): -38.9577 -38.9577 -38.9573 -38.9572 -17.9995 -17.9990 -17.9526 -17.9521 -17.5623 -17.5619 -17.4973 -17.4968 -17.3769 -17.3764 -17.3640 -17.3635 -8.7816 -8.7810 -8.7703 -8.7698 -0.5766 -0.5764 -0.5711 -0.5708 4.0809 4.0812 4.0838 4.0840 5.2836 5.2839 5.2906 5.2909 5.9638 5.9643 5.9643 5.9648 6.8388 6.8389 6.8412 6.8414 8.6040 8.6041 8.6107 8.6109 9.0900 9.0903 9.0911 9.0913 11.9130 11.9132 11.9137 11.9138 13.3008 13.3010 13.3095 13.3097 13.6537 13.6545 k = 0.2768 0.1598 0.1596 ( 3852 PWs) bands (ev): -38.9564 -38.9564 -38.9559 -38.9559 -18.0036 -18.0032 -17.9571 -17.9567 -17.5666 -17.5662 -17.5023 -17.5019 -17.3795 -17.3790 -17.3669 -17.3664 -8.7731 -8.7725 -8.7619 -8.7614 -0.5248 -0.5246 -0.5193 -0.5190 4.0886 4.0889 4.0915 4.0918 5.2499 5.2502 5.2570 5.2573 5.9619 5.9624 5.9624 5.9629 6.7454 6.7455 6.7482 6.7484 8.5987 8.5989 8.6057 8.6059 9.0620 9.0622 9.0630 9.0632 11.8752 11.8754 11.8756 11.8758 13.3298 13.3300 13.3383 13.3385 13.6892 13.6897 k = 0.2857 0.1650 0.1596 ( 3844 PWs) bands (ev): -38.9550 -38.9550 -38.9545 -38.9545 -18.0078 -18.0074 -17.9619 -17.9615 -17.5706 -17.5702 -17.5074 -17.5069 -17.3818 -17.3813 -17.3696 -17.3691 -8.7647 -8.7641 -8.7537 -8.7531 -0.4721 -0.4718 -0.4665 -0.4663 4.0952 4.0955 4.0982 4.0985 5.2149 5.2152 5.2220 5.2224 5.9599 5.9603 5.9604 5.9608 6.6553 6.6555 6.6585 6.6586 8.5941 8.5943 8.6012 8.6014 9.0350 9.0352 9.0359 9.0361 11.8379 11.8380 11.8382 11.8383 13.3598 13.3599 13.3680 13.3682 13.7239 13.7245 k = 0.2946 0.1701 0.1596 ( 3856 PWs) bands (ev): -38.9536 -38.9536 -38.9531 -38.9531 -18.0121 -18.0117 -17.9670 -17.9666 -17.5744 -17.5740 -17.5124 -17.5120 -17.3840 -17.3835 -17.3722 -17.3717 -8.7564 -8.7558 -8.7456 -8.7450 -0.4185 -0.4183 -0.4129 -0.4127 4.1004 4.1006 4.1034 4.1037 5.1785 5.1789 5.1857 5.1860 5.9576 5.9581 5.9581 5.9586 6.5690 6.5692 6.5724 6.5725 8.5899 8.5901 8.5971 8.5973 9.0090 9.0092 9.0099 9.0101 11.8012 11.8014 11.8014 11.8015 13.3905 13.3907 13.3985 13.3987 13.7581 13.7584 k = 0.3036 0.1753 0.1596 ( 3854 PWs) bands (ev): -38.9523 -38.9523 -38.9518 -38.9518 -18.0164 -18.0160 -17.9723 -17.9719 -17.5778 -17.5774 -17.5174 -17.5170 -17.3859 -17.3854 -17.3746 -17.3741 -8.7483 -8.7478 -8.7377 -8.7372 -0.3641 -0.3639 -0.3586 -0.3584 4.1039 4.1041 4.1069 4.1072 5.1410 5.1414 5.1482 5.1485 5.9552 5.9557 5.9557 5.9562 6.4868 6.4870 6.4904 6.4905 8.5864 8.5865 8.5936 8.5938 8.9841 8.9843 8.9849 8.9852 11.7654 11.7654 11.7655 11.7656 13.4220 13.4222 13.4297 13.4299 13.7916 13.7919 k = 0.3125 0.1804 0.1596 ( 3854 PWs) bands (ev): -38.9509 -38.9509 -38.9505 -38.9505 -18.0208 -18.0203 -17.9778 -17.9774 -17.5809 -17.5805 -17.5223 -17.5219 -17.3877 -17.3872 -17.3768 -17.3763 -8.7405 -8.7399 -8.7301 -8.7295 -0.3092 -0.3089 -0.3037 -0.3035 4.1054 4.1057 4.1084 4.1087 5.1026 5.1029 5.1097 5.1100 5.9528 5.9532 5.9532 5.9537 6.4090 6.4091 6.4127 6.4128 8.5834 8.5835 8.5906 8.5908 8.9603 8.9605 8.9611 8.9613 11.7304 11.7304 11.7305 11.7306 13.4540 13.4542 13.4614 13.4616 13.8241 13.8244 k = 0.3214 0.1856 0.1596 ( 3858 PWs) bands (ev): -38.9497 -38.9497 -38.9492 -38.9492 -18.0251 -18.0246 -17.9835 -17.9830 -17.5837 -17.5833 -17.5271 -17.5267 -17.3893 -17.3888 -17.3790 -17.3785 -8.7328 -8.7323 -8.7227 -8.7222 -0.2537 -0.2535 -0.2483 -0.2481 4.1046 4.1049 4.1076 4.1079 5.0637 5.0640 5.0706 5.0709 5.9501 5.9506 5.9506 5.9511 6.3357 6.3358 6.3395 6.3397 8.5809 8.5811 8.5882 8.5883 8.9376 8.9378 8.9384 8.9386 11.6964 11.6965 11.6965 11.6967 13.4864 13.4866 13.4935 13.4937 13.8562 13.8563 k = 0.3304 0.1907 0.1596 ( 3856 PWs) bands (ev): -38.9484 -38.9484 -38.9479 -38.9479 -18.0294 -18.0289 -17.9892 -17.9888 -17.5863 -17.5858 -17.5318 -17.5314 -17.3907 -17.3902 -17.3810 -17.3805 -8.7254 -8.7249 -8.7156 -8.7151 -0.1980 -0.1978 -0.1927 -0.1924 4.1011 4.1014 4.1041 4.1044 5.0248 5.0251 5.0315 5.0319 5.9475 5.9479 5.9479 5.9484 6.2670 6.2672 6.2709 6.2710 8.5792 8.5793 8.5863 8.5865 8.9160 8.9162 8.9168 8.9170 11.6635 11.6637 11.6637 11.6639 13.5190 13.5192 13.5258 13.5260 13.8870 13.8872 k = 0.3393 0.1959 0.1596 ( 3860 PWs) bands (ev): -38.9472 -38.9472 -38.9467 -38.9467 -18.0336 -18.0332 -17.9951 -17.9946 -17.5885 -17.5881 -17.5364 -17.5360 -17.3919 -17.3914 -17.3828 -17.3823 -8.7183 -8.7177 -8.7088 -8.7083 -0.1422 -0.1419 -0.1369 -0.1367 4.0945 4.0947 4.0974 4.0977 4.9867 4.9870 4.9932 4.9935 5.9447 5.9451 5.9452 5.9456 6.2030 6.2031 6.2068 6.2069 8.5780 8.5782 8.5850 8.5852 8.8956 8.8958 8.8963 8.8965 11.6319 11.6320 11.6322 11.6323 13.5517 13.5520 13.5583 13.5585 13.9173 13.9175 k = 0.3482 0.2010 0.1596 ( 3864 PWs) bands (ev): -38.9460 -38.9460 -38.9455 -38.9455 -18.0378 -18.0373 -18.0009 -18.0005 -17.5905 -17.5900 -17.5409 -17.5404 -17.3931 -17.3926 -17.3845 -17.3841 -8.7114 -8.7109 -8.7023 -8.7018 -0.0864 -0.0862 -0.0813 -0.0811 4.0843 4.0846 4.0871 4.0874 4.9502 4.9505 4.9563 4.9567 5.9418 5.9423 5.9423 5.9428 6.1434 6.1435 6.1471 6.1472 8.5776 8.5777 8.5844 8.5846 8.8763 8.8765 8.8769 8.8771 11.6016 11.6017 11.6019 11.6021 13.5845 13.5847 13.5907 13.5909 13.9465 13.9466 k = 0.3571 0.2062 0.1596 ( 3864 PWs) bands (ev): -38.9449 -38.9449 -38.9444 -38.9444 -18.0418 -18.0414 -18.0068 -18.0063 -17.5922 -17.5917 -17.5451 -17.5447 -17.3940 -17.3936 -17.3861 -17.3856 -8.7049 -8.7043 -8.6961 -8.6956 -0.0309 -0.0307 -0.0260 -0.0257 4.0702 4.0705 4.0729 4.0732 4.9161 4.9164 4.9218 4.9222 5.9390 5.9394 5.9395 5.9399 6.0880 6.0882 6.0916 6.0918 8.5777 8.5779 8.5844 8.5846 8.8581 8.8583 8.8587 8.8589 11.5727 11.5728 11.5731 11.5732 13.6170 13.6172 13.6229 13.6231 13.9746 13.9750 k = 0.3661 0.2114 0.1596 ( 3864 PWs) bands (ev): -38.9438 -38.9438 -38.9433 -38.9433 -18.0457 -18.0453 -18.0126 -18.0121 -17.5936 -17.5932 -17.5493 -17.5488 -17.3949 -17.3944 -17.3876 -17.3871 -8.6986 -8.6980 -8.6903 -8.6897 0.0240 0.0242 0.0288 0.0290 4.0519 4.0522 4.0544 4.0547 4.8851 4.8854 4.8904 4.8908 5.9361 5.9365 5.9365 5.9370 6.0368 6.0370 6.0402 6.0404 8.5786 8.5787 8.5850 8.5852 8.8411 8.8413 8.8416 8.8418 11.5452 11.5454 11.5456 11.5458 13.6492 13.6494 13.6548 13.6550 14.0018 14.0023 k = 0.3750 0.2165 0.1596 ( 3864 PWs) bands (ev): -38.9428 -38.9428 -38.9423 -38.9423 -18.0495 -18.0490 -18.0182 -18.0178 -17.5948 -17.5943 -17.5532 -17.5528 -17.3957 -17.3952 -17.3889 -17.3885 -8.6927 -8.6921 -8.6848 -8.6842 0.0781 0.0783 0.0827 0.0829 4.0294 4.0297 4.0317 4.0320 4.8579 4.8583 4.8628 4.8631 5.9330 5.9335 5.9336 5.9340 5.9896 5.9898 5.9927 5.9929 8.5800 8.5802 8.5862 8.5863 8.8252 8.8254 8.8257 8.8259 11.5193 11.5194 11.5197 11.5199 13.6808 13.6811 13.6861 13.6864 14.0279 14.0284 k = 0.3839 0.2217 0.1596 ( 3862 PWs) bands (ev): -38.9418 -38.9418 -38.9413 -38.9413 -18.0530 -18.0525 -18.0238 -18.0233 -17.5957 -17.5953 -17.5570 -17.5565 -17.3963 -17.3958 -17.3902 -17.3897 -8.6870 -8.6865 -8.6796 -8.6791 0.1310 0.1313 0.1355 0.1357 4.0029 4.0032 4.0050 4.0053 4.8350 4.8353 4.8393 4.8397 5.9285 5.9290 5.9297 5.9301 5.9474 5.9476 5.9497 5.9499 8.5820 8.5822 8.5879 8.5880 8.8104 8.8106 8.8108 8.8111 11.4949 11.4951 11.4954 11.4955 13.7119 13.7121 13.7169 13.7171 14.0529 14.0535 k = 0.3929 0.2268 0.1596 ( 3870 PWs) bands (ev): -38.9409 -38.9409 -38.9404 -38.9404 -18.0563 -18.0558 -18.0292 -18.0287 -17.5965 -17.5960 -17.5606 -17.5602 -17.3969 -17.3964 -17.3913 -17.3909 -8.6818 -8.6812 -8.6749 -8.6743 0.1826 0.1828 0.1868 0.1870 3.9728 3.9730 3.9747 3.9749 4.8163 4.8167 4.8202 4.8205 5.9026 5.9028 5.9058 5.9060 5.9300 5.9300 5.9305 5.9305 8.5845 8.5846 8.5900 8.5902 8.7967 8.7970 8.7971 8.7974 11.4722 11.4723 11.4726 11.4727 13.7421 13.7423 13.7468 13.7470 14.0764 14.0770 k = 0.4018 0.2320 0.1596 ( 3866 PWs) bands (ev): -38.9401 -38.9401 -38.9396 -38.9396 -18.0593 -18.0589 -18.0344 -18.0339 -17.5970 -17.5965 -17.5640 -17.5636 -17.3974 -17.3969 -17.3924 -17.3919 -8.6769 -8.6763 -8.6705 -8.6699 0.2323 0.2325 0.2363 0.2365 3.9398 3.9401 3.9415 3.9417 4.8019 4.8022 4.8052 4.8056 5.8660 5.8662 5.8688 5.8690 5.9266 5.9268 5.9271 5.9272 8.5873 8.5875 8.5926 8.5927 8.7842 8.7845 8.7846 8.7848 11.4511 11.4512 11.4515 11.4516 13.7713 13.7715 13.7757 13.7759 14.0987 14.0993 k = 0.4107 0.2371 0.1596 ( 3862 PWs) bands (ev): -38.9393 -38.9393 -38.9388 -38.9388 -18.0621 -18.0616 -18.0393 -18.0389 -17.5973 -17.5968 -17.5673 -17.5668 -17.3978 -17.3973 -17.3933 -17.3928 -8.6723 -8.6717 -8.6664 -8.6659 0.2798 0.2801 0.2835 0.2838 3.9049 3.9051 3.9063 3.9066 4.7913 4.7916 4.7942 4.7945 5.8317 5.8319 5.8343 5.8345 5.9240 5.9242 5.9245 5.9247 8.5905 8.5906 8.5953 8.5955 8.7728 8.7731 8.7731 8.7734 11.4317 11.4318 11.4321 11.4322 13.7993 13.7996 13.8034 13.8036 14.1194 14.1202 k = 0.4196 0.2423 0.1596 ( 3866 PWs) bands (ev): -38.9386 -38.9386 -38.9381 -38.9381 -18.0646 -18.0641 -18.0440 -18.0436 -17.5974 -17.5970 -17.5704 -17.5699 -17.3981 -17.3977 -17.3941 -17.3937 -8.6682 -8.6676 -8.6628 -8.6622 0.3248 0.3250 0.3282 0.3285 3.8690 3.8693 3.8703 3.8705 4.7841 4.7844 4.7865 4.7869 5.8003 5.8005 5.8026 5.8028 5.9217 5.9219 5.9222 5.9223 8.5938 8.5940 8.5983 8.5984 8.7626 8.7628 8.7628 8.7630 11.4140 11.4141 11.4144 11.4145 13.8259 13.8262 13.8297 13.8299 14.1387 14.1392 k = 0.4286 0.2474 0.1596 ( 3858 PWs) bands (ev): -38.9379 -38.9379 -38.9374 -38.9374 -18.0667 -18.0663 -18.0484 -18.0479 -17.5973 -17.5969 -17.5733 -17.5728 -17.3984 -17.3979 -17.3949 -17.3944 -8.6644 -8.6638 -8.6596 -8.6590 0.3667 0.3670 0.3698 0.3701 3.8334 3.8336 3.8345 3.8347 4.7797 4.7800 4.7818 4.7822 5.7718 5.7720 5.7739 5.7741 5.9196 5.9198 5.9201 5.9202 8.5973 8.5974 8.6013 8.6014 8.7534 8.7536 8.7536 8.7538 11.3981 11.3982 11.3985 11.3986 13.8509 13.8511 13.8543 13.8545 14.1563 14.1569 k = 0.4375 0.2526 0.1596 ( 3860 PWs) bands (ev): -38.9373 -38.9373 -38.9368 -38.9368 -18.0685 -18.0681 -18.0525 -18.0520 -17.5971 -17.5966 -17.5760 -17.5756 -17.3986 -17.3981 -17.3956 -17.3951 -8.6610 -8.6604 -8.6568 -8.6562 0.4051 0.4054 0.4079 0.4082 3.7989 3.7991 3.7998 3.8001 4.7775 4.7779 4.7793 4.7796 5.7462 5.7465 5.7480 5.7483 5.9178 5.9179 5.9182 5.9184 8.6006 8.6008 8.6042 8.6043 8.7453 8.7455 8.7455 8.7457 11.3840 11.3841 11.3843 11.3844 13.8739 13.8742 13.8770 13.8772 14.1718 14.1725 k = 0.4464 0.2577 0.1596 ( 3858 PWs) bands (ev): -38.9368 -38.9368 -38.9363 -38.9363 -18.0700 -18.0695 -18.0562 -18.0557 -17.5966 -17.5962 -17.5786 -17.5782 -17.3987 -17.3982 -17.3962 -17.3957 -8.6580 -8.6574 -8.6544 -8.6538 0.4397 0.4399 0.4421 0.4424 3.7668 3.7670 3.7676 3.7678 4.7770 4.7774 4.7785 4.7788 5.7237 5.7239 5.7253 5.7255 5.9161 5.9162 5.9166 5.9167 8.6039 8.6040 8.6070 8.6071 8.7383 8.7385 8.7386 8.7387 11.3717 11.3718 11.3720 11.3721 13.8948 13.8950 13.8974 13.8977 14.1858 14.1862 k = 0.4554 0.2629 0.1596 ( 3862 PWs) bands (ev): -38.9364 -38.9364 -38.9359 -38.9359 -18.0711 -18.0706 -18.0596 -18.0591 -17.5961 -17.5956 -17.5810 -17.5806 -17.3988 -17.3983 -17.3967 -17.3962 -8.6554 -8.6548 -8.6524 -8.6518 0.4698 0.4701 0.4719 0.4722 3.7379 3.7381 3.7385 3.7387 4.7776 4.7780 4.7788 4.7791 5.7043 5.7046 5.7056 5.7058 5.9147 5.9148 5.9151 5.9152 8.6069 8.6070 8.6095 8.6096 8.7324 8.7325 8.7327 8.7328 11.3613 11.3614 11.3615 11.3616 13.9132 13.9134 13.9154 13.9156 14.1976 14.1980 k = 0.4643 0.2681 0.1596 ( 3866 PWs) bands (ev): -38.9360 -38.9360 -38.9355 -38.9355 -18.0718 -18.0713 -18.0625 -18.0621 -17.5953 -17.5949 -17.5833 -17.5828 -17.3988 -17.3984 -17.3972 -17.3967 -8.6533 -8.6527 -8.6508 -8.6502 0.4952 0.4955 0.4969 0.4972 3.7130 3.7132 3.7135 3.7137 4.7788 4.7792 4.7797 4.7801 5.6882 5.6885 5.6893 5.6895 5.9135 5.9136 5.9140 5.9140 8.6095 8.6096 8.6116 8.6117 8.7276 8.7277 8.7278 8.7279 11.3527 11.3528 11.3529 11.3530 13.9288 13.9290 13.9306 13.9308 14.2074 14.2078 k = 0.4732 0.2732 0.1596 ( 3862 PWs) bands (ev): -38.9358 -38.9358 -38.9353 -38.9353 -18.0720 -18.0716 -18.0651 -18.0647 -17.5944 -17.5939 -17.5853 -17.5849 -17.3988 -17.3983 -17.3976 -17.3971 -8.6515 -8.6509 -8.6496 -8.6491 0.5155 0.5158 0.5168 0.5170 3.6929 3.6931 3.6933 3.6935 4.7802 4.7806 4.7809 4.7813 5.6756 5.6758 5.6764 5.6766 5.9126 5.9126 5.9130 5.9131 8.6117 8.6118 8.6133 8.6134 8.7239 8.7239 8.7241 8.7242 11.3460 11.3462 11.3462 11.3463 13.9413 13.9415 13.9427 13.9429 14.2152 14.2156 k = 0.4821 0.2784 0.1596 ( 3856 PWs) bands (ev): -38.9356 -38.9356 -38.9351 -38.9351 -18.0719 -18.0714 -18.0673 -18.0668 -17.5932 -17.5928 -17.5872 -17.5868 -17.3987 -17.3983 -17.3979 -17.3974 -8.6501 -8.6495 -8.6489 -8.6483 0.5303 0.5305 0.5311 0.5314 3.6782 3.6784 3.6784 3.6786 4.7816 4.7819 4.7820 4.7824 5.6665 5.6667 5.6670 5.6672 5.9119 5.9120 5.9124 5.9124 8.6134 8.6136 8.6145 8.6146 8.7212 8.7213 8.7215 8.7215 11.3413 11.3414 11.3414 11.3415 13.9506 13.9508 13.9515 13.9517 14.2208 14.2210 k = 0.4911 0.2835 0.1596 ( 3852 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0714 -18.0709 -18.0691 -18.0686 -17.5920 -17.5915 -17.5890 -17.5885 -17.3986 -17.3982 -17.3981 -17.3977 -8.6492 -8.6486 -8.6486 -8.6480 0.5393 0.5396 0.5398 0.5400 3.6692 3.6693 3.6694 3.6695 4.7825 4.7827 4.7829 4.7831 5.6610 5.6612 5.6613 5.6615 5.9115 5.9116 5.9120 5.9120 8.6146 8.6147 8.6151 8.6152 8.7196 8.7197 8.7199 8.7199 11.3384 11.3385 11.3385 11.3386 13.9563 13.9565 13.9568 13.9570 14.2242 14.2243 k = 0.5000 0.2887 0.1596 ( 3856 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0704 -18.0704 -18.0700 -18.0700 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3980 -17.3980 -8.6487 -8.6487 -8.6481 -8.6481 0.5425 0.5425 0.5428 0.5428 3.6662 3.6662 3.6664 3.6664 4.7829 4.7829 4.7833 4.7833 5.6593 5.6593 5.6595 5.6595 5.9114 5.9114 5.9119 5.9119 8.6151 8.6151 8.6153 8.6153 8.7191 8.7191 8.7193 8.7193 11.3375 11.3375 11.3376 11.3376 13.9584 13.9584 13.9586 13.9586 14.2253 14.2255 k = 0.5000 0.2887 0.1596 ( 3856 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0704 -18.0704 -18.0700 -18.0700 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3980 -17.3980 -8.6487 -8.6487 -8.6481 -8.6481 0.5425 0.5425 0.5428 0.5428 3.6662 3.6662 3.6664 3.6664 4.7829 4.7829 4.7833 4.7833 5.6593 5.6593 5.6595 5.6595 5.9114 5.9114 5.9119 5.9119 8.6151 8.6151 8.6153 8.6153 8.7191 8.7191 8.7193 8.7193 11.3375 11.3375 11.3376 11.3376 13.9584 13.9584 13.9586 13.9586 14.2252 14.2254 k = 0.4949 0.2974 0.1596 ( 3852 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0718 -18.0713 -18.0690 -18.0685 -17.5917 -17.5912 -17.5894 -17.5889 -17.3992 -17.3987 -17.3981 -17.3976 -8.6489 -8.6483 -8.6482 -8.6476 0.5430 0.5431 0.5433 0.5434 3.6670 3.6671 3.6673 3.6674 4.7829 4.7829 4.7833 4.7833 5.6579 5.6581 5.6595 5.6598 5.9105 5.9110 5.9127 5.9132 8.6082 8.6083 8.6137 8.6138 8.7143 8.7145 8.7198 8.7201 11.3424 11.3425 11.3427 11.3428 13.9561 13.9562 13.9575 13.9575 14.2237 14.2239 k = 0.4899 0.3062 0.1596 ( 3860 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0730 -18.0725 -18.0674 -18.0669 -17.5928 -17.5924 -17.5882 -17.5878 -17.4003 -17.3999 -17.3982 -17.3977 -8.6490 -8.6484 -8.6476 -8.6470 0.5446 0.5448 0.5449 0.5451 3.6695 3.6697 3.6701 3.6703 4.7829 4.7830 4.7834 4.7835 5.6555 5.6557 5.6587 5.6589 5.9101 5.9105 5.9144 5.9149 8.5925 8.5926 8.6025 8.6026 8.7070 8.7072 8.7170 8.7172 11.3573 11.3574 11.3578 11.3579 13.9506 13.9506 13.9532 13.9532 14.2200 14.2206 k = 0.4848 0.3149 0.1596 ( 3862 PWs) bands (ev): -38.9353 -38.9353 -38.9348 -38.9348 -18.0741 -18.0736 -18.0657 -18.0652 -17.5939 -17.5934 -17.5870 -17.5865 -17.4019 -17.4014 -17.3986 -17.3982 -8.6490 -8.6484 -8.6468 -8.6462 0.5472 0.5475 0.5477 0.5479 3.6739 3.6741 3.6748 3.6750 4.7829 4.7830 4.7836 4.7837 5.6520 5.6523 5.6567 5.6569 5.9102 5.9106 5.9165 5.9170 8.5667 8.5669 8.5792 8.5793 8.7001 8.7002 8.7125 8.7127 11.3816 11.3817 11.3823 11.3824 13.9418 13.9418 13.9456 13.9457 14.2145 14.2167 k = 0.4798 0.3237 0.1596 ( 3860 PWs) bands (ev): -38.9352 -38.9352 -38.9347 -38.9347 -18.0750 -18.0745 -18.0638 -18.0634 -17.5950 -17.5945 -17.5857 -17.5852 -17.4038 -17.4033 -17.3995 -17.3990 -8.6487 -8.6481 -8.6458 -8.6453 0.5510 0.5513 0.5516 0.5518 3.6800 3.6802 3.6812 3.6814 4.7830 4.7831 4.7838 4.7840 5.6476 5.6478 5.6536 5.6538 5.9108 5.9112 5.9190 5.9194 8.5300 8.5301 8.5428 8.5430 8.6953 8.6954 8.7081 8.7083 11.4146 11.4148 11.4155 11.4156 13.9301 13.9302 13.9350 13.9351 14.2074 14.2087 k = 0.4747 0.3324 0.1596 ( 3860 PWs) bands (ev): -38.9351 -38.9351 -38.9346 -38.9346 -18.0758 -18.0754 -18.0619 -18.0614 -17.5960 -17.5956 -17.5843 -17.5839 -17.4060 -17.4055 -17.4008 -17.4003 -8.6483 -8.6477 -8.6447 -8.6441 0.5558 0.5561 0.5566 0.5568 3.6879 3.6881 3.6894 3.6896 4.7831 4.7832 4.7841 4.7843 5.6422 5.6424 5.6494 5.6496 5.9119 5.9124 5.9218 5.9222 8.4824 8.4825 8.4944 8.4946 8.6926 8.6928 8.7046 8.7047 11.4555 11.4556 11.4565 11.4566 13.9157 13.9157 13.9216 13.9216 14.1989 14.1998 k = 0.4697 0.3412 0.1596 ( 3856 PWs) bands (ev): -38.9350 -38.9350 -38.9345 -38.9345 -18.0766 -18.0761 -18.0598 -18.0594 -17.5971 -17.5966 -17.5829 -17.5825 -17.4086 -17.4081 -17.4025 -17.4020 -8.6477 -8.6471 -8.6434 -8.6428 0.5617 0.5620 0.5626 0.5629 3.6975 3.6977 3.6993 3.6995 4.7833 4.7834 4.7845 4.7846 5.6359 5.6361 5.6440 5.6442 5.9137 5.9141 5.9250 5.9254 8.4249 8.4251 8.4357 8.4359 8.6915 8.6916 8.7021 8.7022 11.5030 11.5031 11.5042 11.5043 13.8989 13.8989 13.9056 13.9056 14.1892 14.1895 k = 0.4646 0.3499 0.1596 ( 3858 PWs) bands (ev): -38.9348 -38.9348 -38.9343 -38.9343 -18.0772 -18.0767 -18.0577 -18.0572 -17.5982 -17.5977 -17.5815 -17.5810 -17.4115 -17.4110 -17.4045 -17.4041 -8.6469 -8.6463 -8.6420 -8.6414 0.5686 0.5689 0.5696 0.5699 3.7088 3.7090 3.7109 3.7111 4.7835 4.7836 4.7849 4.7850 5.6287 5.6289 5.6375 5.6377 5.9159 5.9163 5.9284 5.9288 8.3590 8.3592 8.3686 8.3688 8.6912 8.6913 8.7003 8.7005 11.5563 11.5564 11.5575 11.5576 13.8800 13.8800 13.8873 13.8873 14.1783 14.1792 k = 0.4596 0.3587 0.1596 ( 3866 PWs) bands (ev): -38.9346 -38.9346 -38.9341 -38.9341 -18.0777 -18.0772 -18.0554 -18.0549 -17.5993 -17.5988 -17.5800 -17.5795 -17.4147 -17.4142 -17.4070 -17.4065 -8.6460 -8.6454 -8.6404 -8.6399 0.5765 0.5768 0.5777 0.5779 3.7217 3.7219 3.7241 3.7243 4.7836 4.7838 4.7852 4.7854 5.6206 5.6208 5.6299 5.6301 5.9187 5.9191 5.9321 5.9325 8.2861 8.2862 8.2946 8.2948 8.6913 8.6915 8.6992 8.6993 11.6143 11.6144 11.6156 11.6157 13.8593 13.8593 13.8671 13.8671 14.1662 14.1671 k = 0.4545 0.3674 0.1596 ( 3860 PWs) bands (ev): -38.9344 -38.9344 -38.9339 -38.9339 -18.0781 -18.0776 -18.0530 -18.0526 -17.6004 -17.6000 -17.5784 -17.5779 -17.4180 -17.4176 -17.4097 -17.4092 -8.6449 -8.6444 -8.6387 -8.6382 0.5854 0.5857 0.5867 0.5869 3.7361 3.7363 3.7388 3.7390 4.7838 4.7839 4.7856 4.7857 5.6117 5.6119 5.6214 5.6216 5.9220 5.9224 5.9362 5.9365 8.2074 8.2076 8.2150 8.2152 8.6917 8.6918 8.6985 8.6986 11.6762 11.6763 11.6774 11.6775 13.8372 13.8373 13.8455 13.8455 14.1531 14.1542 k = 0.4495 0.3762 0.1596 ( 3864 PWs) bands (ev): -38.9342 -38.9342 -38.9337 -38.9337 -18.0784 -18.0780 -18.0506 -18.0501 -17.6016 -17.6011 -17.5768 -17.5763 -17.4217 -17.4212 -17.4128 -17.4123 -8.6438 -8.6432 -8.6369 -8.6364 0.5952 0.5955 0.5966 0.5969 3.7520 3.7522 3.7550 3.7552 4.7839 4.7841 4.7859 4.7861 5.6020 5.6022 5.6119 5.6121 5.9257 5.9261 5.9404 5.9408 8.1241 8.1243 8.1311 8.1313 8.6922 8.6923 8.6979 8.6980 11.7410 11.7411 11.7422 11.7423 13.8141 13.8141 13.8226 13.8226 14.1388 14.1392 k = 0.4444 0.3849 0.1596 ( 3856 PWs) bands (ev): -38.9340 -38.9340 -38.9335 -38.9335 -18.0786 -18.0782 -18.0481 -18.0476 -17.6028 -17.6024 -17.5751 -17.5746 -17.4254 -17.4249 -17.4162 -17.4157 -8.6425 -8.6419 -8.6350 -8.6344 0.6058 0.6061 0.6074 0.6076 3.7693 3.7695 3.7726 3.7728 4.7840 4.7842 4.7863 4.7864 5.5917 5.5919 5.6016 5.6018 5.9298 5.9302 5.9448 5.9451 8.0375 8.0377 8.0441 8.0442 8.6926 8.6926 8.6975 8.6976 11.8081 11.8082 11.8093 11.8094 13.7902 13.7902 13.7989 13.7990 14.1237 14.1247 k = 0.4394 0.3936 0.1596 ( 3862 PWs) bands (ev): -38.9337 -38.9337 -38.9332 -38.9332 -18.0788 -18.0784 -18.0455 -18.0451 -17.6041 -17.6037 -17.5733 -17.5729 -17.4293 -17.4289 -17.4198 -17.4193 -8.6411 -8.6405 -8.6330 -8.6325 0.6173 0.6176 0.6190 0.6192 3.7878 3.7880 3.7914 3.7916 4.7841 4.7842 4.7865 4.7866 5.5807 5.5809 5.5906 5.5908 5.9342 5.9345 5.9493 5.9496 7.9485 7.9486 7.9547 7.9549 8.6928 8.6928 8.6970 8.6971 11.8769 11.8770 11.8781 11.8782 13.7658 13.7659 13.7747 13.7747 14.1067 14.1073 k = 0.4343 0.4024 0.1596 ( 3866 PWs) bands (ev): -38.9335 -38.9335 -38.9330 -38.9330 -18.0789 -18.0785 -18.0430 -18.0425 -17.6055 -17.6050 -17.5715 -17.5711 -17.4333 -17.4329 -17.4237 -17.4232 -8.6396 -8.6390 -8.6310 -8.6304 0.6295 0.6298 0.6313 0.6316 3.8075 3.8077 3.8114 3.8116 4.7840 4.7842 4.7866 4.7868 5.5692 5.5694 5.5790 5.5792 5.9388 5.9391 5.9538 5.9542 7.8579 7.8581 7.8640 7.8642 8.6928 8.6928 8.6965 8.6965 11.9469 11.9470 11.9480 11.9481 13.7412 13.7412 13.7501 13.7501 14.0887 14.0890 k = 0.4293 0.4111 0.1596 ( 3870 PWs) bands (ev): -38.9332 -38.9332 -38.9327 -38.9327 -18.0790 -18.0785 -18.0403 -18.0399 -17.6069 -17.6065 -17.5696 -17.5692 -17.4374 -17.4369 -17.4278 -17.4273 -8.6380 -8.6374 -8.6289 -8.6283 0.6425 0.6427 0.6443 0.6446 3.8282 3.8284 3.8325 3.8327 4.7838 4.7840 4.7866 4.7868 5.5571 5.5574 5.5669 5.5671 5.9435 5.9438 5.9584 5.9587 7.7668 7.7670 7.7728 7.7730 8.6925 8.6925 8.6958 8.6958 12.0176 12.0177 12.0187 12.0188 13.7164 13.7165 13.7253 13.7254 14.0693 14.0704 k = 0.4242 0.4199 0.1596 ( 3864 PWs) bands (ev): -38.9329 -38.9329 -38.9324 -38.9324 -18.0790 -18.0785 -18.0377 -18.0372 -17.6085 -17.6080 -17.5677 -17.5673 -17.4414 -17.4410 -17.4320 -17.4316 -8.6364 -8.6358 -8.6267 -8.6261 0.6560 0.6563 0.6580 0.6583 3.8498 3.8501 3.8544 3.8546 4.7834 4.7836 4.7865 4.7867 5.5447 5.5449 5.5544 5.5546 5.9481 5.9484 5.9628 5.9631 7.6759 7.6761 7.6819 7.6821 8.6920 8.6920 8.6950 8.6950 12.0888 12.0889 12.0899 12.0900 13.6917 13.6917 13.7006 13.7006 14.0484 14.0496 k = 0.4192 0.4286 0.1596 ( 3864 PWs) bands (ev): -38.9326 -38.9326 -38.9321 -38.9321 -18.0790 -18.0785 -18.0351 -18.0346 -17.6101 -17.6096 -17.5657 -17.5653 -17.4455 -17.4450 -17.4364 -17.4359 -8.6347 -8.6341 -8.6245 -8.6240 0.6701 0.6704 0.6722 0.6724 3.8722 3.8724 3.8771 3.8773 4.7829 4.7831 4.7861 4.7863 5.5320 5.5322 5.5417 5.5419 5.9526 5.9529 5.9669 5.9672 7.5859 7.5861 7.5920 7.5922 8.6912 8.6912 8.6940 8.6940 12.1602 12.1603 12.1612 12.1614 13.6671 13.6671 13.6759 13.6759 14.0264 14.0274 k = 0.4141 0.4374 0.1596 ( 3860 PWs) bands (ev): -38.9323 -38.9323 -38.9318 -38.9318 -18.0789 -18.0784 -18.0325 -18.0320 -17.6118 -17.6113 -17.5637 -17.5632 -17.4495 -17.4490 -17.4408 -17.4403 -8.6329 -8.6324 -8.6224 -8.6218 0.6846 0.6849 0.6868 0.6871 3.8952 3.8954 3.9004 3.9006 4.7822 4.7824 4.7855 4.7858 5.5191 5.5193 5.5288 5.5290 5.9568 5.9571 5.9707 5.9710 7.4977 7.4978 7.5038 7.5040 8.6900 8.6901 8.6927 8.6928 12.2314 12.2316 12.2326 12.2327 13.6427 13.6427 13.6514 13.6514 14.0019 14.0022 k = 0.4091 0.4461 0.1596 ( 3866 PWs) bands (ev): -38.9321 -38.9321 -38.9316 -38.9316 -18.0788 -18.0784 -18.0300 -18.0295 -17.6136 -17.6131 -17.5616 -17.5612 -17.4535 -17.4530 -17.4452 -17.4448 -8.6312 -8.6306 -8.6202 -8.6196 0.6995 0.6998 0.7018 0.7020 3.9185 3.9187 3.9241 3.9243 4.7812 4.7814 4.7847 4.7849 5.5060 5.5062 5.5159 5.5161 5.9606 5.9609 5.9740 5.9743 7.4118 7.4120 7.4181 7.4182 8.6886 8.6887 8.6913 8.6913 12.3024 12.3026 12.3037 12.3038 13.6185 13.6185 13.6270 13.6271 13.9763 13.9767 k = 0.4040 0.4549 0.1596 ( 3862 PWs) bands (ev): -38.9318 -38.9318 -38.9313 -38.9313 -18.0787 -18.0783 -18.0275 -18.0270 -17.6155 -17.6150 -17.5595 -17.5590 -17.4574 -17.4569 -17.4496 -17.4491 -8.6294 -8.6289 -8.6180 -8.6175 0.7147 0.7149 0.7170 0.7173 3.9421 3.9423 3.9479 3.9482 4.7799 4.7801 4.7835 4.7837 5.4929 5.4931 5.5031 5.5033 5.9639 5.9641 5.9767 5.9770 7.3291 7.3292 7.3354 7.3355 8.6870 8.6871 8.6897 8.6897 12.3730 12.3732 12.3745 12.3746 13.5945 13.5945 13.6029 13.6029 13.9495 13.9513 k = 0.3990 0.4636 0.1596 ( 3874 PWs) bands (ev): -38.9315 -38.9315 -38.9310 -38.9310 -18.0787 -18.0782 -18.0251 -18.0247 -17.6174 -17.6170 -17.5573 -17.5569 -17.4613 -17.4609 -17.4538 -17.4533 -8.6277 -8.6271 -8.6159 -8.6154 0.7299 0.7302 0.7323 0.7326 3.9655 3.9658 3.9717 3.9720 4.7782 4.7784 4.7819 4.7822 5.4800 5.4802 5.4904 5.4906 5.9665 5.9667 5.9787 5.9790 7.2500 7.2501 7.2564 7.2565 8.6852 8.6853 8.6878 8.6879 12.4431 12.4432 12.4447 12.4449 13.5708 13.5708 13.5790 13.5790 13.9208 13.9224 k = 0.3939 0.4724 0.1596 ( 3874 PWs) bands (ev): -38.9312 -38.9312 -38.9307 -38.9307 -18.0786 -18.0781 -18.0229 -18.0224 -17.6194 -17.6190 -17.5551 -17.5547 -17.4653 -17.4648 -17.4577 -17.4572 -8.6260 -8.6255 -8.6139 -8.6133 0.7451 0.7454 0.7476 0.7479 3.9888 3.9890 3.9953 3.9955 4.7762 4.7765 4.7800 4.7803 5.4673 5.4675 5.4781 5.4784 5.9683 5.9685 5.9799 5.9802 7.1752 7.1753 7.1816 7.1818 8.6833 8.6834 8.6859 8.6860 12.5124 12.5126 12.5144 12.5145 13.5474 13.5474 13.5553 13.5554 13.8910 13.8914 k = 0.3889 0.4811 0.1596 ( 3880 PWs) bands (ev): -38.9309 -38.9309 -38.9304 -38.9304 -18.0785 -18.0781 -18.0207 -18.0203 -17.6215 -17.6210 -17.5529 -17.5524 -17.4693 -17.4689 -17.4612 -17.4607 -8.6244 -8.6238 -8.6120 -8.6114 0.7602 0.7605 0.7628 0.7630 4.0114 4.0117 4.0183 4.0185 4.7739 4.7741 4.7777 4.7779 5.4549 5.4552 5.4663 5.4665 5.9692 5.9694 5.9802 5.9804 7.1053 7.1055 7.1118 7.1119 8.6813 8.6814 8.6839 8.6840 12.5810 12.5811 12.5833 12.5834 13.5243 13.5243 13.5320 13.5321 13.8599 13.8611 k = 0.3838 0.4899 0.1596 ( 3876 PWs) bands (ev): -38.9306 -38.9306 -38.9301 -38.9301 -18.0784 -18.0780 -18.0187 -18.0182 -17.6234 -17.6230 -17.5506 -17.5502 -17.4734 -17.4730 -17.4643 -17.4638 -8.6228 -8.6222 -8.6101 -8.6095 0.7750 0.7753 0.7776 0.7779 4.0333 4.0335 4.0405 4.0407 4.7712 4.7715 4.7749 4.7752 5.4432 5.4434 5.4550 5.4553 5.9692 5.9694 5.9795 5.9797 7.0409 7.0411 7.0473 7.0474 8.6792 8.6793 8.6818 8.6819 12.6485 12.6487 12.6512 12.6514 13.5016 13.5016 13.5091 13.5092 13.8278 13.8299 k = 0.3788 0.4986 0.1596 ( 3868 PWs) bands (ev): -38.9304 -38.9304 -38.9299 -38.9299 -18.0784 -18.0779 -18.0169 -18.0164 -17.6254 -17.6249 -17.5484 -17.5479 -17.4775 -17.4770 -17.4669 -17.4665 -8.6213 -8.6207 -8.6083 -8.6077 0.7894 0.7897 0.7920 0.7923 4.0540 4.0542 4.0616 4.0618 4.7682 4.7685 4.7718 4.7721 5.4321 5.4323 5.4445 5.4447 5.9682 5.9684 5.9778 5.9780 6.9824 6.9826 6.9886 6.9888 8.6772 8.6773 8.6798 8.6798 12.7148 12.7150 12.7180 12.7181 13.4795 13.4796 13.4868 13.4868 13.7947 13.7989 k = 0.3737 0.5074 0.1596 ( 3864 PWs) bands (ev): -38.9301 -38.9301 -38.9296 -38.9296 -18.0784 -18.0779 -18.0152 -18.0147 -17.6273 -17.6268 -17.5461 -17.5457 -17.4815 -17.4811 -17.4692 -17.4688 -8.6199 -8.6193 -8.6067 -8.6061 0.8031 0.8034 0.8058 0.8061 4.0733 4.0736 4.0812 4.0815 4.7649 4.7652 4.7684 4.7687 5.4218 5.4221 5.4347 5.4350 5.9663 5.9665 5.9751 5.9753 6.9301 6.9303 6.9362 6.9363 8.6753 8.6754 8.6778 8.6779 12.7795 12.7797 12.7832 12.7834 13.4583 13.4583 13.4653 13.4654 13.7607 13.7617 k = 0.3687 0.5161 0.1596 ( 3864 PWs) bands (ev): -38.9299 -38.9299 -38.9294 -38.9294 -18.0784 -18.0779 -18.0137 -18.0133 -17.6291 -17.6286 -17.5439 -17.5434 -17.4854 -17.4850 -17.4712 -17.4707 -8.6186 -8.6180 -8.6052 -8.6046 0.8160 0.8163 0.8187 0.8190 4.0909 4.0912 4.0992 4.0994 4.7614 4.7617 4.7648 4.7651 5.4124 5.4127 5.4259 5.4262 5.9636 5.9638 5.9716 5.9718 6.8844 6.8845 6.8902 6.8903 8.6734 8.6735 8.6759 8.6760 12.8422 12.8423 12.8465 12.8467 13.4382 13.4383 13.4451 13.4452 13.7264 13.7274 k = 0.3636 0.5249 0.1596 ( 3868 PWs) bands (ev): -38.9297 -38.9297 -38.9292 -38.9292 -18.0784 -18.0779 -18.0125 -18.0120 -17.6307 -17.6303 -17.5418 -17.5413 -17.4892 -17.4887 -17.4728 -17.4724 -8.6174 -8.6168 -8.6039 -8.6033 0.8279 0.8282 0.8306 0.8309 4.1065 4.1067 4.1151 4.1153 4.7578 4.7581 4.7611 4.7614 5.4041 5.4044 5.4181 5.4184 5.9603 5.9605 5.9675 5.9677 6.8452 6.8453 6.8507 6.8509 8.6718 8.6719 8.6741 8.6742 12.9020 12.9021 12.9071 12.9073 13.4200 13.4201 13.4268 13.4269 13.6915 13.6926 k = 0.3586 0.5336 0.1596 ( 3868 PWs) bands (ev): -38.9296 -38.9296 -38.9291 -38.9291 -18.0784 -18.0780 -18.0114 -18.0109 -17.6322 -17.6317 -17.5398 -17.5393 -17.4925 -17.4921 -17.4741 -17.4737 -8.6164 -8.6158 -8.6027 -8.6021 0.8386 0.8389 0.8413 0.8416 4.1198 4.1200 4.1287 4.1289 4.7544 4.7547 4.7575 4.7578 5.3970 5.3973 5.4114 5.4117 5.9566 5.9568 5.9631 5.9632 6.8127 6.8128 6.8179 6.8181 8.6703 8.6704 8.6726 8.6726 12.9577 12.9579 12.9639 12.9640 13.4047 13.4047 13.4116 13.4116 13.6565 13.6575 k = 0.3535 0.5424 0.1596 ( 3872 PWs) bands (ev): -38.9294 -38.9294 -38.9289 -38.9289 -18.0785 -18.0780 -18.0105 -18.0101 -17.6335 -17.6330 -17.5379 -17.5374 -17.4956 -17.4951 -17.4752 -17.4747 -8.6155 -8.6150 -8.6018 -8.6012 0.8478 0.8481 0.8505 0.8508 4.1306 4.1309 4.1398 4.1401 4.7512 4.7515 4.7543 4.7546 5.3911 5.3914 5.4058 5.4062 5.9528 5.9530 5.9586 5.9588 6.7866 6.7868 6.7916 6.7918 8.6691 8.6692 8.6712 8.6713 13.0077 13.0079 13.0151 13.0152 13.3936 13.3936 13.4009 13.4009 13.6212 13.6248 k = 0.3485 0.5511 0.1596 ( 3868 PWs) bands (ev): -38.9293 -38.9293 -38.9288 -38.9288 -18.0785 -18.0781 -18.0099 -18.0094 -17.6345 -17.6340 -17.5363 -17.5359 -17.4981 -17.4976 -17.4759 -17.4755 -8.6148 -8.6143 -8.6010 -8.6004 0.8554 0.8556 0.8581 0.8584 4.1389 4.1392 4.1483 4.1486 4.7485 4.7488 4.7515 4.7518 5.3865 5.3868 5.4015 5.4019 5.9493 5.9495 5.9545 5.9547 6.7669 6.7671 6.7717 6.7719 8.6682 8.6683 8.6702 8.6702 13.0494 13.0495 13.0581 13.0582 13.3890 13.3890 13.3968 13.3969 13.5869 13.5872 k = 0.3434 0.5599 0.1596 ( 3868 PWs) bands (ev): -38.9292 -38.9292 -38.9287 -38.9287 -18.0786 -18.0781 -18.0094 -18.0090 -17.6352 -17.6347 -17.5351 -17.5346 -17.5000 -17.4996 -17.4765 -17.4760 -8.6143 -8.6138 -8.6004 -8.5998 0.8610 0.8613 0.8638 0.8640 4.1446 4.1449 4.1542 4.1545 4.7464 4.7467 4.7495 4.7498 5.3831 5.3835 5.3984 5.3988 5.9465 5.9466 5.9512 5.9514 6.7533 6.7534 6.7578 6.7580 8.6675 8.6676 8.6694 8.6695 13.0799 13.0800 13.0899 13.0899 13.3926 13.3927 13.4013 13.4014 13.5544 13.5545 k = 0.3384 0.5686 0.1596 ( 3872 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0092 -18.0087 -17.6356 -17.6352 -17.5343 -17.5338 -17.5012 -17.5008 -17.4768 -17.4764 -8.6140 -8.6134 -8.6001 -8.5995 0.8646 0.8649 0.8673 0.8676 4.1478 4.1481 4.1576 4.1578 4.7451 4.7454 4.7482 4.7485 5.3811 5.3815 5.3966 5.3969 5.9446 5.9447 5.9490 5.9492 6.7453 6.7455 6.7497 6.7499 8.6671 8.6672 8.6689 8.6690 13.0975 13.0975 13.1082 13.1083 13.4035 13.4036 13.4130 13.4131 13.5272 13.5276 k = 0.3333 0.5774 0.1596 ( 3876 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5012 -17.4769 -17.4765 -8.6139 -8.6133 -8.5999 -8.5994 0.8658 0.8661 0.8686 0.8688 4.1488 4.1491 4.1586 4.1588 4.7447 4.7450 4.7478 4.7481 5.3805 5.3808 5.3959 5.3963 5.9439 5.9440 5.9482 5.9484 6.7427 6.7429 6.7471 6.7473 8.6670 8.6670 8.6687 8.6688 13.1028 13.1029 13.1138 13.1138 13.4114 13.4115 13.4213 13.4214 13.5147 13.5148 k = 0.3333 0.5774 0.1596 ( 3876 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5012 -17.4769 -17.4765 -8.6139 -8.6133 -8.5999 -8.5994 0.8658 0.8661 0.8686 0.8688 4.1488 4.1491 4.1586 4.1588 4.7447 4.7450 4.7478 4.7481 5.3805 5.3808 5.3959 5.3963 5.9439 5.9440 5.9482 5.9484 6.7427 6.7429 6.7471 6.7473 8.6670 8.6670 8.6687 8.6688 13.1028 13.1029 13.1138 13.1138 13.4114 13.4115 13.4213 13.4214 13.5147 13.5151 k = 0.3282 0.5685 0.1596 ( 3874 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0092 -18.0087 -17.6357 -17.6352 -17.5343 -17.5338 -17.5012 -17.5008 -17.4768 -17.4764 -8.6140 -8.6134 -8.6001 -8.5995 0.8645 0.8647 0.8672 0.8675 4.1480 4.1482 4.1577 4.1579 4.7451 4.7454 4.7482 4.7485 5.3812 5.3815 5.3966 5.3969 5.9446 5.9448 5.9491 5.9493 6.7453 6.7455 6.7497 6.7499 8.6671 8.6672 8.6689 8.6690 13.0984 13.0985 13.1092 13.1093 13.4002 13.4003 13.4096 13.4097 13.5298 13.5303 k = 0.3231 0.5596 0.1596 ( 3870 PWs) bands (ev): -38.9292 -38.9292 -38.9287 -38.9287 -18.0786 -18.0781 -18.0094 -18.0089 -17.6352 -17.6347 -17.5350 -17.5345 -17.5000 -17.4996 -17.4765 -17.4761 -8.6144 -8.6138 -8.6004 -8.5999 0.8603 0.8606 0.8631 0.8633 4.1456 4.1459 4.1552 4.1554 4.7464 4.7467 4.7494 4.7497 5.3833 5.3836 5.3986 5.3989 5.9470 5.9472 5.9517 5.9519 6.7528 6.7530 6.7573 6.7575 8.6675 8.6676 8.6694 8.6695 13.0873 13.0874 13.0979 13.0979 13.3738 13.3739 13.3827 13.3828 13.5656 13.5698 k = 0.3179 0.5507 0.1596 ( 3862 PWs) bands (ev): -38.9293 -38.9293 -38.9288 -38.9288 -18.0784 -18.0779 -18.0097 -18.0092 -17.6344 -17.6339 -17.5360 -17.5355 -17.4983 -17.4979 -17.4760 -17.4756 -8.6150 -8.6144 -8.6011 -8.6005 0.8531 0.8534 0.8559 0.8562 4.1424 4.1426 4.1518 4.1520 4.7483 4.7486 4.7512 4.7515 5.3868 5.3872 5.4019 5.4022 5.9511 5.9513 5.9561 5.9562 6.7650 6.7651 6.7697 6.7698 8.6681 8.6682 8.6702 8.6703 13.0718 13.0719 13.0822 13.0823 13.3421 13.3422 13.3507 13.3508 13.6106 13.6144 k = 0.3128 0.5418 0.1596 ( 3866 PWs) bands (ev): -38.9295 -38.9295 -38.9290 -38.9290 -18.0782 -18.0777 -18.0101 -18.0096 -17.6333 -17.6328 -17.5372 -17.5367 -17.4961 -17.4956 -17.4754 -17.4750 -8.6158 -8.6152 -8.6020 -8.6014 0.8427 0.8430 0.8455 0.8458 4.1387 4.1390 4.1479 4.1482 4.7506 4.7509 4.7534 4.7537 5.3918 5.3922 5.4066 5.4070 5.9568 5.9570 5.9621 5.9623 6.7816 6.7817 6.7865 6.7866 8.6690 8.6691 8.6713 8.6714 13.0535 13.0536 13.0638 13.0639 13.3088 13.3089 13.3173 13.3174 13.6579 13.6583 k = 0.3077 0.5329 0.1596 ( 3862 PWs) bands (ev): -38.9297 -38.9297 -38.9292 -38.9292 -18.0779 -18.0774 -18.0105 -18.0101 -17.6319 -17.6314 -17.5384 -17.5379 -17.4935 -17.4931 -17.4746 -17.4742 -8.6169 -8.6163 -8.6032 -8.6026 0.8290 0.8293 0.8319 0.8321 4.1353 4.1355 4.1442 4.1445 4.7533 4.7536 4.7559 4.7562 5.3984 5.3988 5.4129 5.4132 5.9641 5.9643 5.9697 5.9698 6.8024 6.8026 6.8076 6.8077 8.6701 8.6701 8.6726 8.6727 13.0333 13.0334 13.0436 13.0437 13.2753 13.2754 13.2837 13.2839 13.7062 13.7078 k = 0.3026 0.5241 0.1596 ( 3866 PWs) bands (ev): -38.9299 -38.9299 -38.9294 -38.9294 -18.0774 -18.0770 -18.0110 -18.0105 -17.6303 -17.6298 -17.5396 -17.5392 -17.4907 -17.4902 -17.4737 -17.4732 -8.6183 -8.6178 -8.6047 -8.6041 0.8119 0.8122 0.8148 0.8151 4.1325 4.1327 4.1411 4.1414 4.7561 4.7564 4.7586 4.7589 5.4067 5.4070 5.4208 5.4211 5.9727 5.9729 5.9786 5.9787 6.8274 6.8275 6.8327 6.8329 8.6713 8.6714 8.6742 8.6743 13.0118 13.0120 13.0222 13.0223 13.2422 13.2423 13.2508 13.2509 13.7536 13.7539 k = 0.2974 0.5152 0.1596 ( 3858 PWs) bands (ev): -38.9302 -38.9302 -38.9297 -38.9297 -18.0769 -18.0764 -18.0114 -18.0109 -17.6284 -17.6279 -17.5407 -17.5403 -17.4876 -17.4871 -17.4726 -17.4722 -8.6200 -8.6194 -8.6064 -8.6059 0.7913 0.7916 0.7943 0.7946 4.1307 4.1309 4.1391 4.1393 4.7590 4.7593 4.7614 4.7617 5.4166 5.4170 5.4303 5.4307 5.9827 5.9829 5.9887 5.9889 6.8562 6.8563 6.8618 6.8619 8.6728 8.6729 8.6760 8.6761 12.9893 12.9895 12.9998 12.9999 13.2100 13.2102 13.2188 13.2189 13.7992 13.8006 k = 0.2923 0.5063 0.1596 ( 3854 PWs) bands (ev): -38.9305 -38.9305 -38.9300 -38.9300 -18.0761 -18.0757 -18.0117 -18.0112 -17.6263 -17.6258 -17.5418 -17.5413 -17.4843 -17.4839 -17.4714 -17.4709 -8.6219 -8.6214 -8.6085 -8.6079 0.7673 0.7675 0.7703 0.7706 4.1302 4.1305 4.1384 4.1386 4.7620 4.7623 4.7643 4.7646 5.4283 5.4287 5.4417 5.4420 5.9937 5.9939 5.9998 6.0000 6.8887 6.8889 6.8945 6.8947 8.6745 8.6746 8.6780 8.6781 12.9659 12.9661 12.9767 12.9768 13.1792 13.1793 13.1881 13.1882 13.8422 13.8435 k = 0.2872 0.4974 0.1596 ( 3866 PWs) bands (ev): -38.9309 -38.9309 -38.9304 -38.9304 -18.0753 -18.0749 -18.0120 -18.0115 -17.6240 -17.6235 -17.5427 -17.5422 -17.4810 -17.4805 -17.4700 -17.4696 -8.6242 -8.6236 -8.6109 -8.6103 0.7397 0.7400 0.7429 0.7432 4.1313 4.1315 4.1392 4.1394 4.7650 4.7653 4.7673 4.7676 5.4418 5.4421 5.4548 5.4551 6.0055 6.0057 6.0117 6.0119 6.9248 6.9250 6.9307 6.9309 8.6763 8.6764 8.6802 8.6803 12.9418 12.9420 12.9527 12.9529 13.1499 13.1500 13.1590 13.1591 13.8824 13.8835 k = 0.2821 0.4885 0.1596 ( 3864 PWs) bands (ev): -38.9314 -38.9314 -38.9309 -38.9309 -18.0743 -18.0738 -18.0121 -18.0116 -17.6216 -17.6211 -17.5433 -17.5429 -17.4775 -17.4770 -17.4685 -17.4680 -8.6267 -8.6262 -8.6135 -8.6129 0.7089 0.7091 0.7121 0.7124 4.1339 4.1341 4.1416 4.1418 4.7683 4.7685 4.7705 4.7708 5.4571 5.4574 5.4698 5.4701 6.0183 6.0185 6.0244 6.0246 6.9642 6.9644 6.9703 6.9704 8.6783 8.6784 8.6826 8.6827 12.9169 12.9171 12.9281 12.9282 13.1224 13.1225 13.1317 13.1318 13.9182 13.9193 k = 0.2769 0.4796 0.1596 ( 3872 PWs) bands (ev): -38.9319 -38.9319 -38.9314 -38.9314 -18.0731 -18.0726 -18.0121 -18.0116 -17.6190 -17.6186 -17.5438 -17.5434 -17.4740 -17.4735 -17.4668 -17.4663 -8.6296 -8.6290 -8.6165 -8.6159 0.6747 0.6750 0.6781 0.6784 4.1380 4.1383 4.1456 4.1458 4.7719 4.7722 4.7741 4.7744 5.4741 5.4744 5.4865 5.4869 6.0317 6.0319 6.0377 6.0379 7.0068 7.0069 7.0129 7.0131 8.6806 8.6807 8.6852 8.6853 12.8913 12.8915 12.9027 12.9029 13.0969 13.0970 13.1063 13.1065 13.9497 13.9513 k = 0.2718 0.4708 0.1596 ( 3878 PWs) bands (ev): -38.9325 -38.9325 -38.9320 -38.9320 -18.0717 -18.0713 -18.0119 -18.0114 -17.6164 -17.6160 -17.5441 -17.5437 -17.4705 -17.4700 -17.4649 -17.4644 -8.6328 -8.6322 -8.6198 -8.6192 0.6374 0.6377 0.6410 0.6413 4.1435 4.1437 4.1510 4.1512 4.7763 4.7765 4.7784 4.7786 5.4927 5.4931 5.5050 5.5053 6.0459 6.0461 6.0517 6.0519 7.0523 7.0524 7.0584 7.0586 8.6830 8.6831 8.6880 8.6881 12.8652 12.8654 12.8766 12.8768 13.0735 13.0736 13.0830 13.0832 13.9770 13.9794 k = 0.2667 0.4619 0.1596 ( 3878 PWs) bands (ev): -38.9331 -38.9331 -38.9326 -38.9326 -18.0701 -18.0697 -18.0114 -18.0110 -17.6137 -17.6133 -17.5442 -17.5437 -17.4671 -17.4667 -17.4626 -17.4621 -8.6362 -8.6356 -8.6233 -8.6227 0.5973 0.5975 0.6010 0.6013 4.1501 4.1503 4.1576 4.1578 4.7816 4.7818 4.7836 4.7839 5.5130 5.5133 5.5251 5.5254 6.0608 6.0610 6.0664 6.0666 7.1004 7.1006 7.1066 7.1067 8.6857 8.6858 8.6910 8.6911 12.8385 12.8387 12.8500 12.8502 13.0522 13.0524 13.0617 13.0619 14.0005 14.0013 k = 0.2615 0.4530 0.1596 ( 3882 PWs) bands (ev): -38.9337 -38.9337 -38.9332 -38.9332 -18.0684 -18.0679 -18.0108 -18.0103 -17.6110 -17.6106 -17.5440 -17.5435 -17.4641 -17.4636 -17.4598 -17.4593 -8.6400 -8.6394 -8.6272 -8.6266 0.5544 0.5546 0.5583 0.5585 4.1574 4.1577 4.1649 4.1652 4.7882 4.7884 4.7902 4.7904 5.5346 5.5349 5.5466 5.5469 6.0765 6.0768 6.0819 6.0821 7.1511 7.1512 7.1572 7.1573 8.6886 8.6887 8.6942 8.6943 12.8116 12.8118 12.8231 12.8233 13.0329 13.0331 13.0424 13.0426 14.0159 14.0204 k = 0.2564 0.4441 0.1596 ( 3876 PWs) bands (ev): -38.9344 -38.9344 -38.9340 -38.9339 -18.0664 -18.0659 -18.0098 -18.0094 -17.6084 -17.6079 -17.5435 -17.5431 -17.4613 -17.4609 -17.4565 -17.4560 -8.6440 -8.6435 -8.6314 -8.6308 0.5090 0.5093 0.5130 0.5133 4.1651 4.1654 4.1727 4.1730 4.7964 4.7967 4.7984 4.7987 5.5574 5.5577 5.5694 5.5697 6.0933 6.0935 6.0983 6.0986 7.2040 7.2041 7.2100 7.2101 8.6918 8.6919 8.6977 8.6979 12.7846 12.7848 12.7960 12.7962 13.0156 13.0157 13.0250 13.0252 14.0283 14.0313 k = 0.2513 0.4352 0.1596 ( 3868 PWs) bands (ev): -38.9352 -38.9352 -38.9347 -38.9347 -18.0642 -18.0637 -18.0086 -18.0082 -17.6057 -17.6052 -17.5428 -17.5423 -17.4588 -17.4584 -17.4528 -17.4523 -8.6484 -8.6478 -8.6358 -8.6352 0.4614 0.4616 0.4656 0.4658 4.1728 4.1731 4.1805 4.1808 4.8067 4.8069 4.8088 4.8091 5.5812 5.5815 5.5931 5.5935 6.1113 6.1115 6.1160 6.1162 7.2588 7.2589 7.2647 7.2648 8.6954 8.6955 8.7016 8.7017 12.7577 12.7579 12.7690 12.7692 13.0000 13.0001 13.0093 13.0095 14.0361 14.0412 k = 0.2462 0.4264 0.1596 ( 3864 PWs) bands (ev): -38.9360 -38.9360 -38.9355 -38.9355 -18.0618 -18.0613 -18.0072 -18.0067 -17.6031 -17.6027 -17.5418 -17.5413 -17.4563 -17.4559 -17.4489 -17.4484 -8.6531 -8.6525 -8.6406 -8.6400 0.4117 0.4119 0.4160 0.4163 4.1799 4.1802 4.1878 4.1881 4.8191 4.8194 4.8214 4.8218 5.6056 5.6060 5.6176 5.6179 6.1307 6.1309 6.1351 6.1353 7.3154 7.3155 7.3211 7.3212 8.6993 8.6995 8.7058 8.7059 12.7312 12.7314 12.7424 12.7426 12.9859 12.9860 12.9952 12.9953 14.0398 14.0435 k = 0.2410 0.4175 0.1596 ( 3868 PWs) bands (ev): -38.9369 -38.9369 -38.9364 -38.9364 -18.0592 -18.0587 -18.0054 -18.0050 -17.6006 -17.6002 -17.5405 -17.5401 -17.4538 -17.4534 -17.4449 -17.4444 -8.6581 -8.6575 -8.6456 -8.6451 0.3602 0.3605 0.3647 0.3650 4.1862 4.1865 4.1943 4.1946 4.8341 4.8344 4.8367 4.8371 5.6304 5.6307 5.6424 5.6428 6.1520 6.1521 6.1560 6.1561 7.3734 7.3735 7.3789 7.3791 8.7037 8.7038 8.7103 8.7105 12.7053 12.7055 12.7163 12.7165 12.9732 12.9733 12.9823 12.9825 14.0396 14.0455 k = 0.2359 0.4086 0.1596 ( 3860 PWs) bands (ev): -38.9378 -38.9378 -38.9374 -38.9373 -18.0564 -18.0559 -18.0034 -18.0029 -17.5982 -17.5977 -17.5389 -17.5385 -17.4512 -17.4508 -17.4408 -17.4403 -8.6634 -8.6628 -8.6510 -8.6504 0.3073 0.3075 0.3119 0.3122 4.1913 4.1916 4.1995 4.1998 4.8518 4.8521 4.8547 4.8551 5.6552 5.6556 5.6673 5.6677 6.1753 6.1755 6.1791 6.1792 7.4327 7.4329 7.4380 7.4382 8.7085 8.7087 8.7154 8.7155 12.6803 12.6804 12.6911 12.6913 12.9617 12.9618 12.9707 12.9709 14.0367 14.0401 k = 0.2308 0.3997 0.1596 ( 3860 PWs) bands (ev): -38.9388 -38.9388 -38.9383 -38.9383 -18.0534 -18.0530 -18.0011 -18.0006 -17.5958 -17.5954 -17.5371 -17.5366 -17.4485 -17.4481 -17.4366 -17.4361 -8.6689 -8.6684 -8.6566 -8.6560 0.2530 0.2532 0.2578 0.2581 4.1949 4.1952 4.2033 4.2036 4.8722 4.8725 4.8755 4.8759 5.6797 5.6801 5.6919 5.6922 6.2013 6.2014 6.2048 6.2050 7.4931 7.4932 7.4981 7.4983 8.7139 8.7140 8.7209 8.7210 12.6562 12.6564 12.6669 12.6671 12.9512 12.9513 12.9602 12.9603 14.0307 14.0337 k = 0.2256 0.3908 0.1596 ( 3868 PWs) bands (ev): -38.9398 -38.9398 -38.9393 -38.9393 -18.0503 -18.0499 -17.9985 -17.9980 -17.5936 -17.5931 -17.5350 -17.5345 -17.4457 -17.4453 -17.4324 -17.4320 -8.6748 -8.6742 -8.6625 -8.6619 0.1977 0.1979 0.2026 0.2029 4.1970 4.1973 4.2054 4.2057 4.8952 4.8956 4.8989 4.8993 5.7035 5.7039 5.7157 5.7161 6.2302 6.2303 6.2336 6.2338 7.5542 7.5544 7.5590 7.5591 8.7199 8.7200 8.7269 8.7270 12.6333 12.6335 12.6439 12.6440 12.9416 12.9417 12.9505 12.9507 14.0226 14.0318 k = 0.2205 0.3819 0.1596 ( 3872 PWs) bands (ev): -38.9409 -38.9409 -38.9404 -38.9404 -18.0471 -18.0466 -17.9957 -17.9952 -17.5914 -17.5909 -17.5326 -17.5322 -17.4428 -17.4423 -17.4282 -17.4277 -8.6810 -8.6804 -8.6687 -8.6681 0.1415 0.1417 0.1466 0.1468 4.1974 4.1977 4.2058 4.2061 4.9207 4.9210 4.9248 4.9251 5.7263 5.7267 5.7385 5.7389 6.2625 6.2626 6.2659 6.2660 7.6160 7.6161 7.6205 7.6206 8.7264 8.7266 8.7335 8.7337 12.6118 12.6119 12.6222 12.6223 12.9328 12.9329 12.9417 12.9418 14.0130 14.0150 k = 0.2154 0.3731 0.1596 ( 3868 PWs) bands (ev): -38.9420 -38.9420 -38.9415 -38.9415 -18.0436 -18.0432 -17.9926 -17.9921 -17.5892 -17.5888 -17.5300 -17.5295 -17.4397 -17.4393 -17.4240 -17.4235 -8.6874 -8.6868 -8.6751 -8.6746 0.0847 0.0850 0.0899 0.0902 4.1961 4.1965 4.2045 4.2049 4.9483 4.9487 4.9527 4.9531 5.7479 5.7483 5.7601 5.7605 6.2985 6.2986 6.3020 6.3022 7.6782 7.6783 7.6823 7.6825 8.7337 8.7339 8.7408 8.7410 12.5917 12.5919 12.6020 12.6021 12.9246 12.9247 12.9335 12.9336 14.0017 14.0053 k = 0.2103 0.3642 0.1596 ( 3882 PWs) bands (ev): -38.9432 -38.9432 -38.9427 -38.9427 -18.0401 -18.0397 -17.9893 -17.9888 -17.5871 -17.5866 -17.5272 -17.5267 -17.4366 -17.4361 -17.4197 -17.4192 -8.6941 -8.6935 -8.6818 -8.6813 0.0275 0.0278 0.0328 0.0331 4.1933 4.1937 4.2017 4.2020 4.9778 4.9781 4.9825 4.9828 5.7680 5.7684 5.7801 5.7805 6.3386 6.3387 6.3423 6.3424 7.7405 7.7407 7.7443 7.7444 8.7417 8.7419 8.7488 8.7489 12.5732 12.5733 12.5833 12.5834 12.9170 12.9172 12.9259 12.9260 13.9879 13.9914 k = 0.2051 0.3553 0.1596 ( 3880 PWs) bands (ev): -38.9444 -38.9444 -38.9439 -38.9439 -18.0365 -18.0360 -17.9858 -17.9853 -17.5849 -17.5845 -17.5242 -17.5237 -17.4333 -17.4328 -17.4154 -17.4150 -8.7011 -8.7005 -8.6888 -8.6882 -0.0299 -0.0296 -0.0245 -0.0243 4.1891 4.1894 4.1973 4.1976 5.0087 5.0090 5.0136 5.0140 5.7867 5.7871 5.7986 5.7990 6.3829 6.3830 6.3868 6.3869 7.8029 7.8031 7.8063 7.8064 8.7505 8.7507 8.7575 8.7576 12.5563 12.5565 12.5663 12.5664 12.9100 12.9101 12.9188 12.9189 13.9728 13.9746 k = 0.2000 0.3464 0.1596 ( 3880 PWs) bands (ev): -38.9456 -38.9456 -38.9451 -38.9451 -18.0327 -18.0322 -17.9821 -17.9817 -17.5827 -17.5822 -17.5210 -17.5205 -17.4298 -17.4294 -17.4111 -17.4107 -8.7083 -8.7077 -8.6960 -8.6954 -0.0874 -0.0871 -0.0819 -0.0816 4.1836 4.1839 4.1916 4.1919 5.0405 5.0409 5.0457 5.0461 5.8037 5.8041 5.8155 5.8159 6.4316 6.4317 6.4357 6.4358 7.8652 7.8653 7.8681 7.8682 8.7602 8.7604 8.7670 8.7671 12.5412 12.5413 12.5510 12.5511 12.9033 12.9034 12.9121 12.9122 13.9561 13.9584 k = 0.1949 0.3375 0.1596 ( 3872 PWs) bands (ev): -38.9469 -38.9469 -38.9464 -38.9464 -18.0288 -18.0284 -17.9783 -17.9779 -17.5803 -17.5799 -17.5176 -17.5171 -17.4262 -17.4258 -17.4068 -17.4064 -8.7157 -8.7151 -8.7034 -8.7028 -0.1447 -0.1444 -0.1391 -0.1389 4.1770 4.1773 4.1848 4.1851 5.0730 5.0734 5.0784 5.0788 5.8193 5.8197 5.8308 5.8312 6.4846 6.4847 6.4889 6.4891 7.9270 7.9271 7.9295 7.9296 8.7709 8.7710 8.7774 8.7776 12.5278 12.5280 12.5375 12.5377 12.8970 12.8971 12.9058 12.9059 13.9380 13.9395 k = 0.1897 0.3286 0.1596 ( 3872 PWs) bands (ev): -38.9482 -38.9482 -38.9477 -38.9477 -18.0249 -18.0245 -17.9744 -17.9740 -17.5779 -17.5775 -17.5141 -17.5136 -17.4225 -17.4221 -17.4025 -17.4021 -8.7233 -8.7228 -8.7111 -8.7105 -0.2017 -0.2015 -0.1961 -0.1959 4.1693 4.1696 4.1769 4.1772 5.1058 5.1062 5.1113 5.1117 5.8334 5.8338 5.8447 5.8451 6.5420 6.5421 6.5465 6.5466 7.9882 7.9883 7.9902 7.9903 8.7826 8.7827 8.7888 8.7890 12.5163 12.5165 12.5259 12.5260 12.8910 12.8911 12.8997 12.8999 13.9176 13.9191 k = 0.1846 0.3198 0.1596 ( 3864 PWs) bands (ev): -38.9495 -38.9495 -38.9490 -38.9490 -18.0210 -18.0205 -17.9704 -17.9700 -17.5753 -17.5749 -17.5105 -17.5100 -17.4187 -17.4182 -17.3982 -17.3977 -8.7312 -8.7306 -8.7189 -8.7183 -0.2584 -0.2582 -0.2527 -0.2525 4.1608 4.1611 4.1681 4.1684 5.1385 5.1389 5.1441 5.1445 5.8463 5.8467 5.8572 5.8577 6.6035 6.6036 6.6082 6.6083 8.0486 8.0487 8.0502 8.0503 8.7954 8.7955 8.8013 8.8014 12.5067 12.5068 12.5161 12.5163 12.8852 12.8853 12.8940 12.8941 13.8952 13.8956 k = 0.1795 0.3109 0.1596 ( 3860 PWs) bands (ev): -38.9508 -38.9508 -38.9503 -38.9503 -18.0170 -18.0165 -17.9665 -17.9660 -17.5726 -17.5722 -17.5067 -17.5063 -17.4147 -17.4143 -17.3939 -17.3934 -8.7392 -8.7387 -8.7270 -8.7264 -0.3145 -0.3143 -0.3088 -0.3086 4.1516 4.1519 4.1585 4.1588 5.1709 5.1712 5.1766 5.1770 5.8581 5.8585 5.8687 5.8691 6.6690 6.6691 6.6738 6.6739 8.1079 8.1080 8.1090 8.1091 8.8095 8.8096 8.8150 8.8151 12.4989 12.4990 12.5082 12.5083 12.8796 12.8797 12.8883 12.8884 13.8709 13.8725 k = 0.1744 0.3020 0.1596 ( 3856 PWs) bands (ev): -38.9522 -38.9522 -38.9517 -38.9517 -18.0130 -18.0125 -17.9625 -17.9620 -17.5697 -17.5692 -17.5029 -17.5025 -17.4106 -17.4101 -17.3896 -17.3891 -8.7475 -8.7469 -8.7352 -8.7346 -0.3699 -0.3697 -0.3642 -0.3640 4.1416 4.1419 4.1483 4.1486 5.2027 5.2031 5.2086 5.2089 5.8689 5.8693 5.8791 5.8795 6.7382 6.7384 6.7431 6.7433 8.1657 8.1657 8.1666 8.1667 8.8251 8.8252 8.8301 8.8303 12.4929 12.4930 12.5021 12.5023 12.8741 12.8742 12.8828 12.8829 13.8443 13.8450 k = 0.1692 0.2931 0.1596 ( 3856 PWs) bands (ev): -38.9536 -38.9536 -38.9531 -38.9531 -18.0090 -18.0086 -17.9585 -17.9581 -17.5665 -17.5661 -17.4991 -17.4987 -17.4064 -17.4059 -17.3852 -17.3847 -8.7559 -8.7553 -8.7436 -8.7430 -0.4246 -0.4244 -0.4189 -0.4187 4.1311 4.1314 4.1375 4.1378 5.2339 5.2343 5.2398 5.2402 5.8788 5.8792 5.8887 5.8891 6.8109 6.8110 6.8159 6.8160 8.2215 8.2216 8.2227 8.2228 8.8423 8.8424 8.8469 8.8470 12.4888 12.4889 12.4979 12.4980 12.8686 12.8687 12.8774 12.8775 13.8161 13.8173 k = 0.1641 0.2842 0.1596 ( 3848 PWs) bands (ev): -38.9550 -38.9550 -38.9545 -38.9545 -18.0051 -18.0046 -17.9547 -17.9542 -17.5632 -17.5627 -17.4952 -17.4947 -17.4020 -17.4015 -17.3809 -17.3804 -8.7644 -8.7638 -8.7521 -8.7515 -0.4784 -0.4781 -0.4727 -0.4724 4.1202 4.1205 4.1262 4.1265 5.2643 5.2647 5.2703 5.2706 5.8879 5.8884 5.8975 5.8979 6.8867 6.8868 6.8917 6.8918 8.2753 8.2754 8.2770 8.2771 8.8616 8.8617 8.8657 8.8658 12.4864 12.4865 12.4954 12.4956 12.8632 12.8633 12.8719 12.8720 13.7852 13.7866 k = 0.1590 0.2754 0.1596 ( 3852 PWs) bands (ev): -38.9564 -38.9564 -38.9559 -38.9559 -18.0012 -18.0007 -17.9510 -17.9505 -17.5596 -17.5592 -17.4913 -17.4908 -17.3975 -17.3970 -17.3765 -17.3760 -8.7730 -8.7725 -8.7608 -8.7602 -0.5312 -0.5310 -0.5255 -0.5253 4.1087 4.1090 4.1144 4.1147 5.2939 5.2943 5.2999 5.3003 5.8964 5.8969 5.9056 5.9060 6.9652 6.9653 6.9702 6.9704 8.3267 8.3268 8.3290 8.3291 8.8830 8.8831 8.8867 8.8868 12.4857 12.4858 12.4947 12.4948 12.8576 12.8578 12.8664 12.8665 13.7532 13.7544 k = 0.1538 0.2665 0.1596 ( 3844 PWs) bands (ev): -38.9578 -38.9578 -38.9573 -38.9573 -17.9973 -17.9969 -17.9474 -17.9469 -17.5557 -17.5553 -17.4874 -17.4869 -17.3928 -17.3923 -17.3722 -17.3717 -8.7818 -8.7812 -8.7696 -8.7690 -0.5829 -0.5827 -0.5773 -0.5771 4.0970 4.0973 4.1023 4.1026 5.3228 5.3231 5.3288 5.3291 5.9044 5.9048 5.9131 5.9136 7.0461 7.0462 7.0511 7.0513 8.3754 8.3756 8.3783 8.3784 8.9071 8.9071 8.9104 8.9104 12.4866 12.4868 12.4955 12.4957 12.8520 12.8521 12.8607 12.8609 13.7196 13.7208 k = 0.1487 0.2576 0.1596 ( 3848 PWs) bands (ev): -38.9592 -38.9592 -38.9587 -38.9587 -17.9936 -17.9931 -17.9440 -17.9435 -17.5517 -17.5512 -17.4835 -17.4830 -17.3880 -17.3875 -17.3678 -17.3673 -8.7906 -8.7900 -8.7785 -8.7779 -0.6335 -0.6333 -0.6279 -0.6277 4.0848 4.0851 4.0899 4.0902 5.3508 5.3512 5.3569 5.3572 5.9117 5.9122 5.9201 5.9205 7.1288 7.1290 7.1339 7.1340 8.4212 8.4214 8.4246 8.4248 8.9340 8.9340 8.9370 8.9371 12.4890 12.4892 12.4980 12.4981 12.8462 12.8463 12.8549 12.8551 13.6846 13.6880 k = 0.1436 0.2487 0.1596 ( 3848 PWs) bands (ev): -38.9607 -38.9607 -38.9602 -38.9602 -17.9899 -17.9895 -17.9408 -17.9403 -17.5474 -17.5469 -17.4796 -17.4791 -17.3831 -17.3826 -17.3634 -17.3629 -8.7994 -8.7989 -8.7874 -8.7869 -0.6829 -0.6827 -0.6774 -0.6771 4.0724 4.0727 4.0771 4.0774 5.3782 5.3786 5.3843 5.3846 5.9185 5.9190 5.9265 5.9270 7.2129 7.2130 7.2180 7.2181 8.4640 8.4641 8.4679 8.4680 8.9640 8.9641 8.9670 8.9670 12.4929 12.4930 12.5018 12.5019 12.8402 12.8403 12.8490 12.8491 13.6488 13.6491 k = 0.1385 0.2398 0.1596 ( 3846 PWs) bands (ev): -38.9621 -38.9621 -38.9616 -38.9616 -17.9864 -17.9859 -17.9378 -17.9374 -17.5429 -17.5424 -17.4758 -17.4753 -17.3780 -17.3775 -17.3590 -17.3585 -8.8083 -8.8078 -8.7964 -8.7958 -0.7310 -0.7308 -0.7255 -0.7253 4.0598 4.0601 4.0642 4.0645 5.4050 5.4054 5.4111 5.4114 5.9249 5.9253 5.9325 5.9329 7.2977 7.2979 7.3028 7.3029 8.5038 8.5039 8.5080 8.5081 8.9973 8.9974 9.0003 9.0004 12.4979 12.4981 12.5069 12.5071 12.8339 12.8341 12.8428 12.8429 13.6121 13.6212 k = 0.1333 0.2309 0.1596 ( 3842 PWs) bands (ev): -38.9635 -38.9635 -38.9630 -38.9630 -17.9829 -17.9825 -17.9351 -17.9346 -17.5381 -17.5377 -17.4720 -17.4715 -17.3728 -17.3723 -17.3546 -17.3541 -8.8172 -8.8166 -8.8054 -8.8049 -0.7777 -0.7775 -0.7724 -0.7721 4.0469 4.0472 4.0510 4.0513 5.4314 5.4317 5.4374 5.4377 5.9307 5.9312 5.9379 5.9384 7.3826 7.3827 7.3877 7.3878 8.5409 8.5410 8.5452 8.5454 9.0340 9.0341 9.0370 9.0372 12.5041 12.5043 12.5132 12.5133 12.8275 12.8276 12.8364 12.8366 13.5750 13.5759 k = 0.1282 0.2221 0.1596 ( 3846 PWs) bands (ev): -38.9649 -38.9649 -38.9644 -38.9644 -17.9796 -17.9792 -17.9326 -17.9322 -17.5332 -17.5328 -17.4684 -17.4679 -17.3675 -17.3670 -17.3502 -17.3497 -8.8261 -8.8255 -8.8145 -8.8139 -0.8231 -0.8229 -0.8178 -0.8176 4.0339 4.0342 4.0377 4.0380 5.4574 5.4577 5.4633 5.4637 5.9360 5.9365 5.9429 5.9433 7.4666 7.4667 7.4718 7.4719 8.5760 8.5761 8.5803 8.5804 9.0737 9.0739 9.0769 9.0771 12.5112 12.5113 12.5204 12.5205 12.8208 12.8210 12.8299 12.8300 13.5378 13.5381 k = 0.1231 0.2132 0.1596 ( 3850 PWs) bands (ev): -38.9663 -38.9663 -38.9658 -38.9658 -17.9764 -17.9760 -17.9304 -17.9299 -17.5282 -17.5278 -17.4648 -17.4644 -17.3620 -17.3615 -17.3457 -17.3452 -8.8349 -8.8344 -8.8235 -8.8229 -0.8670 -0.8668 -0.8618 -0.8616 4.0208 4.0210 4.0242 4.0245 5.4831 5.4834 5.4890 5.4893 5.9408 5.9413 5.9473 5.9478 7.5488 7.5489 7.5541 7.5542 8.6099 8.6101 8.6140 8.6141 9.1163 9.1164 9.1195 9.1197 12.5190 12.5192 12.5284 12.5285 12.8140 12.8142 12.8232 12.8234 13.5001 13.5022 k = 0.1179 0.2043 0.1596 ( 3846 PWs) bands (ev): -38.9676 -38.9676 -38.9671 -38.9671 -17.9733 -17.9729 -17.9284 -17.9280 -17.5230 -17.5226 -17.4614 -17.4609 -17.3565 -17.3560 -17.3412 -17.3407 -8.8437 -8.8431 -8.8324 -8.8318 -0.9094 -0.9091 -0.9043 -0.9041 4.0075 4.0078 4.0107 4.0110 5.5087 5.5090 5.5145 5.5149 5.9452 5.9456 5.9513 5.9518 7.6281 7.6283 7.6336 7.6338 8.6439 8.6440 8.6475 8.6476 9.1612 9.1613 9.1645 9.1646 12.5273 12.5275 12.5369 12.5371 12.8072 12.8074 12.8166 12.8168 13.4622 13.4639 k = 0.1128 0.1954 0.1596 ( 3846 PWs) bands (ev): -38.9690 -38.9690 -38.9685 -38.9685 -17.9704 -17.9700 -17.9267 -17.9263 -17.5178 -17.5173 -17.4581 -17.4577 -17.3509 -17.3504 -17.3367 -17.3362 -8.8523 -8.8517 -8.8413 -8.8407 -0.9502 -0.9500 -0.9453 -0.9450 3.9943 3.9946 3.9972 3.9975 5.5342 5.5346 5.5399 5.5403 5.9490 5.9494 5.9548 5.9553 7.7033 7.7034 7.7090 7.7092 8.6792 8.6793 8.6823 8.6824 9.2079 9.2080 9.2111 9.2113 12.5360 12.5361 12.5458 12.5460 12.8005 12.8007 12.8100 12.8102 13.4247 13.4255 k = 0.1077 0.1865 0.1596 ( 3846 PWs) bands (ev): -38.9703 -38.9703 -38.9698 -38.9698 -17.9676 -17.9672 -17.9253 -17.9248 -17.5124 -17.5120 -17.4550 -17.4545 -17.3452 -17.3447 -17.3322 -17.3317 -8.8608 -8.8602 -8.8500 -8.8494 -0.9894 -0.9892 -0.9847 -0.9844 3.9810 3.9813 3.9837 3.9840 5.5597 5.5601 5.5653 5.5657 5.9523 5.9528 5.9578 5.9582 7.7729 7.7731 7.7790 7.7791 8.7173 8.7174 8.7198 8.7199 9.2558 9.2560 9.2591 9.2593 12.5447 12.5449 12.5549 12.5551 12.7940 12.7942 12.8037 12.8039 13.3870 13.3872 k = 0.1026 0.1776 0.1596 ( 3846 PWs) bands (ev): -38.9715 -38.9715 -38.9710 -38.9710 -17.9650 -17.9645 -17.9241 -17.9236 -17.5071 -17.5067 -17.4520 -17.4516 -17.3395 -17.3390 -17.3277 -17.3272 -8.8691 -8.8686 -8.8586 -8.8581 -1.0271 -1.0268 -1.0224 -1.0222 3.9678 3.9681 3.9703 3.9706 5.5853 5.5856 5.5908 5.5911 5.9551 5.9556 5.9603 5.9608 7.8358 7.8359 7.8422 7.8423 8.7595 8.7596 8.7615 8.7616 9.3045 9.3047 9.3077 9.3079 12.5534 12.5536 12.5639 12.5641 12.7879 12.7881 12.7978 12.7980 13.3495 13.3499 k = 0.0974 0.1688 0.1596 ( 3838 PWs) bands (ev): -38.9728 -38.9728 -38.9723 -38.9723 -17.9625 -17.9620 -17.9231 -17.9226 -17.5018 -17.5013 -17.4493 -17.4488 -17.3337 -17.3332 -17.3231 -17.3226 -8.8773 -8.8767 -8.8671 -8.8665 -1.0630 -1.0628 -1.0585 -1.0583 3.9547 3.9550 3.9570 3.9573 5.6109 5.6113 5.6163 5.6166 5.9576 5.9580 5.9624 5.9629 7.8907 7.8908 7.8974 7.8975 8.8069 8.8070 8.8088 8.8089 9.3534 9.3536 9.3565 9.3567 12.5619 12.5621 12.5726 12.5728 12.7823 12.7825 12.7923 12.7925 13.3118 13.3121 k = 0.0923 0.1599 0.1596 ( 3838 PWs) bands (ev): -38.9740 -38.9740 -38.9735 -38.9735 -17.9601 -17.9596 -17.9224 -17.9219 -17.4965 -17.4961 -17.4467 -17.4462 -17.3280 -17.3275 -17.3186 -17.3181 -8.8852 -8.8846 -8.8753 -8.8748 -1.0973 -1.0971 -1.0930 -1.0928 3.9418 3.9421 3.9439 3.9442 5.6366 5.6369 5.6418 5.6421 5.9595 5.9600 5.9640 5.9645 7.9368 7.9370 7.9438 7.9440 8.8603 8.8604 8.8624 8.8625 9.4020 9.4023 9.4050 9.4053 12.5701 12.5703 12.5810 12.5812 12.7774 12.7776 12.7875 12.7878 13.2740 13.2742 k = 0.0872 0.1510 0.1596 ( 3844 PWs) bands (ev): -38.9751 -38.9751 -38.9746 -38.9746 -17.9578 -17.9574 -17.9218 -17.9214 -17.4913 -17.4909 -17.4443 -17.4438 -17.3224 -17.3219 -17.3141 -17.3136 -8.8929 -8.8923 -8.8834 -8.8828 -1.1298 -1.1296 -1.1257 -1.1255 3.9291 3.9294 3.9310 3.9313 5.6622 5.6626 5.6672 5.6676 5.9610 5.9615 5.9652 5.9657 7.9740 7.9742 7.9812 7.9813 8.9200 8.9201 8.9225 8.9226 9.4500 9.4502 9.4529 9.4531 12.5778 12.5780 12.5890 12.5892 12.7733 12.7735 12.7834 12.7837 13.2362 13.2364 k = 0.0821 0.1421 0.1596 ( 3844 PWs) bands (ev): -38.9762 -38.9762 -38.9757 -38.9757 -17.9557 -17.9552 -17.9215 -17.9211 -17.4863 -17.4858 -17.4421 -17.4416 -17.3168 -17.3163 -17.3097 -17.3092 -8.9002 -8.8997 -8.8912 -8.8906 -1.1606 -1.1604 -1.1567 -1.1565 3.9168 3.9171 3.9184 3.9187 5.6878 5.6882 5.6927 5.6930 5.9622 5.9626 5.9661 5.9666 8.0025 8.0027 8.0098 8.0099 8.9858 8.9859 8.9886 8.9888 9.4970 9.4972 9.4998 9.5000 12.5851 12.5853 12.5965 12.5967 12.7700 12.7702 12.7801 12.7803 13.1982 13.1984 k = 0.0769 0.1332 0.1596 ( 3844 PWs) bands (ev): -38.9773 -38.9773 -38.9768 -38.9768 -17.9536 -17.9532 -17.9214 -17.9209 -17.4814 -17.4809 -17.4401 -17.4396 -17.3113 -17.3108 -17.3053 -17.3048 -8.9073 -8.9068 -8.8987 -8.8981 -1.1897 -1.1894 -1.1859 -1.1857 3.9047 3.9050 3.9063 3.9066 5.7133 5.7136 5.7179 5.7183 5.9630 5.9635 5.9667 5.9671 8.0231 8.0233 8.0302 8.0304 9.0568 9.0570 9.0600 9.0602 9.5425 9.5427 9.5452 9.5455 12.5921 12.5923 12.6035 12.6037 12.7675 12.7677 12.7774 12.7776 13.1601 13.1603 k = 0.0718 0.1244 0.1596 ( 3840 PWs) bands (ev): -38.9783 -38.9783 -38.9778 -38.9778 -17.9517 -17.9513 -17.9214 -17.9209 -17.4766 -17.4762 -17.4383 -17.4378 -17.3060 -17.3055 -17.3010 -17.3005 -8.9141 -8.9135 -8.9059 -8.9053 -1.2169 -1.2167 -1.2134 -1.2131 3.8931 3.8934 3.8945 3.8948 5.7385 5.7389 5.7429 5.7433 5.9636 5.9640 5.9670 5.9674 8.0367 8.0369 8.0436 8.0438 9.1320 9.1322 9.1354 9.1356 9.5864 9.5866 9.5890 9.5892 12.5989 12.5991 12.6103 12.6105 12.7657 12.7659 12.7753 12.7755 13.1218 13.1220 k = 0.0667 0.1155 0.1596 ( 3836 PWs) bands (ev): -38.9793 -38.9793 -38.9788 -38.9788 -17.9499 -17.9495 -17.9216 -17.9211 -17.4721 -17.4716 -17.4366 -17.4362 -17.3009 -17.3004 -17.2967 -17.2962 -8.9205 -8.9199 -8.9127 -8.9122 -1.2423 -1.2421 -1.2390 -1.2388 3.8820 3.8823 3.8832 3.8835 5.7633 5.7637 5.7675 5.7679 5.9639 5.9644 5.9670 5.9675 8.0444 8.0446 8.0511 8.0513 9.2100 9.2102 9.2134 9.2137 9.6282 9.6285 9.6308 9.6310 12.6056 12.6058 12.6169 12.6171 12.7643 12.7645 12.7735 12.7737 13.0835 13.0837 k = 0.0615 0.1066 0.1596 ( 3840 PWs) bands (ev): -38.9802 -38.9802 -38.9797 -38.9797 -17.9482 -17.9477 -17.9219 -17.9214 -17.4678 -17.4673 -17.4353 -17.4348 -17.2960 -17.2955 -17.2927 -17.2922 -8.9265 -8.9259 -8.9192 -8.9187 -1.2659 -1.2657 -1.2629 -1.2626 3.8714 3.8717 3.8725 3.8728 5.7875 5.7879 5.7914 5.7918 5.9640 5.9644 5.9668 5.9673 8.0474 8.0476 8.0537 8.0539 9.2894 9.2896 9.2928 9.2931 9.6678 9.6680 9.6702 9.6705 12.6124 12.6126 12.6235 12.6237 12.7632 12.7634 12.7720 12.7722 13.0453 13.0455 k = 0.0564 0.0977 0.1596 ( 3830 PWs) bands (ev): -38.9810 -38.9810 -38.9805 -38.9805 -17.9465 -17.9461 -17.9223 -17.9219 -17.4637 -17.4632 -17.4341 -17.4336 -17.2914 -17.2909 -17.2887 -17.2882 -8.9321 -8.9315 -8.9253 -8.9248 -1.2877 -1.2875 -1.2848 -1.2846 3.8614 3.8617 3.8624 3.8627 5.8110 5.8114 5.8147 5.8151 5.9639 5.9644 5.9665 5.9670 8.0467 8.0469 8.0525 8.0527 9.3688 9.3691 9.3723 9.3725 9.7049 9.7052 9.7072 9.7075 12.6195 12.6197 12.6304 12.6306 12.7621 12.7623 12.7704 12.7706 13.0074 13.0076 k = 0.0513 0.0888 0.1596 ( 3834 PWs) bands (ev): -38.9818 -38.9818 -38.9813 -38.9813 -17.9450 -17.9445 -17.9229 -17.9224 -17.4598 -17.4593 -17.4331 -17.4326 -17.2870 -17.2865 -17.2850 -17.2845 -8.9372 -8.9367 -8.9310 -8.9305 -1.3076 -1.3074 -1.3050 -1.3047 3.8521 3.8524 3.8530 3.8533 5.8335 5.8339 5.8369 5.8373 5.9637 5.9642 5.9661 5.9665 8.0431 8.0433 8.0485 8.0487 9.4471 9.4473 9.4504 9.4506 9.7393 9.7396 9.7415 9.7418 12.6269 12.6272 12.6376 12.6378 12.7608 12.7610 12.7685 12.7687 12.9701 12.9704 k = 0.0462 0.0799 0.1596 ( 3830 PWs) bands (ev): -38.9825 -38.9825 -38.9820 -38.9820 -17.9435 -17.9430 -17.9235 -17.9231 -17.4562 -17.4557 -17.4323 -17.4318 -17.2830 -17.2825 -17.2815 -17.2810 -8.9420 -8.9414 -8.9363 -8.9357 -1.3256 -1.3254 -1.3232 -1.3230 3.8435 3.8438 3.8442 3.8445 5.8548 5.8552 5.8579 5.8583 5.9635 5.9640 5.9656 5.9661 8.0375 8.0378 8.0424 8.0427 9.5228 9.5230 9.5259 9.5262 9.7709 9.7712 9.7729 9.7732 12.6349 12.6351 12.6453 12.6455 12.7590 12.7592 12.7661 12.7663 12.9339 12.9341 k = 0.0410 0.0711 0.1596 ( 3826 PWs) bands (ev): -38.9831 -38.9831 -38.9826 -38.9826 -17.9420 -17.9416 -17.9242 -17.9238 -17.4528 -17.4523 -17.4317 -17.4312 -17.2793 -17.2788 -17.2783 -17.2778 -8.9462 -8.9456 -8.9411 -8.9406 -1.3418 -1.3415 -1.3396 -1.3394 3.8356 3.8359 3.8363 3.8366 5.8747 5.8751 5.8775 5.8779 5.9633 5.9637 5.9651 5.9656 8.0307 8.0309 8.0351 8.0353 9.5948 9.5951 9.5978 9.5980 9.7995 9.7997 9.8013 9.8016 12.6433 12.6435 12.6535 12.6537 12.7566 12.7568 12.7630 12.7632 12.8991 12.8994 k = 0.0359 0.0622 0.1596 ( 3822 PWs) bands (ev): -38.9837 -38.9837 -38.9832 -38.9832 -17.9406 -17.9402 -17.9250 -17.9246 -17.4497 -17.4492 -17.4313 -17.4309 -17.2761 -17.2756 -17.2753 -17.2748 -8.9499 -8.9494 -8.9454 -8.9449 -1.3560 -1.3558 -1.3541 -1.3539 3.8286 3.8289 3.8292 3.8295 5.8928 5.8933 5.8954 5.8958 5.9631 5.9636 5.9647 5.9651 8.0232 8.0235 8.0271 8.0273 9.6620 9.6623 9.6647 9.6649 9.8249 9.8252 9.8266 9.8269 12.6523 12.6525 12.6622 12.6624 12.7533 12.7535 12.7589 12.7591 12.8665 12.8667 k = 0.0308 0.0533 0.1596 ( 3816 PWs) bands (ev): -38.9842 -38.9842 -38.9837 -38.9837 -17.9393 -17.9388 -17.9259 -17.9254 -17.4468 -17.4463 -17.4312 -17.4307 -17.2732 -17.2727 -17.2727 -17.2722 -8.9531 -8.9526 -8.9493 -8.9487 -1.3683 -1.3681 -1.3667 -1.3665 3.8224 3.8227 3.8229 3.8232 5.9090 5.9094 5.9112 5.9116 5.9631 5.9636 5.9644 5.9649 8.0157 8.0159 8.0190 8.0192 9.7232 9.7234 9.7256 9.7258 9.8472 9.8474 9.8487 9.8489 12.6616 12.6618 12.6713 12.6715 12.7490 12.7492 12.7537 12.7539 12.8366 12.8368 k = 0.0256 0.0444 0.1596 ( 3816 PWs) bands (ev): -38.9846 -38.9846 -38.9841 -38.9841 -17.9380 -17.9375 -17.9268 -17.9264 -17.4442 -17.4437 -17.4312 -17.4308 -17.2707 -17.2704 -17.2702 -17.2699 -8.9559 -8.9553 -8.9526 -8.9521 -1.3788 -1.3786 -1.3774 -1.3772 3.8171 3.8174 3.8175 3.8178 5.9229 5.9233 5.9247 5.9252 5.9633 5.9638 5.9644 5.9648 8.0085 8.0087 8.0112 8.0115 9.7772 9.7774 9.7793 9.7795 9.8661 9.8664 9.8674 9.8677 12.6713 12.6715 12.6807 12.6809 12.7435 12.7437 12.7471 12.7473 12.8102 12.8104 k = 0.0205 0.0355 0.1596 ( 3808 PWs) bands (ev): -38.9849 -38.9849 -38.9844 -38.9844 -17.9367 -17.9363 -17.9278 -17.9273 -17.4418 -17.4414 -17.4315 -17.4310 -17.2686 -17.2685 -17.2681 -17.2680 -8.9580 -8.9575 -8.9554 -8.9549 -1.3873 -1.3871 -1.3862 -1.3860 3.8128 3.8131 3.8131 3.8134 5.9341 5.9345 5.9356 5.9360 5.9641 5.9645 5.9648 5.9653 8.0021 8.0023 8.0043 8.0045 9.8230 9.8233 9.8248 9.8250 9.8818 9.8821 9.8829 9.8831 12.6810 12.6813 12.6902 12.6904 12.7368 12.7369 12.7393 12.7395 12.7882 12.7883 k = 0.0154 0.0266 0.1596 ( 3812 PWs) bands (ev): -38.9852 -38.9852 -38.9847 -38.9847 -17.9355 -17.9350 -17.9288 -17.9283 -17.4397 -17.4393 -17.4320 -17.4315 -17.2671 -17.2670 -17.2666 -17.2665 -8.9596 -8.9591 -8.9577 -8.9571 -1.3939 -1.3937 -1.3931 -1.3929 3.8093 3.8096 3.8097 3.8099 5.9423 5.9427 5.9433 5.9438 5.9654 5.9658 5.9659 5.9663 7.9968 7.9970 7.9985 7.9987 9.8597 9.8600 9.8610 9.8613 9.8942 9.8945 9.8950 9.8953 12.6907 12.6909 12.6993 12.6996 12.7292 12.7294 12.7309 12.7312 12.7708 12.7710 k = 0.0103 0.0178 0.1596 ( 3816 PWs) bands (ev): -38.9854 -38.9854 -38.9849 -38.9849 -17.9343 -17.9339 -17.9298 -17.9294 -17.4379 -17.4374 -17.4327 -17.4323 -17.2659 -17.2659 -17.2654 -17.2654 -8.9607 -8.9602 -8.9594 -8.9588 -1.3986 -1.3984 -1.3981 -1.3978 3.8069 3.8071 3.8072 3.8074 5.9474 5.9478 5.9480 5.9484 5.9673 5.9674 5.9678 5.9679 7.9929 7.9931 7.9940 7.9942 9.8861 9.8864 9.8870 9.8873 9.9036 9.9039 9.9041 9.9044 12.6999 12.7001 12.7076 12.7078 12.7221 12.7223 12.7232 12.7235 12.7582 12.7583 k = 0.0051 0.0089 0.1596 ( 3824 PWs) bands (ev): -38.9855 -38.9855 -38.9850 -38.9850 -17.9332 -17.9327 -17.9309 -17.9305 -17.4363 -17.4358 -17.4337 -17.4332 -17.2653 -17.2653 -17.2648 -17.2648 -8.9612 -8.9607 -8.9606 -8.9600 -1.4014 -1.4011 -1.4011 -1.4009 3.8054 3.8055 3.8057 3.8058 5.9500 5.9502 5.9504 5.9507 5.9690 5.9690 5.9694 5.9695 7.9906 7.9908 7.9912 7.9914 9.9010 9.9013 9.9013 9.9016 9.9107 9.9108 9.9110 9.9111 12.7079 12.7082 12.7132 12.7133 12.7173 12.7174 12.7178 12.7180 12.7506 12.7508 k = 0.0000 0.0000 0.1596 ( 3824 PWs) bands (ev): -38.9856 -38.9856 -38.9851 -38.9851 -17.9320 -17.9320 -17.9316 -17.9316 -17.4349 -17.4349 -17.4344 -17.4344 -17.2650 -17.2650 -17.2645 -17.2645 -8.9612 -8.9612 -8.9606 -8.9606 -1.4022 -1.4022 -1.4020 -1.4020 3.8050 3.8050 3.8053 3.8053 5.9508 5.9508 5.9513 5.9513 5.9697 5.9697 5.9701 5.9701 7.9900 7.9900 7.9902 7.9902 9.9052 9.9052 9.9054 9.9054 9.9140 9.9140 9.9143 9.9143 12.7130 12.7130 12.7133 12.7133 12.7159 12.7159 12.7162 12.7162 12.7499 12.7499 k = 0.5000 0.2887 0.1596 ( 3856 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0704 -18.0704 -18.0700 -18.0700 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3980 -17.3980 -8.6487 -8.6487 -8.6481 -8.6481 0.5425 0.5425 0.5428 0.5428 3.6662 3.6662 3.6664 3.6664 4.7829 4.7829 4.7833 4.7833 5.6593 5.6593 5.6595 5.6595 5.9114 5.9114 5.9119 5.9119 8.6151 8.6151 8.6153 8.6153 8.7191 8.7191 8.7193 8.7193 11.3375 11.3375 11.3376 11.3376 13.9584 13.9584 13.9586 13.9586 14.2252 14.2253 k = 0.5000 0.2887 0.1496 ( 3852 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0704 -18.0704 -18.0700 -18.0700 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6487 -8.6487 -8.6481 -8.6481 0.5416 0.5416 0.5437 0.5437 3.6314 3.6314 3.7032 3.7032 4.7753 4.7753 4.7905 4.7905 5.5994 5.5994 5.7180 5.7180 5.9067 5.9067 5.9167 5.9167 8.5895 8.5895 8.6409 8.6409 8.7087 8.7087 8.7298 8.7298 11.3272 11.3272 11.3474 11.3474 13.9528 13.9528 13.9643 13.9643 14.2238 14.2240 k = 0.5000 0.2887 0.1397 ( 3860 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0700 -18.0700 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3980 -17.3980 -8.6487 -8.6487 -8.6480 -8.6480 0.5405 0.5405 0.5448 0.5448 3.5985 3.5985 3.7420 3.7420 4.7673 4.7673 4.7976 4.7976 5.5385 5.5385 5.7750 5.7750 5.9018 5.9018 5.9217 5.9217 8.5639 8.5639 8.6663 8.6663 8.6984 8.6984 8.7402 8.7402 11.3165 11.3165 11.3566 11.3566 13.9472 13.9472 13.9702 13.9702 14.2223 14.2226 k = 0.5000 0.2887 0.1297 ( 3866 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0700 -18.0700 -17.5906 -17.5906 -17.5901 -17.5901 -17.3985 -17.3985 -17.3980 -17.3980 -8.6488 -8.6488 -8.6480 -8.6480 0.5394 0.5394 0.5458 0.5458 3.5678 3.5678 3.7828 3.7828 4.7588 4.7588 4.8045 4.8045 5.4771 5.4771 5.8298 5.8298 5.8973 5.8973 5.9266 5.9266 8.5389 8.5389 8.6862 8.6862 8.6932 8.6932 8.7505 8.7505 11.3055 11.3055 11.3652 11.3652 13.9419 13.9419 13.9761 13.9761 14.2212 14.2215 k = 0.5000 0.2887 0.1197 ( 3874 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0700 -18.0700 -17.5906 -17.5906 -17.5902 -17.5902 -17.3985 -17.3985 -17.3980 -17.3980 -8.6489 -8.6489 -8.6479 -8.6479 0.5384 0.5384 0.5468 0.5468 3.5392 3.5392 3.8253 3.8253 4.7499 4.7499 4.8110 4.8110 5.4155 5.4155 5.8795 5.8795 5.8955 5.8956 5.9315 5.9315 8.5146 8.5146 8.6776 8.6776 8.7162 8.7162 8.7606 8.7606 11.2944 11.2944 11.3730 11.3730 13.9367 13.9367 13.9820 13.9820 14.2195 14.2198 k = 0.5000 0.2887 0.1097 ( 3876 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0700 -18.0700 -17.5906 -17.5906 -17.5902 -17.5902 -17.3985 -17.3985 -17.3980 -17.3980 -8.6489 -8.6489 -8.6479 -8.6479 0.5374 0.5374 0.5477 0.5477 3.5128 3.5128 3.8695 3.8695 4.7402 4.7402 4.8172 4.8172 5.3543 5.3543 5.8865 5.8865 5.9323 5.9323 5.9382 5.9382 8.4911 8.4911 8.6681 8.6681 8.7393 8.7393 8.7704 8.7704 11.2834 11.2834 11.3801 11.3801 13.9318 13.9318 13.9879 13.9879 14.2182 14.2183 k = 0.5000 0.2887 0.0998 ( 3872 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0699 -18.0699 -17.5906 -17.5906 -17.5902 -17.5902 -17.3985 -17.3985 -17.3980 -17.3980 -8.6490 -8.6490 -8.6478 -8.6478 0.5365 0.5365 0.5486 0.5486 3.4886 3.4886 3.9154 3.9154 4.7297 4.7297 4.8231 4.8231 5.2941 5.2941 5.8828 5.8828 5.9403 5.9403 5.9814 5.9814 8.4689 8.4689 8.6590 8.6590 8.7609 8.7609 8.7803 8.7803 11.2725 11.2725 11.3864 11.3864 13.9272 13.9272 13.9937 13.9937 14.2171 14.2174 k = 0.5000 0.2887 0.0898 ( 3864 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0699 -18.0699 -17.5906 -17.5906 -17.5901 -17.5901 -17.3985 -17.3985 -17.3980 -17.3980 -8.6490 -8.6490 -8.6477 -8.6477 0.5356 0.5356 0.5495 0.5495 3.4667 3.4667 3.9627 3.9627 4.7179 4.7179 4.8286 4.8286 5.2355 5.2355 5.8791 5.8791 5.9446 5.9446 6.0251 6.0251 8.4479 8.4479 8.6505 8.6505 8.7793 8.7793 8.7916 8.7916 11.2621 11.2621 11.3919 11.3919 13.9229 13.9229 13.9994 13.9994 14.2160 14.2161 k = 0.5000 0.2887 0.0798 ( 3858 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0699 -18.0699 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6491 -8.6491 -8.6476 -8.6476 0.5348 0.5348 0.5503 0.5503 3.4470 3.4470 4.0113 4.0113 4.7044 4.7044 4.8336 4.8336 5.1794 5.1794 5.8756 5.8756 5.9486 5.9486 6.0653 6.0653 8.4285 8.4285 8.6427 8.6427 8.7914 8.7914 8.8068 8.8068 11.2522 11.2522 11.3967 11.3967 13.9190 13.9190 14.0049 14.0049 14.2150 14.2150 k = 0.5000 0.2887 0.0698 ( 3862 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0699 -18.0699 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6492 -8.6492 -8.6476 -8.6476 0.5341 0.5341 0.5510 0.5510 3.4295 3.4295 4.0610 4.0610 4.6884 4.6884 4.8381 4.8381 5.1267 5.1267 5.8723 5.8723 5.9521 5.9521 6.1017 6.1017 8.4108 8.4108 8.6355 8.6355 8.7997 8.7997 8.8233 8.8233 11.2430 11.2430 11.4007 11.4007 13.9154 13.9154 14.0101 14.0101 14.2141 14.2142 k = 0.5000 0.2887 0.0599 ( 3848 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0698 -18.0698 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6492 -8.6492 -8.6475 -8.6475 0.5334 0.5334 0.5516 0.5516 3.4144 3.4144 4.1116 4.1116 4.6692 4.6692 4.8421 4.8421 5.0786 5.0786 5.8695 5.8695 5.9554 5.9554 6.1339 6.1339 8.3951 8.3951 8.6292 8.6292 8.8065 8.8065 8.8388 8.8388 11.2346 11.2346 11.4041 11.4041 13.9123 13.9123 14.0149 14.0149 14.2134 14.2134 k = 0.5000 0.2887 0.0499 ( 3854 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0706 -18.0706 -18.0698 -18.0698 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6492 -8.6492 -8.6475 -8.6475 0.5328 0.5328 0.5521 0.5521 3.4015 3.4015 4.1626 4.1626 4.6460 4.6460 4.8455 4.8455 5.0364 5.0364 5.8671 5.8671 5.9581 5.9581 6.1617 6.1617 8.3814 8.3814 8.6238 8.6238 8.8121 8.8121 8.8523 8.8523 11.2273 11.2273 11.4068 11.4068 13.9096 13.9096 14.0192 14.0192 14.2127 14.2127 k = 0.5000 0.2887 0.0399 ( 3846 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0706 -18.0706 -18.0698 -18.0698 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6493 -8.6493 -8.6474 -8.6474 0.5324 0.5324 0.5526 0.5526 3.3911 3.3911 4.2135 4.2135 4.6184 4.6184 4.8484 4.8484 5.0013 5.0013 5.8651 5.8651 5.9604 5.9604 6.1848 6.1848 8.3700 8.3700 8.6192 8.6192 8.8167 8.8167 8.8637 8.8637 11.2211 11.2211 11.4089 11.4089 13.9073 13.9073 14.0230 14.0230 14.2122 14.2122 k = 0.5000 0.2887 0.0299 ( 3836 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0705 -18.0705 -18.0698 -18.0698 -17.5905 -17.5905 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6493 -8.6493 -8.6474 -8.6474 0.5320 0.5320 0.5529 0.5529 3.3829 3.3829 4.2633 4.2633 4.5866 4.5866 4.8507 4.8507 4.9740 4.9740 5.8635 5.8635 5.9622 5.9622 6.2030 6.2030 8.3610 8.3610 8.6156 8.6156 8.8203 8.8203 8.8727 8.8727 11.2162 11.2162 11.4105 11.4105 13.9056 13.9056 14.0261 14.0261 14.2118 14.2118 k = 0.5000 0.2887 0.0200 ( 3840 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0706 -18.0706 -18.0698 -18.0698 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6493 -8.6493 -8.6474 -8.6474 0.5317 0.5317 0.5532 0.5532 3.3770 3.3770 4.3100 4.3100 4.5525 4.5525 4.8523 4.8523 4.9547 4.9547 5.8623 5.8623 5.9635 5.9635 6.2161 6.2161 8.3545 8.3545 8.6130 8.6130 8.8229 8.8229 8.8793 8.8793 11.2125 11.2125 11.4116 11.4116 13.9043 13.9043 14.0284 14.0284 14.2115 14.2115 k = 0.5000 0.2887 0.0100 ( 3846 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0706 -18.0706 -18.0698 -18.0698 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6493 -8.6493 -8.6474 -8.6474 0.5315 0.5315 0.5533 0.5533 3.3735 3.3735 4.3484 4.3484 4.5214 4.5214 4.8533 4.8533 4.9434 4.9434 5.8616 5.8616 5.9643 5.9643 6.2241 6.2241 8.3505 8.3505 8.6115 8.6115 8.8244 8.8244 8.8832 8.8832 11.2103 11.2103 11.4123 11.4123 13.9035 13.9035 14.0298 14.0298 14.2113 14.2113 k = 0.5000 0.2887-0.0000 ( 3850 PWs) bands (ev): -38.9354 -38.9354 -38.9349 -38.9349 -18.0706 -18.0706 -18.0698 -18.0698 -17.5906 -17.5906 -17.5901 -17.5901 -17.3984 -17.3984 -17.3979 -17.3979 -8.6493 -8.6493 -8.6474 -8.6474 0.5315 0.5315 0.5534 0.5534 3.3723 3.3723 4.3653 4.3653 4.5069 4.5069 4.8536 4.8536 4.9396 4.9396 5.8613 5.8613 5.9645 5.9645 6.2267 6.2267 8.3492 8.3492 8.6109 8.6109 8.8249 8.8249 8.8845 8.8845 11.2096 11.2096 11.4125 11.4125 13.9033 13.9033 14.0303 14.0303 14.2112 14.2112 k = 0.3333 0.5774-0.0000 ( 3861 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6140 -8.6135 -8.5997 -8.5992 0.8651 0.8673 0.8688 0.8691 3.9226 3.9226 4.5340 4.5340 4.7371 4.7374 4.7404 4.7437 5.3889 5.3892 5.3963 5.4060 5.4264 5.4264 6.3260 6.3260 6.7446 6.7447 6.7470 6.7553 8.6618 8.6667 8.6668 8.6669 13.0810 13.0811 13.0851 13.0987 13.2052 13.2052 13.5320 13.5377 13.5378 13.5520 k = 0.3333 0.5774 0.0100 ( 3867 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6354 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6141 -8.6135 -8.5998 -8.5992 0.8651 0.8673 0.8688 0.8691 3.9236 3.9236 4.5312 4.5312 4.7372 4.7374 4.7405 4.7438 5.3888 5.3891 5.3963 5.4059 5.4299 5.4299 6.3242 6.3242 6.7446 6.7447 6.7470 6.7552 8.6618 8.6667 8.6668 8.6669 13.0812 13.0813 13.0854 13.0989 13.2061 13.2061 13.5318 13.5375 13.5375 13.5517 k = 0.3333 0.5774 0.0200 ( 3867 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6354 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6141 -8.6135 -8.5998 -8.5992 0.8651 0.8673 0.8688 0.8691 3.9265 3.9265 4.5228 4.5228 4.7374 4.7377 4.7407 4.7439 5.3886 5.3889 5.3962 5.4057 5.4402 5.4402 6.3192 6.3192 6.7445 6.7447 6.7469 6.7551 8.6619 8.6667 8.6668 8.6669 13.0818 13.0819 13.0860 13.0994 13.2090 13.2090 13.5313 13.5368 13.5369 13.5510 k = 0.3333 0.5774 0.0299 ( 3858 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5015 -17.5011 -17.4769 -17.4764 -8.6140 -8.6135 -8.5997 -8.5992 0.8651 0.8673 0.8688 0.8691 3.9312 3.9312 4.5094 4.5095 4.7378 4.7380 4.7410 4.7442 5.3882 5.3885 5.3961 5.4054 5.4569 5.4569 6.3108 6.3108 6.7444 6.7446 6.7468 6.7548 8.6621 8.6669 8.6669 8.6670 13.0828 13.0828 13.0871 13.1002 13.2137 13.2137 13.5304 13.5357 13.5358 13.5497 k = 0.3333 0.5774 0.0399 ( 3858 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5015 -17.5011 -17.4769 -17.4764 -8.6140 -8.6135 -8.5998 -8.5992 0.8652 0.8672 0.8688 0.8691 3.9379 3.9379 4.4916 4.4916 4.7382 4.7385 4.7415 4.7445 5.3877 5.3880 5.3959 5.4049 5.4792 5.4792 6.2990 6.2990 6.7443 6.7445 6.7467 6.7544 8.6624 8.6670 8.6671 8.6671 13.0841 13.0841 13.0886 13.1014 13.2203 13.2203 13.5292 13.5343 13.5343 13.5480 k = 0.3333 0.5774 0.0499 ( 3864 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6140 -8.6134 -8.5998 -8.5992 0.8652 0.8672 0.8688 0.8691 3.9464 3.9464 4.4700 4.4700 4.7388 4.7390 4.7420 4.7448 5.3871 5.3874 5.3958 5.4043 5.5065 5.5065 6.2841 6.2841 6.7442 6.7443 6.7466 6.7539 8.6627 8.6671 8.6672 8.6672 13.0857 13.0857 13.0904 13.1027 13.2286 13.2286 13.5278 13.5325 13.5325 13.5458 k = 0.3333 0.5774 0.0599 ( 3870 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6354 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6140 -8.6134 -8.5998 -8.5992 0.8652 0.8671 0.8687 0.8690 3.9568 3.9568 4.4454 4.4454 4.7394 4.7397 4.7425 4.7453 5.3863 5.3867 5.3956 5.4037 5.5380 5.5380 6.2660 6.2660 6.7440 6.7442 6.7464 6.7534 8.6630 8.6673 8.6673 8.6674 13.0875 13.0876 13.0926 13.1043 13.2387 13.2387 13.5263 13.5304 13.5305 13.5433 k = 0.3333 0.5774 0.0698 ( 3864 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5015 -17.5011 -17.4769 -17.4764 -8.6140 -8.6134 -8.5998 -8.5992 0.8653 0.8670 0.8687 0.8690 3.9690 3.9690 4.4185 4.4185 4.7401 4.7404 4.7432 4.7457 5.3855 5.3859 5.3954 5.4029 5.5729 5.5729 6.2450 6.2450 6.7438 6.7440 6.7463 6.7527 8.6635 8.6674 8.6675 8.6676 13.0895 13.0896 13.0949 13.1060 13.2505 13.2505 13.5246 13.5281 13.5282 13.5405 k = 0.3333 0.5774 0.0798 ( 3864 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5015 -17.5011 -17.4769 -17.4764 -8.6140 -8.6134 -8.5998 -8.5992 0.8653 0.8669 0.8687 0.8690 3.9830 3.9830 4.3900 4.3900 4.7409 4.7411 4.7439 4.7462 5.3847 5.3851 5.3952 5.4021 5.6105 5.6106 6.2210 6.2210 6.7437 6.7438 6.7462 6.7521 8.6639 8.6675 8.6677 8.6678 13.0916 13.0917 13.0975 13.1077 13.2639 13.2639 13.5228 13.5257 13.5257 13.5376 k = 0.3333 0.5774 0.0898 ( 3864 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5015 -17.5011 -17.4769 -17.4764 -8.6140 -8.6134 -8.5998 -8.5993 0.8654 0.8668 0.8687 0.8690 3.9988 3.9988 4.3604 4.3604 4.7416 4.7419 4.7446 4.7466 5.3839 5.3842 5.3951 5.4013 5.6502 5.6502 6.1943 6.1943 6.7435 6.7436 6.7461 6.7514 8.6643 8.6675 8.6679 8.6680 13.0938 13.0938 13.1001 13.1093 13.2788 13.2788 13.5212 13.5231 13.5232 13.5345 k = 0.3333 0.5774 0.0998 ( 3864 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5015 -17.5011 -17.4769 -17.4764 -8.6139 -8.6134 -8.5999 -8.5993 0.8654 0.8667 0.8687 0.8690 4.0163 4.0163 4.3301 4.3301 4.7423 4.7426 4.7452 4.7471 5.3831 5.3835 5.3950 5.4004 5.6914 5.6914 6.1650 6.1650 6.7433 6.7435 6.7461 6.7507 8.6648 8.6676 8.6681 8.6682 13.0958 13.0959 13.1027 13.1109 13.2951 13.2951 13.5197 13.5205 13.5205 13.5314 k = 0.3333 0.5774 0.1097 ( 3858 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5015 -17.5011 -17.4769 -17.4764 -8.6139 -8.6133 -8.5999 -8.5993 0.8655 0.8666 0.8687 0.8689 4.0354 4.0354 4.2997 4.2997 4.7430 4.7433 4.7459 4.7475 5.3824 5.3827 5.3950 5.3996 5.7336 5.7336 6.1333 6.1333 6.7431 6.7433 6.7461 6.7500 8.6652 8.6676 8.6683 8.6684 13.0978 13.0978 13.1052 13.1122 13.3127 13.3127 13.5170 13.5172 13.5184 13.5285 k = 0.3333 0.5774 0.1197 ( 3858 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5015 -17.5011 -17.4769 -17.4764 -8.6139 -8.6133 -8.5999 -8.5993 0.8656 0.8665 0.8686 0.8689 4.0562 4.0562 4.2693 4.2694 4.7436 4.7439 4.7465 4.7478 5.3817 5.3821 5.3950 5.3988 5.7764 5.7764 6.0995 6.0995 6.7430 6.7432 6.7462 6.7494 8.6657 8.6676 8.6685 8.6685 13.0995 13.0995 13.1075 13.1133 13.3315 13.3315 13.5073 13.5092 13.5174 13.5254 k = 0.3333 0.5774 0.1297 ( 3864 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6139 -8.6133 -8.5999 -8.5993 0.8657 0.8664 0.8686 0.8689 4.0784 4.0784 4.2394 4.2394 4.7441 4.7444 4.7470 4.7480 5.3812 5.3815 5.3951 5.3980 5.8194 5.8194 6.0636 6.0636 6.7429 6.7431 6.7463 6.7487 8.6661 8.6675 8.6686 8.6687 13.1009 13.1009 13.1096 13.1141 13.3514 13.3514 13.4853 13.4882 13.5168 13.5176 k = 0.3333 0.5774 0.1397 ( 3861 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4764 -8.6139 -8.6133 -8.5999 -8.5993 0.8657 0.8663 0.8686 0.8689 4.1021 4.1021 4.2101 4.2101 4.7445 4.7447 4.7474 4.7481 5.3808 5.3812 5.3954 5.3973 5.8622 5.8622 6.0259 6.0259 6.7428 6.7430 6.7465 6.7482 8.6664 8.6674 8.6687 8.6688 13.1019 13.1020 13.1114 13.1144 13.3721 13.3722 13.4625 13.4626 13.5159 13.5164 k = 0.3333 0.5774 0.1496 ( 3870 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5011 -17.4769 -17.4765 -8.6139 -8.6133 -8.5999 -8.5994 0.8658 0.8661 0.8686 0.8688 4.1270 4.1270 4.1818 4.1818 4.7446 4.7449 4.7477 4.7481 5.3806 5.3809 5.3957 5.3967 5.9045 5.9045 5.9867 5.9867 6.7428 6.7429 6.7468 6.7477 8.6667 8.6672 8.6687 8.6688 13.1026 13.1026 13.1128 13.1143 13.3935 13.3936 13.4397 13.4398 13.5150 13.5152 k = 0.3333 0.5774 0.1596 ( 3876 PWs) bands (ev): -38.9291 -38.9291 -38.9286 -38.9286 -18.0786 -18.0782 -18.0091 -18.0086 -17.6358 -17.6353 -17.5341 -17.5336 -17.5016 -17.5012 -17.4769 -17.4765 -8.6139 -8.6133 -8.5999 -8.5994 0.8658 0.8661 0.8686 0.8688 4.1488 4.1491 4.1586 4.1588 4.7447 4.7450 4.7478 4.7481 5.3805 5.3808 5.3959 5.3963 5.9439 5.9440 5.9482 5.9484 6.7427 6.7429 6.7471 6.7473 8.6670 8.6670 8.6687 8.6688 13.1028 13.1029 13.1138 13.1138 13.4114 13.4115 13.4213 13.4214 13.5147 13.5152 Writing output data file ScAlCO.save init_run : 1.22s CPU 0.71s WALL ( 1 calls) electrons : 582.76s CPU 475.37s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.13s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 582.76s CPU 475.36s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.34s CPU 0.19s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.47s CPU 0.63s WALL ( 365 calls) cegterg : 531.44s CPU 444.90s WALL ( 1262 calls) Called by sum_band: Called by *egterg: h_psi : 274.44s CPU 198.71s WALL ( 23455 calls) s_psi : 32.24s CPU 25.47s WALL ( 23455 calls) g_psi : 0.63s CPU 0.51s WALL ( 21828 calls) cdiaghg : 212.09s CPU 196.94s WALL ( 22193 calls) cegterg:over : 19.22s CPU 16.11s WALL ( 21828 calls) cegterg:upda : 18.57s CPU 16.33s WALL ( 21828 calls) cegterg:last : 6.58s CPU 5.83s WALL ( 2394 calls) cdiaghg:chol : 11.45s CPU 11.09s WALL ( 22193 calls) cdiaghg:inve : 7.58s CPU 7.42s WALL ( 22193 calls) cdiaghg:para : 11.98s CPU 11.39s WALL ( 44386 calls) Called by h_psi: h_psi:vloc : 224.02s CPU 159.21s WALL ( 23455 calls) h_psi:vnl : 49.80s CPU 38.98s WALL ( 23455 calls) add_vuspsi : 28.54s CPU 21.90s WALL ( 23455 calls) General routines calbec : 21.14s CPU 17.01s WALL ( 23455 calls) fft : 0.07s CPU 0.04s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 210.77s CPU 148.51s WALL ( 1705432 calls) interpolate : 0.02s CPU 0.01s WALL ( 4 calls) davcio : 0.48s CPU 1.06s WALL ( 730 calls) Parallel routines fft_scatter : 82.06s CPU 64.57s WALL ( 1705455 calls) PWSCF : 10m 3.10s CPU 8m25.96s WALL This run was terminated on: 2:43:56 12Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=