Program PWSCF v.5.1.1 starts on 29Aug2015 at 15:16:24 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BeAu.save/ file Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 91 36 10 4575 1148 176 Max 92 37 11 4584 1167 183 Sum 4397 1757 505 219799 55467 8601 bravais-lattice index = 14 lattice parameter (alat) = 8.8212 a.u. unit-cell volume = 686.4186 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 71.0000 Ry charge density cutoff = 711.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.821241 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.000000 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 1.000000 ) PseudoPot. # 1 for Be read from file: /home/autes/Pseudo/Be.rel-pbe-sl-rrkjus_psl.1.0.0.UPF MD5 check sum: 3d54b317f5f631cde3ecbcbec2334fee Pseudo is Ultrasoft, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1041 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 Au read from file: /home/autes/Pseudo/Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d39daeb1f194fdf5670f47ad6d8ea3dd 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 1279 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 Be 4.00 9.01220 Be( 1.00) Au 11.00 196.96660 Au( 1.00) 3 Sym. Ops. (no inversion) found (note: 9 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 - cart. axis [-1,-1,-1] cryst. s( 2) = ( 0 0 1 ) ( 1 0 0 ) ( 0 1 0 ) cart. s( 2) = ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) isym = 3 120 deg rotation - cart. axis [1,1,1] cryst. s( 3) = ( 0 1 0 ) ( 0 0 1 ) ( 1 0 0 ) cart. s( 3) = ( 0.0000000 0.0000000 1.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) double point group C_3 (3) there are 6 classes and 3 irreducible representations the character table: E -E C3 -C3 C3^2 -C3^2 G_4 1.00 -1.00 0.50 -0.50 0.50 -0.50 G_5 1.00 -1.00 0.50 -0.50 0.50 -0.50 G_6 1.00 -1.00 -1.00 1.00 -1.00 1.00 imaginary part E -E C3 -C3 C3^2 -C3^2 G_4 0.00 0.00 0.87 -0.87 -0.87 0.87 G_5 0.00 0.00 -0.87 0.87 0.87 -0.87 G_6 0.00 0.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 C3^2 2 C3 3 -E -1 -C3^2 -2 -C3 -3 Cartesian axes number of k points= 263 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038023 k( 2) = ( 0.0000000 0.0147059 -0.0000000), wk = 0.0038023 k( 3) = ( 0.0000000 0.0294118 -0.0000000), wk = 0.0038023 k( 4) = ( 0.0000000 0.0441177 -0.0000000), wk = 0.0038023 k( 5) = ( 0.0000000 0.0588235 -0.0000000), wk = 0.0038023 k( 6) = ( 0.0000000 0.0735294 -0.0000000), wk = 0.0038023 k( 7) = ( 0.0000000 0.0882353 -0.0000000), wk = 0.0038023 k( 8) = ( 0.0000000 0.1029412 -0.0000000), wk = 0.0038023 k( 9) = ( 0.0000000 0.1176471 -0.0000000), wk = 0.0038023 k( 10) = ( 0.0000000 0.1323529 -0.0000000), wk = 0.0038023 k( 11) = ( 0.0000000 0.1470588 -0.0000000), wk = 0.0038023 k( 12) = ( 0.0000000 0.1617647 -0.0000000), wk = 0.0038023 k( 13) = ( 0.0000000 0.1764706 -0.0000000), wk = 0.0038023 k( 14) = ( 0.0000000 0.1911765 -0.0000000), wk = 0.0038023 k( 15) = ( 0.0000000 0.2058823 -0.0000000), wk = 0.0038023 k( 16) = ( 0.0000000 0.2205882 -0.0000000), wk = 0.0038023 k( 17) = ( 0.0000000 0.2352941 -0.0000000), wk = 0.0038023 k( 18) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0038023 k( 19) = ( 0.0000000 0.2647059 -0.0000000), wk = 0.0038023 k( 20) = ( 0.0000000 0.2794118 -0.0000000), wk = 0.0038023 k( 21) = ( 0.0000000 0.2941177 -0.0000000), wk = 0.0038023 k( 22) = ( 0.0000000 0.3088235 -0.0000000), wk = 0.0038023 k( 23) = ( 0.0000000 0.3235294 -0.0000000), wk = 0.0038023 k( 24) = ( 0.0000000 0.3382353 -0.0000000), wk = 0.0038023 k( 25) = ( 0.0000000 0.3529412 -0.0000000), wk = 0.0038023 k( 26) = ( 0.0000000 0.3676471 -0.0000000), wk = 0.0038023 k( 27) = ( 0.0000000 0.3823529 -0.0000000), wk = 0.0038023 k( 28) = ( 0.0000000 0.3970588 -0.0000000), wk = 0.0038023 k( 29) = ( 0.0000000 0.4117647 -0.0000000), wk = 0.0038023 k( 30) = ( 0.0000000 0.4264706 -0.0000000), wk = 0.0038023 k( 31) = ( 0.0000000 0.4411765 -0.0000000), wk = 0.0038023 k( 32) = ( 0.0000000 0.4558823 -0.0000000), wk = 0.0038023 k( 33) = ( 0.0000000 0.4705882 -0.0000000), wk = 0.0038023 k( 34) = ( 0.0000000 0.4852941 -0.0000000), wk = 0.0038023 k( 35) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0038023 k( 36) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0038023 k( 37) = ( 0.0147059 0.5000000 -0.0000000), wk = 0.0038023 k( 38) = ( 0.0294118 0.5000000 -0.0000000), wk = 0.0038023 k( 39) = ( 0.0441177 0.5000000 -0.0000000), wk = 0.0038023 k( 40) = ( 0.0588235 0.5000000 -0.0000000), wk = 0.0038023 k( 41) = ( 0.0735294 0.5000000 -0.0000000), wk = 0.0038023 k( 42) = ( 0.0882353 0.5000000 -0.0000000), wk = 0.0038023 k( 43) = ( 0.1029412 0.5000000 -0.0000000), wk = 0.0038023 k( 44) = ( 0.1176471 0.5000000 -0.0000000), wk = 0.0038023 k( 45) = ( 0.1323529 0.5000000 -0.0000000), wk = 0.0038023 k( 46) = ( 0.1470588 0.5000000 -0.0000000), wk = 0.0038023 k( 47) = ( 0.1617647 0.5000000 -0.0000000), wk = 0.0038023 k( 48) = ( 0.1764706 0.5000000 -0.0000000), wk = 0.0038023 k( 49) = ( 0.1911765 0.5000000 -0.0000000), wk = 0.0038023 k( 50) = ( 0.2058823 0.5000000 -0.0000000), wk = 0.0038023 k( 51) = ( 0.2205882 0.5000000 -0.0000000), wk = 0.0038023 k( 52) = ( 0.2352941 0.5000000 -0.0000000), wk = 0.0038023 k( 53) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0038023 k( 54) = ( 0.2647059 0.5000000 -0.0000000), wk = 0.0038023 k( 55) = ( 0.2794118 0.5000000 -0.0000000), wk = 0.0038023 k( 56) = ( 0.2941177 0.5000000 -0.0000000), wk = 0.0038023 k( 57) = ( 0.3088235 0.5000000 -0.0000000), wk = 0.0038023 k( 58) = ( 0.3235294 0.5000000 -0.0000000), wk = 0.0038023 k( 59) = ( 0.3382353 0.5000000 -0.0000000), wk = 0.0038023 k( 60) = ( 0.3529412 0.5000000 -0.0000000), wk = 0.0038023 k( 61) = ( 0.3676471 0.5000000 -0.0000000), wk = 0.0038023 k( 62) = ( 0.3823529 0.5000000 -0.0000000), wk = 0.0038023 k( 63) = ( 0.3970588 0.5000000 -0.0000000), wk = 0.0038023 k( 64) = ( 0.4117647 0.5000000 -0.0000000), wk = 0.0038023 k( 65) = ( 0.4264706 0.5000000 -0.0000000), wk = 0.0038023 k( 66) = ( 0.4411765 0.5000000 -0.0000000), wk = 0.0038023 k( 67) = ( 0.4558823 0.5000000 -0.0000000), wk = 0.0038023 k( 68) = ( 0.4705882 0.5000000 -0.0000000), wk = 0.0038023 k( 69) = ( 0.4852941 0.5000000 -0.0000000), wk = 0.0038023 k( 70) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0038023 k( 71) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0038023 k( 72) = ( 0.4895833 0.4895833 -0.0000000), wk = 0.0038023 k( 73) = ( 0.4791667 0.4791667 -0.0000000), wk = 0.0038023 k( 74) = ( 0.4687500 0.4687500 -0.0000000), wk = 0.0038023 k( 75) = ( 0.4583333 0.4583333 -0.0000000), wk = 0.0038023 k( 76) = ( 0.4479167 0.4479167 -0.0000000), wk = 0.0038023 k( 77) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0038023 k( 78) = ( 0.4270833 0.4270833 -0.0000000), wk = 0.0038023 k( 79) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0038023 k( 80) = ( 0.4062500 0.4062500 -0.0000000), wk = 0.0038023 k( 81) = ( 0.3958333 0.3958333 -0.0000000), wk = 0.0038023 k( 82) = ( 0.3854167 0.3854167 -0.0000000), wk = 0.0038023 k( 83) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0038023 k( 84) = ( 0.3645833 0.3645833 -0.0000000), wk = 0.0038023 k( 85) = ( 0.3541667 0.3541667 -0.0000000), wk = 0.0038023 k( 86) = ( 0.3437500 0.3437500 -0.0000000), wk = 0.0038023 k( 87) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0038023 k( 88) = ( 0.3229167 0.3229167 -0.0000000), wk = 0.0038023 k( 89) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0038023 k( 90) = ( 0.3020833 0.3020833 -0.0000000), wk = 0.0038023 k( 91) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0038023 k( 92) = ( 0.2812500 0.2812500 -0.0000000), wk = 0.0038023 k( 93) = ( 0.2708333 0.2708333 -0.0000000), wk = 0.0038023 k( 94) = ( 0.2604167 0.2604167 -0.0000000), wk = 0.0038023 k( 95) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0038023 k( 96) = ( 0.2395833 0.2395833 -0.0000000), wk = 0.0038023 k( 97) = ( 0.2291667 0.2291667 -0.0000000), wk = 0.0038023 k( 98) = ( 0.2187500 0.2187500 -0.0000000), wk = 0.0038023 k( 99) = ( 0.2083333 0.2083333 -0.0000000), wk = 0.0038023 k( 100) = ( 0.1979167 0.1979167 -0.0000000), wk = 0.0038023 k( 101) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0038023 k( 102) = ( 0.1770833 0.1770833 -0.0000000), wk = 0.0038023 k( 103) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0038023 k( 104) = ( 0.1562500 0.1562500 -0.0000000), wk = 0.0038023 k( 105) = ( 0.1458333 0.1458333 -0.0000000), wk = 0.0038023 k( 106) = ( 0.1354167 0.1354167 -0.0000000), wk = 0.0038023 k( 107) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0038023 k( 108) = ( 0.1145833 0.1145833 -0.0000000), wk = 0.0038023 k( 109) = ( 0.1041667 0.1041667 -0.0000000), wk = 0.0038023 k( 110) = ( 0.0937500 0.0937500 -0.0000000), wk = 0.0038023 k( 111) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0038023 k( 112) = ( 0.0729167 0.0729167 -0.0000000), wk = 0.0038023 k( 113) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0038023 k( 114) = ( 0.0520833 0.0520833 -0.0000000), wk = 0.0038023 k( 115) = ( 0.0416667 0.0416667 -0.0000000), wk = 0.0038023 k( 116) = ( 0.0312500 0.0312500 -0.0000000), wk = 0.0038023 k( 117) = ( 0.0208333 0.0208333 -0.0000000), wk = 0.0038023 k( 118) = ( 0.0104167 0.0104167 -0.0000000), wk = 0.0038023 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038023 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038023 k( 121) = ( 0.0084746 0.0084746 0.0084746), wk = 0.0038023 k( 122) = ( 0.0169491 0.0169491 0.0169491), wk = 0.0038023 k( 123) = ( 0.0254237 0.0254237 0.0254237), wk = 0.0038023 k( 124) = ( 0.0338983 0.0338983 0.0338983), wk = 0.0038023 k( 125) = ( 0.0423729 0.0423729 0.0423729), wk = 0.0038023 k( 126) = ( 0.0508475 0.0508475 0.0508475), wk = 0.0038023 k( 127) = ( 0.0593220 0.0593220 0.0593220), wk = 0.0038023 k( 128) = ( 0.0677966 0.0677966 0.0677966), wk = 0.0038023 k( 129) = ( 0.0762712 0.0762712 0.0762712), wk = 0.0038023 k( 130) = ( 0.0847458 0.0847458 0.0847458), wk = 0.0038023 k( 131) = ( 0.0932203 0.0932203 0.0932203), wk = 0.0038023 k( 132) = ( 0.1016949 0.1016949 0.1016949), wk = 0.0038023 k( 133) = ( 0.1101695 0.1101695 0.1101695), wk = 0.0038023 k( 134) = ( 0.1186441 0.1186441 0.1186441), wk = 0.0038023 k( 135) = ( 0.1271186 0.1271186 0.1271186), wk = 0.0038023 k( 136) = ( 0.1355932 0.1355932 0.1355932), wk = 0.0038023 k( 137) = ( 0.1440678 0.1440678 0.1440678), wk = 0.0038023 k( 138) = ( 0.1525424 0.1525424 0.1525424), wk = 0.0038023 k( 139) = ( 0.1610169 0.1610169 0.1610169), wk = 0.0038023 k( 140) = ( 0.1694915 0.1694915 0.1694915), wk = 0.0038023 k( 141) = ( 0.1779661 0.1779661 0.1779661), wk = 0.0038023 k( 142) = ( 0.1864407 0.1864407 0.1864407), wk = 0.0038023 k( 143) = ( 0.1949153 0.1949152 0.1949152), wk = 0.0038023 k( 144) = ( 0.2033898 0.2033898 0.2033898), wk = 0.0038023 k( 145) = ( 0.2118644 0.2118644 0.2118644), wk = 0.0038023 k( 146) = ( 0.2203390 0.2203390 0.2203390), wk = 0.0038023 k( 147) = ( 0.2288136 0.2288136 0.2288136), wk = 0.0038023 k( 148) = ( 0.2372881 0.2372881 0.2372881), wk = 0.0038023 k( 149) = ( 0.2457627 0.2457627 0.2457627), wk = 0.0038023 k( 150) = ( 0.2542373 0.2542373 0.2542373), wk = 0.0038023 k( 151) = ( 0.2627119 0.2627119 0.2627119), wk = 0.0038023 k( 152) = ( 0.2711864 0.2711864 0.2711864), wk = 0.0038023 k( 153) = ( 0.2796610 0.2796610 0.2796610), wk = 0.0038023 k( 154) = ( 0.2881356 0.2881356 0.2881356), wk = 0.0038023 k( 155) = ( 0.2966102 0.2966102 0.2966102), wk = 0.0038023 k( 156) = ( 0.3050848 0.3050847 0.3050847), wk = 0.0038023 k( 157) = ( 0.3135593 0.3135593 0.3135593), wk = 0.0038023 k( 158) = ( 0.3220339 0.3220339 0.3220339), wk = 0.0038023 k( 159) = ( 0.3305085 0.3305085 0.3305085), wk = 0.0038023 k( 160) = ( 0.3389831 0.3389830 0.3389830), wk = 0.0038023 k( 161) = ( 0.3474576 0.3474576 0.3474576), wk = 0.0038023 k( 162) = ( 0.3559322 0.3559322 0.3559322), wk = 0.0038023 k( 163) = ( 0.3644068 0.3644068 0.3644068), wk = 0.0038023 k( 164) = ( 0.3728814 0.3728814 0.3728814), wk = 0.0038023 k( 165) = ( 0.3813559 0.3813559 0.3813559), wk = 0.0038023 k( 166) = ( 0.3898305 0.3898305 0.3898305), wk = 0.0038023 k( 167) = ( 0.3983051 0.3983051 0.3983051), wk = 0.0038023 k( 168) = ( 0.4067797 0.4067797 0.4067797), wk = 0.0038023 k( 169) = ( 0.4152542 0.4152542 0.4152542), wk = 0.0038023 k( 170) = ( 0.4237288 0.4237288 0.4237288), wk = 0.0038023 k( 171) = ( 0.4322034 0.4322034 0.4322034), wk = 0.0038023 k( 172) = ( 0.4406780 0.4406780 0.4406780), wk = 0.0038023 k( 173) = ( 0.4491525 0.4491525 0.4491525), wk = 0.0038023 k( 174) = ( 0.4576271 0.4576271 0.4576271), wk = 0.0038023 k( 175) = ( 0.4661017 0.4661017 0.4661017), wk = 0.0038023 k( 176) = ( 0.4745763 0.4745763 0.4745763), wk = 0.0038023 k( 177) = ( 0.4830508 0.4830508 0.4830508), wk = 0.0038023 k( 178) = ( 0.4915254 0.4915254 0.4915254), wk = 0.0038023 k( 179) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038023 k( 180) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038023 k( 181) = ( 0.4895833 0.5000000 0.4895833), wk = 0.0038023 k( 182) = ( 0.4791667 0.5000000 0.4791667), wk = 0.0038023 k( 183) = ( 0.4687500 0.5000000 0.4687500), wk = 0.0038023 k( 184) = ( 0.4583333 0.5000000 0.4583333), wk = 0.0038023 k( 185) = ( 0.4479167 0.5000000 0.4479167), wk = 0.0038023 k( 186) = ( 0.4375000 0.5000000 0.4375000), wk = 0.0038023 k( 187) = ( 0.4270833 0.5000000 0.4270833), wk = 0.0038023 k( 188) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0038023 k( 189) = ( 0.4062500 0.5000000 0.4062500), wk = 0.0038023 k( 190) = ( 0.3958333 0.5000000 0.3958333), wk = 0.0038023 k( 191) = ( 0.3854167 0.5000000 0.3854167), wk = 0.0038023 k( 192) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0038023 k( 193) = ( 0.3645833 0.5000000 0.3645833), wk = 0.0038023 k( 194) = ( 0.3541667 0.5000000 0.3541667), wk = 0.0038023 k( 195) = ( 0.3437500 0.5000000 0.3437500), wk = 0.0038023 k( 196) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0038023 k( 197) = ( 0.3229167 0.5000000 0.3229167), wk = 0.0038023 k( 198) = ( 0.3125000 0.5000000 0.3125000), wk = 0.0038023 k( 199) = ( 0.3020833 0.5000000 0.3020833), wk = 0.0038023 k( 200) = ( 0.2916667 0.5000000 0.2916667), wk = 0.0038023 k( 201) = ( 0.2812500 0.5000000 0.2812500), wk = 0.0038023 k( 202) = ( 0.2708333 0.5000000 0.2708333), wk = 0.0038023 k( 203) = ( 0.2604167 0.5000000 0.2604167), wk = 0.0038023 k( 204) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0038023 k( 205) = ( 0.2395833 0.5000000 0.2395833), wk = 0.0038023 k( 206) = ( 0.2291667 0.5000000 0.2291667), wk = 0.0038023 k( 207) = ( 0.2187500 0.5000000 0.2187500), wk = 0.0038023 k( 208) = ( 0.2083333 0.5000000 0.2083333), wk = 0.0038023 k( 209) = ( 0.1979167 0.5000000 0.1979167), wk = 0.0038023 k( 210) = ( 0.1875000 0.5000000 0.1875000), wk = 0.0038023 k( 211) = ( 0.1770833 0.5000000 0.1770833), wk = 0.0038023 k( 212) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0038023 k( 213) = ( 0.1562500 0.5000000 0.1562500), wk = 0.0038023 k( 214) = ( 0.1458333 0.5000000 0.1458333), wk = 0.0038023 k( 215) = ( 0.1354167 0.5000000 0.1354167), wk = 0.0038023 k( 216) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0038023 k( 217) = ( 0.1145833 0.5000000 0.1145833), wk = 0.0038023 k( 218) = ( 0.1041667 0.5000000 0.1041667), wk = 0.0038023 k( 219) = ( 0.0937500 0.5000000 0.0937500), wk = 0.0038023 k( 220) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0038023 k( 221) = ( 0.0729167 0.5000000 0.0729167), wk = 0.0038023 k( 222) = ( 0.0625000 0.5000000 0.0625000), wk = 0.0038023 k( 223) = ( 0.0520833 0.5000000 0.0520833), wk = 0.0038023 k( 224) = ( 0.0416667 0.5000000 0.0416667), wk = 0.0038023 k( 225) = ( 0.0312500 0.5000000 0.0312500), wk = 0.0038023 k( 226) = ( 0.0208333 0.5000000 0.0208333), wk = 0.0038023 k( 227) = ( 0.0104167 0.5000000 0.0104167), wk = 0.0038023 k( 228) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0038023 k( 229) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0038023 k( 230) = ( 0.5000000 0.5000000 0.0147059), wk = 0.0038023 k( 231) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0038023 k( 232) = ( 0.5000000 0.5000000 0.0441176), wk = 0.0038023 k( 233) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0038023 k( 234) = ( 0.5000000 0.5000000 0.0735294), wk = 0.0038023 k( 235) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0038023 k( 236) = ( 0.5000000 0.5000000 0.1029412), wk = 0.0038023 k( 237) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0038023 k( 238) = ( 0.5000000 0.5000000 0.1323529), wk = 0.0038023 k( 239) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0038023 k( 240) = ( 0.5000000 0.5000000 0.1617647), wk = 0.0038023 k( 241) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0038023 k( 242) = ( 0.5000000 0.5000000 0.1911765), wk = 0.0038023 k( 243) = ( 0.5000000 0.5000000 0.2058823), wk = 0.0038023 k( 244) = ( 0.5000000 0.5000000 0.2205882), wk = 0.0038023 k( 245) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0038023 k( 246) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0038023 k( 247) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0038023 k( 248) = ( 0.5000000 0.5000000 0.2794118), wk = 0.0038023 k( 249) = ( 0.5000000 0.5000000 0.2941176), wk = 0.0038023 k( 250) = ( 0.5000000 0.5000000 0.3088235), wk = 0.0038023 k( 251) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0038023 k( 252) = ( 0.5000000 0.5000000 0.3382353), wk = 0.0038023 k( 253) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0038023 k( 254) = ( 0.5000000 0.5000000 0.3676471), wk = 0.0038023 k( 255) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0038023 k( 256) = ( 0.5000000 0.5000000 0.3970588), wk = 0.0038023 k( 257) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0038023 k( 258) = ( 0.5000000 0.5000000 0.4264706), wk = 0.0038023 k( 259) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0038023 k( 260) = ( 0.5000000 0.5000000 0.4558823), wk = 0.0038023 k( 261) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0038023 k( 262) = ( 0.5000000 0.5000000 0.4852941), wk = 0.0038023 k( 263) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038023 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038023 k( 2) = ( 0.0000000 0.0147059 0.0000000), wk = 0.0038023 k( 3) = ( 0.0000000 0.0294118 0.0000000), wk = 0.0038023 k( 4) = ( 0.0000000 0.0441177 0.0000000), wk = 0.0038023 k( 5) = ( 0.0000000 0.0588235 0.0000000), wk = 0.0038023 k( 6) = ( 0.0000000 0.0735294 0.0000000), wk = 0.0038023 k( 7) = ( 0.0000000 0.0882353 0.0000000), wk = 0.0038023 k( 8) = ( 0.0000000 0.1029412 0.0000000), wk = 0.0038023 k( 9) = ( 0.0000000 0.1176471 0.0000000), wk = 0.0038023 k( 10) = ( 0.0000000 0.1323529 0.0000000), wk = 0.0038023 k( 11) = ( 0.0000000 0.1470588 0.0000000), wk = 0.0038023 k( 12) = ( 0.0000000 0.1617647 0.0000000), wk = 0.0038023 k( 13) = ( 0.0000000 0.1764706 0.0000000), wk = 0.0038023 k( 14) = ( 0.0000000 0.1911765 0.0000000), wk = 0.0038023 k( 15) = ( 0.0000000 0.2058823 0.0000000), wk = 0.0038023 k( 16) = ( 0.0000000 0.2205882 0.0000000), wk = 0.0038023 k( 17) = ( 0.0000000 0.2352941 0.0000000), wk = 0.0038023 k( 18) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0038023 k( 19) = ( 0.0000000 0.2647059 0.0000000), wk = 0.0038023 k( 20) = ( 0.0000000 0.2794118 0.0000000), wk = 0.0038023 k( 21) = ( 0.0000000 0.2941177 0.0000000), wk = 0.0038023 k( 22) = ( 0.0000000 0.3088235 0.0000000), wk = 0.0038023 k( 23) = ( 0.0000000 0.3235294 0.0000000), wk = 0.0038023 k( 24) = ( 0.0000000 0.3382353 0.0000000), wk = 0.0038023 k( 25) = ( 0.0000000 0.3529412 0.0000000), wk = 0.0038023 k( 26) = ( 0.0000000 0.3676471 0.0000000), wk = 0.0038023 k( 27) = ( 0.0000000 0.3823529 0.0000000), wk = 0.0038023 k( 28) = ( 0.0000000 0.3970588 0.0000000), wk = 0.0038023 k( 29) = ( 0.0000000 0.4117647 0.0000000), wk = 0.0038023 k( 30) = ( 0.0000000 0.4264706 0.0000000), wk = 0.0038023 k( 31) = ( 0.0000000 0.4411765 0.0000000), wk = 0.0038023 k( 32) = ( 0.0000000 0.4558823 0.0000000), wk = 0.0038023 k( 33) = ( 0.0000000 0.4705882 0.0000000), wk = 0.0038023 k( 34) = ( 0.0000000 0.4852941 0.0000000), wk = 0.0038023 k( 35) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0038023 k( 36) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0038023 k( 37) = ( 0.0147059 0.5000000 0.0000000), wk = 0.0038023 k( 38) = ( 0.0294118 0.5000000 0.0000000), wk = 0.0038023 k( 39) = ( 0.0441177 0.5000000 0.0000000), wk = 0.0038023 k( 40) = ( 0.0588235 0.5000000 0.0000000), wk = 0.0038023 k( 41) = ( 0.0735294 0.5000000 0.0000000), wk = 0.0038023 k( 42) = ( 0.0882353 0.5000000 0.0000000), wk = 0.0038023 k( 43) = ( 0.1029412 0.5000000 0.0000000), wk = 0.0038023 k( 44) = ( 0.1176471 0.5000000 0.0000000), wk = 0.0038023 k( 45) = ( 0.1323529 0.5000000 0.0000000), wk = 0.0038023 k( 46) = ( 0.1470588 0.5000000 0.0000000), wk = 0.0038023 k( 47) = ( 0.1617647 0.5000000 0.0000000), wk = 0.0038023 k( 48) = ( 0.1764706 0.5000000 0.0000000), wk = 0.0038023 k( 49) = ( 0.1911765 0.5000000 0.0000000), wk = 0.0038023 k( 50) = ( 0.2058823 0.5000000 0.0000000), wk = 0.0038023 k( 51) = ( 0.2205882 0.5000000 0.0000000), wk = 0.0038023 k( 52) = ( 0.2352941 0.5000000 0.0000000), wk = 0.0038023 k( 53) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0038023 k( 54) = ( 0.2647059 0.5000000 0.0000000), wk = 0.0038023 k( 55) = ( 0.2794118 0.5000000 0.0000000), wk = 0.0038023 k( 56) = ( 0.2941177 0.5000000 0.0000000), wk = 0.0038023 k( 57) = ( 0.3088235 0.5000000 0.0000000), wk = 0.0038023 k( 58) = ( 0.3235294 0.5000000 -0.0000000), wk = 0.0038023 k( 59) = ( 0.3382353 0.5000000 0.0000000), wk = 0.0038023 k( 60) = ( 0.3529412 0.5000000 0.0000000), wk = 0.0038023 k( 61) = ( 0.3676471 0.5000000 0.0000000), wk = 0.0038023 k( 62) = ( 0.3823529 0.5000000 0.0000000), wk = 0.0038023 k( 63) = ( 0.3970588 0.5000000 -0.0000000), wk = 0.0038023 k( 64) = ( 0.4117647 0.5000000 0.0000000), wk = 0.0038023 k( 65) = ( 0.4264706 0.5000000 0.0000000), wk = 0.0038023 k( 66) = ( 0.4411765 0.5000000 0.0000000), wk = 0.0038023 k( 67) = ( 0.4558823 0.5000000 0.0000000), wk = 0.0038023 k( 68) = ( 0.4705882 0.5000000 0.0000000), wk = 0.0038023 k( 69) = ( 0.4852941 0.5000000 0.0000000), wk = 0.0038023 k( 70) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0038023 k( 71) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0038023 k( 72) = ( 0.4895833 0.4895833 0.0000000), wk = 0.0038023 k( 73) = ( 0.4791667 0.4791667 0.0000000), wk = 0.0038023 k( 74) = ( 0.4687500 0.4687500 0.0000000), wk = 0.0038023 k( 75) = ( 0.4583333 0.4583333 0.0000000), wk = 0.0038023 k( 76) = ( 0.4479167 0.4479167 0.0000000), wk = 0.0038023 k( 77) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0038023 k( 78) = ( 0.4270833 0.4270833 0.0000000), wk = 0.0038023 k( 79) = ( 0.4166667 0.4166667 0.0000000), wk = 0.0038023 k( 80) = ( 0.4062500 0.4062500 0.0000000), wk = 0.0038023 k( 81) = ( 0.3958333 0.3958333 0.0000000), wk = 0.0038023 k( 82) = ( 0.3854167 0.3854167 -0.0000000), wk = 0.0038023 k( 83) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0038023 k( 84) = ( 0.3645833 0.3645833 0.0000000), wk = 0.0038023 k( 85) = ( 0.3541667 0.3541667 0.0000000), wk = 0.0038023 k( 86) = ( 0.3437500 0.3437500 -0.0000000), wk = 0.0038023 k( 87) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0038023 k( 88) = ( 0.3229167 0.3229167 0.0000000), wk = 0.0038023 k( 89) = ( 0.3125000 0.3125000 0.0000000), wk = 0.0038023 k( 90) = ( 0.3020833 0.3020833 0.0000000), wk = 0.0038023 k( 91) = ( 0.2916667 0.2916667 0.0000000), wk = 0.0038023 k( 92) = ( 0.2812500 0.2812500 0.0000000), wk = 0.0038023 k( 93) = ( 0.2708333 0.2708333 0.0000000), wk = 0.0038023 k( 94) = ( 0.2604167 0.2604167 0.0000000), wk = 0.0038023 k( 95) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0038023 k( 96) = ( 0.2395833 0.2395833 0.0000000), wk = 0.0038023 k( 97) = ( 0.2291667 0.2291667 0.0000000), wk = 0.0038023 k( 98) = ( 0.2187500 0.2187500 0.0000000), wk = 0.0038023 k( 99) = ( 0.2083333 0.2083333 0.0000000), wk = 0.0038023 k( 100) = ( 0.1979167 0.1979167 0.0000000), wk = 0.0038023 k( 101) = ( 0.1875000 0.1875000 0.0000000), wk = 0.0038023 k( 102) = ( 0.1770833 0.1770833 0.0000000), wk = 0.0038023 k( 103) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0038023 k( 104) = ( 0.1562500 0.1562500 0.0000000), wk = 0.0038023 k( 105) = ( 0.1458333 0.1458333 -0.0000000), wk = 0.0038023 k( 106) = ( 0.1354167 0.1354167 0.0000000), wk = 0.0038023 k( 107) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0038023 k( 108) = ( 0.1145833 0.1145833 0.0000000), wk = 0.0038023 k( 109) = ( 0.1041667 0.1041667 0.0000000), wk = 0.0038023 k( 110) = ( 0.0937500 0.0937500 0.0000000), wk = 0.0038023 k( 111) = ( 0.0833333 0.0833333 0.0000000), wk = 0.0038023 k( 112) = ( 0.0729167 0.0729167 0.0000000), wk = 0.0038023 k( 113) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0038023 k( 114) = ( 0.0520833 0.0520833 0.0000000), wk = 0.0038023 k( 115) = ( 0.0416667 0.0416667 0.0000000), wk = 0.0038023 k( 116) = ( 0.0312500 0.0312500 0.0000000), wk = 0.0038023 k( 117) = ( 0.0208333 0.0208333 0.0000000), wk = 0.0038023 k( 118) = ( 0.0104167 0.0104167 0.0000000), wk = 0.0038023 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038023 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038023 k( 121) = ( 0.0084746 0.0084746 0.0084746), wk = 0.0038023 k( 122) = ( 0.0169491 0.0169491 0.0169491), wk = 0.0038023 k( 123) = ( 0.0254237 0.0254237 0.0254237), wk = 0.0038023 k( 124) = ( 0.0338983 0.0338983 0.0338983), wk = 0.0038023 k( 125) = ( 0.0423729 0.0423729 0.0423729), wk = 0.0038023 k( 126) = ( 0.0508475 0.0508475 0.0508475), wk = 0.0038023 k( 127) = ( 0.0593220 0.0593220 0.0593220), wk = 0.0038023 k( 128) = ( 0.0677966 0.0677966 0.0677966), wk = 0.0038023 k( 129) = ( 0.0762712 0.0762712 0.0762712), wk = 0.0038023 k( 130) = ( 0.0847458 0.0847458 0.0847458), wk = 0.0038023 k( 131) = ( 0.0932203 0.0932203 0.0932203), wk = 0.0038023 k( 132) = ( 0.1016949 0.1016949 0.1016949), wk = 0.0038023 k( 133) = ( 0.1101695 0.1101695 0.1101695), wk = 0.0038023 k( 134) = ( 0.1186441 0.1186441 0.1186441), wk = 0.0038023 k( 135) = ( 0.1271186 0.1271186 0.1271186), wk = 0.0038023 k( 136) = ( 0.1355932 0.1355932 0.1355932), wk = 0.0038023 k( 137) = ( 0.1440678 0.1440678 0.1440678), wk = 0.0038023 k( 138) = ( 0.1525424 0.1525424 0.1525424), wk = 0.0038023 k( 139) = ( 0.1610169 0.1610169 0.1610169), wk = 0.0038023 k( 140) = ( 0.1694915 0.1694915 0.1694915), wk = 0.0038023 k( 141) = ( 0.1779661 0.1779661 0.1779661), wk = 0.0038023 k( 142) = ( 0.1864407 0.1864407 0.1864407), wk = 0.0038023 k( 143) = ( 0.1949153 0.1949153 0.1949153), wk = 0.0038023 k( 144) = ( 0.2033898 0.2033898 0.2033898), wk = 0.0038023 k( 145) = ( 0.2118644 0.2118644 0.2118644), wk = 0.0038023 k( 146) = ( 0.2203390 0.2203390 0.2203390), wk = 0.0038023 k( 147) = ( 0.2288136 0.2288136 0.2288136), wk = 0.0038023 k( 148) = ( 0.2372881 0.2372881 0.2372881), wk = 0.0038023 k( 149) = ( 0.2457627 0.2457627 0.2457627), wk = 0.0038023 k( 150) = ( 0.2542373 0.2542373 0.2542373), wk = 0.0038023 k( 151) = ( 0.2627119 0.2627119 0.2627119), wk = 0.0038023 k( 152) = ( 0.2711864 0.2711864 0.2711864), wk = 0.0038023 k( 153) = ( 0.2796610 0.2796610 0.2796610), wk = 0.0038023 k( 154) = ( 0.2881356 0.2881356 0.2881356), wk = 0.0038023 k( 155) = ( 0.2966102 0.2966102 0.2966102), wk = 0.0038023 k( 156) = ( 0.3050848 0.3050848 0.3050848), wk = 0.0038023 k( 157) = ( 0.3135593 0.3135593 0.3135593), wk = 0.0038023 k( 158) = ( 0.3220339 0.3220339 0.3220339), wk = 0.0038023 k( 159) = ( 0.3305085 0.3305085 0.3305085), wk = 0.0038023 k( 160) = ( 0.3389831 0.3389831 0.3389831), wk = 0.0038023 k( 161) = ( 0.3474576 0.3474576 0.3474576), wk = 0.0038023 k( 162) = ( 0.3559322 0.3559322 0.3559322), wk = 0.0038023 k( 163) = ( 0.3644068 0.3644068 0.3644068), wk = 0.0038023 k( 164) = ( 0.3728814 0.3728814 0.3728814), wk = 0.0038023 k( 165) = ( 0.3813559 0.3813559 0.3813559), wk = 0.0038023 k( 166) = ( 0.3898305 0.3898305 0.3898305), wk = 0.0038023 k( 167) = ( 0.3983051 0.3983051 0.3983051), wk = 0.0038023 k( 168) = ( 0.4067797 0.4067797 0.4067797), wk = 0.0038023 k( 169) = ( 0.4152542 0.4152542 0.4152542), wk = 0.0038023 k( 170) = ( 0.4237288 0.4237288 0.4237288), wk = 0.0038023 k( 171) = ( 0.4322034 0.4322034 0.4322034), wk = 0.0038023 k( 172) = ( 0.4406780 0.4406780 0.4406780), wk = 0.0038023 k( 173) = ( 0.4491525 0.4491525 0.4491525), wk = 0.0038023 k( 174) = ( 0.4576271 0.4576271 0.4576271), wk = 0.0038023 k( 175) = ( 0.4661017 0.4661017 0.4661017), wk = 0.0038023 k( 176) = ( 0.4745763 0.4745763 0.4745763), wk = 0.0038023 k( 177) = ( 0.4830508 0.4830508 0.4830508), wk = 0.0038023 k( 178) = ( 0.4915254 0.4915254 0.4915254), wk = 0.0038023 k( 179) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038023 k( 180) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038023 k( 181) = ( 0.4895833 0.5000000 0.4895833), wk = 0.0038023 k( 182) = ( 0.4791667 0.5000000 0.4791667), wk = 0.0038023 k( 183) = ( 0.4687500 0.5000000 0.4687500), wk = 0.0038023 k( 184) = ( 0.4583333 0.5000000 0.4583333), wk = 0.0038023 k( 185) = ( 0.4479167 0.5000000 0.4479167), wk = 0.0038023 k( 186) = ( 0.4375000 0.5000000 0.4375000), wk = 0.0038023 k( 187) = ( 0.4270833 0.5000000 0.4270833), wk = 0.0038023 k( 188) = ( 0.4166667 0.5000000 0.4166667), wk = 0.0038023 k( 189) = ( 0.4062500 0.5000000 0.4062500), wk = 0.0038023 k( 190) = ( 0.3958333 0.5000000 0.3958333), wk = 0.0038023 k( 191) = ( 0.3854167 0.5000000 0.3854167), wk = 0.0038023 k( 192) = ( 0.3750000 0.5000000 0.3750000), wk = 0.0038023 k( 193) = ( 0.3645833 0.5000000 0.3645833), wk = 0.0038023 k( 194) = ( 0.3541667 0.5000000 0.3541667), wk = 0.0038023 k( 195) = ( 0.3437500 0.5000000 0.3437500), wk = 0.0038023 k( 196) = ( 0.3333333 0.5000000 0.3333333), wk = 0.0038023 k( 197) = ( 0.3229167 0.5000000 0.3229167), wk = 0.0038023 k( 198) = ( 0.3125000 0.5000000 0.3125000), wk = 0.0038023 k( 199) = ( 0.3020833 0.5000000 0.3020833), wk = 0.0038023 k( 200) = ( 0.2916667 0.5000000 0.2916667), wk = 0.0038023 k( 201) = ( 0.2812500 0.5000000 0.2812500), wk = 0.0038023 k( 202) = ( 0.2708333 0.5000000 0.2708333), wk = 0.0038023 k( 203) = ( 0.2604167 0.5000000 0.2604167), wk = 0.0038023 k( 204) = ( 0.2500000 0.5000000 0.2500000), wk = 0.0038023 k( 205) = ( 0.2395833 0.5000000 0.2395833), wk = 0.0038023 k( 206) = ( 0.2291667 0.5000000 0.2291667), wk = 0.0038023 k( 207) = ( 0.2187500 0.5000000 0.2187500), wk = 0.0038023 k( 208) = ( 0.2083333 0.5000000 0.2083333), wk = 0.0038023 k( 209) = ( 0.1979167 0.5000000 0.1979167), wk = 0.0038023 k( 210) = ( 0.1875000 0.5000000 0.1875000), wk = 0.0038023 k( 211) = ( 0.1770833 0.5000000 0.1770833), wk = 0.0038023 k( 212) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0038023 k( 213) = ( 0.1562500 0.5000000 0.1562500), wk = 0.0038023 k( 214) = ( 0.1458333 0.5000000 0.1458333), wk = 0.0038023 k( 215) = ( 0.1354167 0.5000000 0.1354167), wk = 0.0038023 k( 216) = ( 0.1250000 0.5000000 0.1250000), wk = 0.0038023 k( 217) = ( 0.1145833 0.5000000 0.1145833), wk = 0.0038023 k( 218) = ( 0.1041667 0.5000000 0.1041667), wk = 0.0038023 k( 219) = ( 0.0937500 0.5000000 0.0937500), wk = 0.0038023 k( 220) = ( 0.0833333 0.5000000 0.0833333), wk = 0.0038023 k( 221) = ( 0.0729167 0.5000000 0.0729167), wk = 0.0038023 k( 222) = ( 0.0625000 0.5000000 0.0625000), wk = 0.0038023 k( 223) = ( 0.0520833 0.5000000 0.0520833), wk = 0.0038023 k( 224) = ( 0.0416667 0.5000000 0.0416667), wk = 0.0038023 k( 225) = ( 0.0312500 0.5000000 0.0312500), wk = 0.0038023 k( 226) = ( 0.0208333 0.5000000 0.0208333), wk = 0.0038023 k( 227) = ( 0.0104167 0.5000000 0.0104167), wk = 0.0038023 k( 228) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0038023 k( 229) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0038023 k( 230) = ( 0.5000000 0.5000000 0.0147059), wk = 0.0038023 k( 231) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0038023 k( 232) = ( 0.5000000 0.5000000 0.0441177), wk = 0.0038023 k( 233) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0038023 k( 234) = ( 0.5000000 0.5000000 0.0735294), wk = 0.0038023 k( 235) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0038023 k( 236) = ( 0.5000000 0.5000000 0.1029412), wk = 0.0038023 k( 237) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0038023 k( 238) = ( 0.5000000 0.5000000 0.1323529), wk = 0.0038023 k( 239) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0038023 k( 240) = ( 0.5000000 0.5000000 0.1617647), wk = 0.0038023 k( 241) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0038023 k( 242) = ( 0.5000000 0.5000000 0.1911765), wk = 0.0038023 k( 243) = ( 0.5000000 0.5000000 0.2058823), wk = 0.0038023 k( 244) = ( 0.5000000 0.5000000 0.2205882), wk = 0.0038023 k( 245) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0038023 k( 246) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0038023 k( 247) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0038023 k( 248) = ( 0.5000000 0.5000000 0.2794118), wk = 0.0038023 k( 249) = ( 0.5000000 0.5000000 0.2941177), wk = 0.0038023 k( 250) = ( 0.5000000 0.5000000 0.3088235), wk = 0.0038023 k( 251) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0038023 k( 252) = ( 0.5000000 0.5000000 0.3382353), wk = 0.0038023 k( 253) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0038023 k( 254) = ( 0.5000000 0.5000000 0.3676471), wk = 0.0038023 k( 255) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0038023 k( 256) = ( 0.5000000 0.5000000 0.3970588), wk = 0.0038023 k( 257) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0038023 k( 258) = ( 0.5000000 0.5000000 0.4264706), wk = 0.0038023 k( 259) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0038023 k( 260) = ( 0.5000000 0.5000000 0.4558823), wk = 0.0038023 k( 261) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0038023 k( 262) = ( 0.5000000 0.5000000 0.4852941), wk = 0.0038023 k( 263) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0038023 Dense grid: 219799 G-vectors FFT dimensions: ( 75, 75, 75) Smooth grid: 55467 G-vectors FFT dimensions: ( 48, 48, 48) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.33 Mb ( 302, 72) NL pseudopotentials 0.44 Mb ( 151, 192) Each V/rho on FFT grid 0.17 Mb ( 11250) Each G-vector array 0.03 Mb ( 4577) G-vector shells 0.01 Mb ( 879) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.33 Mb ( 302, 288) Each subspace H/S matrix 1.27 Mb ( 288, 288) Each matrix 0.42 Mb ( 192, 2, 72) The potential is recalculated from file : ./BeAu.save/charge-density.dat Starting wfc are 112 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 45.7 secs Computing kpt #: 2 total cpu time spent up to now is 51.0 secs Computing kpt #: 3 total cpu time spent up to now is 56.4 secs Computing kpt #: 4 total cpu time spent up to now is 61.5 secs Computing kpt #: 5 total cpu time spent up to now is 66.8 secs Computing kpt #: 6 total cpu time spent up to now is 72.1 secs Computing kpt #: 7 total cpu time spent up to now is 77.4 secs Computing kpt #: 8 total cpu time spent up to now is 82.7 secs Computing kpt #: 9 total cpu time spent up to now is 87.9 secs Computing kpt #: 10 total cpu time spent up to now is 93.1 secs Computing kpt #: 11 total cpu time spent up to now is 98.2 secs Computing kpt #: 12 total cpu time spent up to now is 103.5 secs Computing kpt #: 13 total cpu time spent up to now is 108.9 secs Computing kpt #: 14 total cpu time spent up to now is 114.4 secs Computing kpt #: 15 total cpu time spent up to now is 120.3 secs Computing kpt #: 16 total cpu time spent up to now is 125.6 secs Computing kpt #: 17 total cpu time spent up to now is 130.9 secs Computing kpt #: 18 total cpu time spent up to now is 136.1 secs Computing kpt #: 19 total cpu time spent up to now is 141.3 secs Computing kpt #: 20 total cpu time spent up to now is 146.6 secs Computing kpt #: 21 total cpu time spent up to now is 151.9 secs Computing kpt #: 22 total cpu time spent up to now is 157.1 secs Computing kpt #: 23 total cpu time spent up to now is 162.4 secs Computing kpt #: 24 total cpu time spent up to now is 168.3 secs Computing kpt #: 25 total cpu time spent up to now is 174.1 secs Computing kpt #: 26 total cpu time spent up to now is 179.5 secs Computing kpt #: 27 total cpu time spent up to now is 185.2 secs Computing kpt #: 28 total cpu time spent up to now is 190.9 secs Computing kpt #: 29 total cpu time spent up to now is 196.6 secs Computing kpt #: 30 total cpu time spent up to now is 202.2 secs Computing kpt #: 31 total cpu time spent up to now is 207.8 secs Computing kpt #: 32 total cpu time spent up to now is 213.1 secs Computing kpt #: 33 total cpu time spent up to now is 218.4 secs Computing kpt #: 34 total cpu time spent up to now is 223.7 secs Computing kpt #: 35 total cpu time spent up to now is 229.1 secs Computing kpt #: 36 total cpu time spent up to now is 234.5 secs Computing kpt #: 37 total cpu time spent up to now is 239.8 secs Computing kpt #: 38 total cpu time spent up to now is 245.3 secs Computing kpt #: 39 total cpu time spent up to now is 250.7 secs Computing kpt #: 40 total cpu time spent up to now is 256.0 secs Computing kpt #: 41 total cpu time spent up to now is 261.1 secs Computing kpt #: 42 total cpu time spent up to now is 266.3 secs Computing kpt #: 43 total cpu time spent up to now is 271.5 secs Computing kpt #: 44 total cpu time spent up to now is 276.6 secs Computing kpt #: 45 total cpu time spent up to now is 281.8 secs Computing kpt #: 46 total cpu time spent up to now is 286.9 secs Computing kpt #: 47 total cpu time spent up to now is 292.3 secs Computing kpt #: 48 total cpu time spent up to now is 297.8 secs Computing kpt #: 49 total cpu time spent up to now is 302.9 secs Computing kpt #: 50 total cpu time spent up to now is 308.1 secs Computing kpt #: 51 total cpu time spent up to now is 313.3 secs Computing kpt #: 52 total cpu time spent up to now is 318.5 secs Computing kpt #: 53 total cpu time spent up to now is 323.7 secs Computing kpt #: 54 total cpu time spent up to now is 328.8 secs Computing kpt #: 55 total cpu time spent up to now is 333.7 secs Computing kpt #: 56 total cpu time spent up to now is 338.6 secs Computing kpt #: 57 total cpu time spent up to now is 343.4 secs Computing kpt #: 58 total cpu time spent up to now is 348.3 secs Computing kpt #: 59 total cpu time spent up to now is 353.1 secs Computing kpt #: 60 total cpu time spent up to now is 357.8 secs Computing kpt #: 61 total cpu time spent up to now is 362.8 secs Computing kpt #: 62 total cpu time spent up to now is 367.6 secs Computing kpt #: 63 total cpu time spent up to now is 372.2 secs Computing kpt #: 64 total cpu time spent up to now is 376.8 secs Computing kpt #: 65 total cpu time spent up to now is 381.3 secs Computing kpt #: 66 total cpu time spent up to now is 385.8 secs Computing kpt #: 67 total cpu time spent up to now is 390.2 secs Computing kpt #: 68 total cpu time spent up to now is 394.6 secs Computing kpt #: 69 total cpu time spent up to now is 399.0 secs Computing kpt #: 70 total cpu time spent up to now is 403.4 secs Computing kpt #: 71 total cpu time spent up to now is 408.0 secs Computing kpt #: 72 total cpu time spent up to now is 412.4 secs Computing kpt #: 73 total cpu time spent up to now is 418.4 secs Computing kpt #: 74 total cpu time spent up to now is 423.7 secs Computing kpt #: 75 total cpu time spent up to now is 428.2 secs Computing kpt #: 76 total cpu time spent up to now is 432.8 secs Computing kpt #: 77 total cpu time spent up to now is 437.5 secs Computing kpt #: 78 total cpu time spent up to now is 442.2 secs Computing kpt #: 79 total cpu time spent up to now is 447.0 secs Computing kpt #: 80 total cpu time spent up to now is 451.7 secs Computing kpt #: 81 total cpu time spent up to now is 456.4 secs Computing kpt #: 82 total cpu time spent up to now is 461.3 secs Computing kpt #: 83 total cpu time spent up to now is 466.2 secs Computing kpt #: 84 total cpu time spent up to now is 471.2 secs Computing kpt #: 85 total cpu time spent up to now is 476.4 secs Computing kpt #: 86 total cpu time spent up to now is 481.5 secs Computing kpt #: 87 total cpu time spent up to now is 486.8 secs Computing kpt #: 88 total cpu time spent up to now is 492.2 secs Computing kpt #: 89 total cpu time spent up to now is 497.4 secs Computing kpt #: 90 total cpu time spent up to now is 502.5 secs Computing kpt #: 91 total cpu time spent up to now is 507.7 secs Computing kpt #: 92 total cpu time spent up to now is 513.0 secs Computing kpt #: 93 total cpu time spent up to now is 518.1 secs Computing kpt #: 94 total cpu time spent up to now is 523.3 secs Computing kpt #: 95 total cpu time spent up to now is 528.7 secs Computing kpt #: 96 total cpu time spent up to now is 534.0 secs Computing kpt #: 97 total cpu time spent up to now is 539.4 secs Computing kpt #: 98 total cpu time spent up to now is 544.6 secs Computing kpt #: 99 total cpu time spent up to now is 549.6 secs Computing kpt #: 100 total cpu time spent up to now is 554.8 secs Computing kpt #: 101 total cpu time spent up to now is 559.9 secs Computing kpt #: 102 total cpu time spent up to now is 565.1 secs Computing kpt #: 103 total cpu time spent up to now is 570.4 secs Computing kpt #: 104 total cpu time spent up to now is 575.6 secs Computing kpt #: 105 total cpu time spent up to now is 580.7 secs Computing kpt #: 106 total cpu time spent up to now is 585.8 secs Computing kpt #: 107 total cpu time spent up to now is 591.0 secs Computing kpt #: 108 total cpu time spent up to now is 596.4 secs Computing kpt #: 109 total cpu time spent up to now is 601.6 secs Computing kpt #: 110 total cpu time spent up to now is 607.2 secs Computing kpt #: 111 total cpu time spent up to now is 612.5 secs Computing kpt #: 112 total cpu time spent up to now is 617.8 secs Computing kpt #: 113 total cpu time spent up to now is 623.2 secs Computing kpt #: 114 total cpu time spent up to now is 628.6 secs Computing kpt #: 115 total cpu time spent up to now is 634.0 secs Computing kpt #: 116 total cpu time spent up to now is 639.2 secs Computing kpt #: 117 total cpu time spent up to now is 644.5 secs Computing kpt #: 118 total cpu time spent up to now is 649.7 secs Computing kpt #: 119 total cpu time spent up to now is 654.9 secs Computing kpt #: 120 total cpu time spent up to now is 660.0 secs Computing kpt #: 121 total cpu time spent up to now is 665.3 secs Computing kpt #: 122 total cpu time spent up to now is 670.5 secs Computing kpt #: 123 total cpu time spent up to now is 675.8 secs Computing kpt #: 124 total cpu time spent up to now is 681.2 secs Computing kpt #: 125 total cpu time spent up to now is 686.5 secs Computing kpt #: 126 total cpu time spent up to now is 691.9 secs Computing kpt #: 127 total cpu time spent up to now is 697.3 secs Computing kpt #: 128 total cpu time spent up to now is 702.7 secs Computing kpt #: 129 total cpu time spent up to now is 708.0 secs Computing kpt #: 130 total cpu time spent up to now is 713.4 secs Computing kpt #: 131 total cpu time spent up to now is 719.5 secs Computing kpt #: 132 total cpu time spent up to now is 724.7 secs Computing kpt #: 133 total cpu time spent up to now is 730.1 secs Computing kpt #: 134 total cpu time spent up to now is 735.4 secs Computing kpt #: 135 total cpu time spent up to now is 740.7 secs Computing kpt #: 136 total cpu time spent up to now is 746.2 secs Computing kpt #: 137 total cpu time spent up to now is 751.7 secs Computing kpt #: 138 total cpu time spent up to now is 757.2 secs Computing kpt #: 139 total cpu time spent up to now is 762.8 secs Computing kpt #: 140 total cpu time spent up to now is 768.5 secs Computing kpt #: 141 total cpu time spent up to now is 774.1 secs Computing kpt #: 142 total cpu time spent up to now is 779.5 secs Computing kpt #: 143 total cpu time spent up to now is 784.9 secs Computing kpt #: 144 total cpu time spent up to now is 790.1 secs Computing kpt #: 145 total cpu time spent up to now is 795.6 secs Computing kpt #: 146 total cpu time spent up to now is 800.8 secs Computing kpt #: 147 total cpu time spent up to now is 806.0 secs Computing kpt #: 148 total cpu time spent up to now is 811.2 secs Computing kpt #: 149 total cpu time spent up to now is 816.7 secs Computing kpt #: 150 total cpu time spent up to now is 822.0 secs Computing kpt #: 151 total cpu time spent up to now is 827.2 secs Computing kpt #: 152 total cpu time spent up to now is 832.4 secs Computing kpt #: 153 total cpu time spent up to now is 837.7 secs Computing kpt #: 154 total cpu time spent up to now is 843.0 secs Computing kpt #: 155 total cpu time spent up to now is 848.4 secs Computing kpt #: 156 total cpu time spent up to now is 853.7 secs Computing kpt #: 157 total cpu time spent up to now is 859.1 secs Computing kpt #: 158 total cpu time spent up to now is 864.6 secs Computing kpt #: 159 total cpu time spent up to now is 870.2 secs Computing kpt #: 160 total cpu time spent up to now is 876.0 secs Computing kpt #: 161 total cpu time spent up to now is 882.1 secs Computing kpt #: 162 total cpu time spent up to now is 888.1 secs Computing kpt #: 163 total cpu time spent up to now is 894.5 secs Computing kpt #: 164 total cpu time spent up to now is 900.5 secs Computing kpt #: 165 total cpu time spent up to now is 906.7 secs Computing kpt #: 166 total cpu time spent up to now is 912.8 secs Computing kpt #: 167 total cpu time spent up to now is 918.7 secs Computing kpt #: 168 total cpu time spent up to now is 924.5 secs Computing kpt #: 169 total cpu time spent up to now is 930.6 secs Computing kpt #: 170 total cpu time spent up to now is 936.4 secs Computing kpt #: 171 total cpu time spent up to now is 942.4 secs Computing kpt #: 172 total cpu time spent up to now is 948.3 secs Computing kpt #: 173 total cpu time spent up to now is 954.6 secs Computing kpt #: 174 total cpu time spent up to now is 960.9 secs Computing kpt #: 175 total cpu time spent up to now is 966.8 secs Computing kpt #: 176 total cpu time spent up to now is 972.8 secs Computing kpt #: 177 total cpu time spent up to now is 979.0 secs Computing kpt #: 178 total cpu time spent up to now is 985.0 secs Computing kpt #: 179 total cpu time spent up to now is 990.7 secs Computing kpt #: 180 total cpu time spent up to now is 996.4 secs Computing kpt #: 181 total cpu time spent up to now is 1002.3 secs Computing kpt #: 182 total cpu time spent up to now is 1008.1 secs Computing kpt #: 183 total cpu time spent up to now is 1014.1 secs Computing kpt #: 184 total cpu time spent up to now is 1022.0 secs Computing kpt #: 185 total cpu time spent up to now is 1027.8 secs Computing kpt #: 186 total cpu time spent up to now is 1033.6 secs Computing kpt #: 187 total cpu time spent up to now is 1039.3 secs Computing kpt #: 188 total cpu time spent up to now is 1045.2 secs Computing kpt #: 189 total cpu time spent up to now is 1050.9 secs Computing kpt #: 190 total cpu time spent up to now is 1056.6 secs Computing kpt #: 191 total cpu time spent up to now is 1062.3 secs Computing kpt #: 192 total cpu time spent up to now is 1067.8 secs Computing kpt #: 193 total cpu time spent up to now is 1073.5 secs Computing kpt #: 194 total cpu time spent up to now is 1078.9 secs Computing kpt #: 195 total cpu time spent up to now is 1084.3 secs Computing kpt #: 196 total cpu time spent up to now is 1089.7 secs Computing kpt #: 197 total cpu time spent up to now is 1095.0 secs Computing kpt #: 198 total cpu time spent up to now is 1100.1 secs Computing kpt #: 199 total cpu time spent up to now is 1105.3 secs Computing kpt #: 200 total cpu time spent up to now is 1110.3 secs Computing kpt #: 201 total cpu time spent up to now is 1115.4 secs Computing kpt #: 202 total cpu time spent up to now is 1120.4 secs Computing kpt #: 203 total cpu time spent up to now is 1125.7 secs Computing kpt #: 204 total cpu time spent up to now is 1130.8 secs Computing kpt #: 205 total cpu time spent up to now is 1135.8 secs Computing kpt #: 206 total cpu time spent up to now is 1140.6 secs Computing kpt #: 207 total cpu time spent up to now is 1145.5 secs Computing kpt #: 208 total cpu time spent up to now is 1150.3 secs Computing kpt #: 209 total cpu time spent up to now is 1155.1 secs Computing kpt #: 210 total cpu time spent up to now is 1160.0 secs Computing kpt #: 211 total cpu time spent up to now is 1164.9 secs Computing kpt #: 212 total cpu time spent up to now is 1169.7 secs Computing kpt #: 213 total cpu time spent up to now is 1174.6 secs Computing kpt #: 214 total cpu time spent up to now is 1179.5 secs Computing kpt #: 215 total cpu time spent up to now is 1184.3 secs Computing kpt #: 216 total cpu time spent up to now is 1189.2 secs Computing kpt #: 217 total cpu time spent up to now is 1194.0 secs Computing kpt #: 218 total cpu time spent up to now is 1199.0 secs Computing kpt #: 219 total cpu time spent up to now is 1204.0 secs Computing kpt #: 220 total cpu time spent up to now is 1209.1 secs Computing kpt #: 221 total cpu time spent up to now is 1214.2 secs Computing kpt #: 222 total cpu time spent up to now is 1219.3 secs Computing kpt #: 223 total cpu time spent up to now is 1224.6 secs Computing kpt #: 224 total cpu time spent up to now is 1230.0 secs Computing kpt #: 225 total cpu time spent up to now is 1235.4 secs Computing kpt #: 226 total cpu time spent up to now is 1240.7 secs Computing kpt #: 227 total cpu time spent up to now is 1246.0 secs Computing kpt #: 228 total cpu time spent up to now is 1251.3 secs Computing kpt #: 229 total cpu time spent up to now is 1255.7 secs Computing kpt #: 230 total cpu time spent up to now is 1260.2 secs Computing kpt #: 231 total cpu time spent up to now is 1264.6 secs Computing kpt #: 232 total cpu time spent up to now is 1269.0 secs Computing kpt #: 233 total cpu time spent up to now is 1273.4 secs Computing kpt #: 234 total cpu time spent up to now is 1277.9 secs Computing kpt #: 235 total cpu time spent up to now is 1282.3 secs Computing kpt #: 236 total cpu time spent up to now is 1286.8 secs Computing kpt #: 237 total cpu time spent up to now is 1291.3 secs Computing kpt #: 238 total cpu time spent up to now is 1295.7 secs Computing kpt #: 239 total cpu time spent up to now is 1300.2 secs Computing kpt #: 240 total cpu time spent up to now is 1304.7 secs Computing kpt #: 241 total cpu time spent up to now is 1309.2 secs Computing kpt #: 242 total cpu time spent up to now is 1313.7 secs Computing kpt #: 243 total cpu time spent up to now is 1319.1 secs Computing kpt #: 244 total cpu time spent up to now is 1323.7 secs Computing kpt #: 245 total cpu time spent up to now is 1328.5 secs Computing kpt #: 246 total cpu time spent up to now is 1333.2 secs Computing kpt #: 247 total cpu time spent up to now is 1338.0 secs Computing kpt #: 248 total cpu time spent up to now is 1342.9 secs Computing kpt #: 249 total cpu time spent up to now is 1348.1 secs Computing kpt #: 250 total cpu time spent up to now is 1353.2 secs Computing kpt #: 251 total cpu time spent up to now is 1358.3 secs Computing kpt #: 252 total cpu time spent up to now is 1363.4 secs Computing kpt #: 253 total cpu time spent up to now is 1368.6 secs Computing kpt #: 254 total cpu time spent up to now is 1373.9 secs Computing kpt #: 255 total cpu time spent up to now is 1379.3 secs Computing kpt #: 256 total cpu time spent up to now is 1385.0 secs Computing kpt #: 257 total cpu time spent up to now is 1390.5 secs Computing kpt #: 258 total cpu time spent up to now is 1395.9 secs Computing kpt #: 259 total cpu time spent up to now is 1401.6 secs Computing kpt #: 260 total cpu time spent up to now is 1407.3 secs Computing kpt #: 261 total cpu time spent up to now is 1413.1 secs Computing kpt #: 262 total cpu time spent up to now is 1418.9 secs Computing kpt #: 263 total cpu time spent up to now is 1424.6 secs ethr = 1.67E-11, avg # of iterations = 35.6 total cpu time spent up to now is 1424.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6931 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0517 3.0517 6.3406 6.3406 6.3406 6.3406 6.4136 6.4136 6.9108 6.9108 6.9847 6.9847 6.9847 6.9847 7.1598 7.1598 7.1598 7.1598 7.7301 7.7301 8.0036 8.0036 8.2398 8.2398 8.2398 8.2398 8.7690 8.7690 8.7690 8.7690 8.8768 8.8768 9.5347 9.5347 9.5347 9.5347 9.6256 9.6256 10.3820 10.3820 10.3820 10.3820 11.2247 11.2247 11.7808 11.7808 11.7808 11.7808 13.5468 13.5468 13.5695 13.5695 13.5695 13.5695 18.1928 18.1928 18.1928 18.1928 18.4910 18.4910 18.5998 18.5998 18.5998 18.5998 k = 0.0000 0.0147-0.0000 ( 6955 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0533 3.0533 6.3373 6.3384 6.3425 6.3431 6.4082 6.4183 6.9010 6.9201 6.9742 6.9821 6.9886 6.9928 7.1442 7.1517 7.1707 7.1742 7.7161 7.7464 7.9775 8.0307 8.2177 8.2325 8.2457 8.2620 8.7225 8.7376 8.7969 8.8118 8.8636 8.8915 9.5141 9.5161 9.5546 9.5569 9.6135 9.6393 10.3669 10.3743 10.3885 10.3960 11.1611 11.2826 11.6935 11.7548 11.8113 11.8655 13.4745 13.4850 13.5612 13.5637 13.6390 13.6620 18.1367 18.1628 18.2023 18.2204 18.4815 18.4872 18.5721 18.5986 18.6022 18.6086 k = 0.0000 0.0294-0.0000 ( 6955 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0581 3.0581 6.3332 6.3356 6.3440 6.3448 6.4024 6.4224 6.8909 6.9286 6.9611 6.9811 6.9939 6.9989 7.1276 7.1470 7.1841 7.1874 7.7045 7.7645 7.9528 8.0586 8.1966 8.2239 8.2499 8.2837 8.6733 8.7043 8.8186 8.8417 8.8598 8.9091 9.4957 9.4993 9.5758 9.5803 9.6030 9.6550 10.3510 10.3654 10.3938 10.4086 11.0940 11.3333 11.6051 11.7325 11.8466 11.9463 13.4048 13.4087 13.5590 13.5603 13.7309 13.7625 18.0626 18.1136 18.1911 18.2129 18.4462 18.4639 18.5403 18.5913 18.6064 18.6115 k = 0.0000 0.0441-0.0000 ( 6951 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0662 3.0662 6.3282 6.3323 6.3451 6.3458 6.3961 6.4258 6.8805 6.9358 6.9459 6.9815 7.0002 7.0039 7.1105 7.1456 7.1991 7.1995 7.6953 7.7839 7.9296 8.0864 8.1775 8.2144 8.2523 8.3041 8.6217 8.6701 8.8316 8.8336 8.8900 8.9312 9.4803 9.4844 9.5930 9.5988 9.6043 9.6728 10.3342 10.3556 10.3976 10.4194 11.0257 11.3759 11.5169 11.7134 11.8866 12.0216 13.3406 13.3413 13.5546 13.5553 13.8313 13.8708 17.9776 18.0473 18.1611 18.1768 18.3708 18.4227 18.5036 18.5522 18.6237 18.6367 k = 0.0000 0.0588-0.0000 ( 6959 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0774 3.0774 6.3223 6.3283 6.3459 6.3460 6.3894 6.4284 6.8695 6.9292 6.9412 6.9824 7.0075 7.0087 7.0938 7.1472 7.2108 7.2150 7.6883 7.8037 7.9078 8.1115 8.1631 8.2049 8.2527 8.3228 8.5681 8.6354 8.8220 8.8356 8.9199 8.9576 9.4685 9.4718 9.5849 9.6216 9.6283 9.6927 10.3167 10.3449 10.3999 10.4281 10.9586 11.4094 11.4313 11.6968 11.9307 12.0899 13.2810 13.2839 13.5484 13.5485 13.9399 13.9867 17.8857 17.9661 18.1151 18.1235 18.2763 18.3529 18.4581 18.4996 18.6438 18.6738 k = 0.0000 0.0735-0.0000 ( 6951 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0919 3.0919 6.3155 6.3234 6.3455 6.3464 6.3824 6.4304 6.8575 6.9120 6.9446 6.9817 7.0146 7.0158 7.0791 7.1514 7.2213 7.2312 7.6835 7.8227 7.8872 8.1233 8.1634 8.1969 8.2510 8.3393 8.5127 8.6004 8.8120 8.8325 8.9444 8.9861 9.4611 9.4621 9.5769 9.6458 9.6518 9.7148 10.2985 10.3334 10.4006 10.4341 10.8949 11.3451 11.4387 11.6824 11.9774 12.1500 13.2303 13.2321 13.5398 13.5405 14.0561 14.1098 17.7890 17.8724 18.0562 18.0609 18.1704 18.2604 18.4049 18.4401 18.6634 18.7140 k = 0.0000 0.0882-0.0000 ( 6943 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.1095 3.1096 6.3077 6.3174 6.3444 6.3465 6.3754 6.4315 6.8436 6.8958 6.9462 6.9767 7.0225 7.0247 7.0685 7.1576 7.2311 7.2472 7.6806 7.8395 7.8677 8.1176 8.1756 8.1983 8.2469 8.3533 8.4559 8.5649 8.8049 8.8242 8.9630 9.0150 9.4555 9.4585 9.5691 9.6706 9.6742 9.7390 10.2795 10.3213 10.3993 10.4371 10.8369 11.2644 11.4601 11.6701 12.0253 12.2004 13.1856 13.1890 13.5293 13.5313 14.1794 14.2393 17.6889 17.7685 17.9874 17.9935 18.0576 18.1527 18.3456 18.3765 18.6815 18.7527 k = 0.0000 0.1029-0.0000 ( 6943 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.1304 3.1304 6.2988 6.3098 6.3425 6.3463 6.3685 6.4320 6.8273 6.8817 6.9458 6.9661 7.0319 7.0343 7.0642 7.1655 7.2405 7.2627 7.6794 7.8490 7.8529 8.1075 8.1779 8.2186 8.2402 8.3649 8.3981 8.5289 8.8015 8.8122 8.9755 9.0429 9.4525 9.4610 9.5611 9.6953 9.6959 9.7650 10.2597 10.3086 10.3957 10.4371 10.7861 11.1878 11.4770 11.6599 12.0729 12.2400 13.1442 13.1574 13.5169 13.5210 14.3088 14.3744 17.5863 17.6564 17.9097 17.9237 17.9423 18.0359 18.2823 18.3109 18.6981 18.7881 k = 0.0000 0.1176-0.0000 ( 6959 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.1544 3.1544 6.2885 6.3005 6.3400 6.3456 6.3620 6.4317 6.8084 6.8702 6.9409 6.9536 7.0415 7.0444 7.0666 7.1745 7.2493 7.2773 7.6799 7.8307 7.8619 8.0955 8.1823 8.2307 8.2431 8.3400 8.3745 8.4921 8.7984 8.8023 8.9825 9.0686 9.4535 9.4683 9.5529 9.7148 9.7212 9.7923 10.2390 10.2953 10.3894 10.4347 10.7434 11.1161 11.4907 11.6518 12.1190 12.2681 13.1079 13.1359 13.5030 13.5099 14.4429 14.5140 17.4820 17.5384 17.8127 17.8397 17.8530 17.9142 18.2169 18.2446 18.7133 18.8198 k = 0.0000 0.1324-0.0000 ( 6951 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.1815 3.1816 6.2768 6.2890 6.3364 6.3446 6.3564 6.4307 6.7876 6.8611 6.9248 6.9481 7.0504 7.0548 7.0747 7.1841 7.2576 7.2909 7.6817 7.8126 7.8667 8.0802 8.1945 8.2180 8.2622 8.2863 8.3828 8.4547 8.7844 8.8072 8.9849 9.0913 9.4588 9.4797 9.5443 9.7325 9.7457 9.8203 10.2173 10.2814 10.3805 10.4313 10.7086 11.0496 11.5023 11.6462 12.1624 12.2844 13.0766 13.1242 13.4874 13.4984 14.5799 14.6564 17.3764 17.4165 17.6971 17.7531 17.7779 17.7952 18.1511 18.1791 18.7275 18.8481 k = 0.0000 0.1471-0.0000 ( 6947 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.2118 3.2119 6.2633 6.2750 6.3319 6.3432 6.3518 6.4290 6.7656 6.8541 6.9035 6.9451 7.0590 7.0656 7.0863 7.1938 7.2652 7.3032 7.6845 7.7950 7.8683 8.0602 8.2021 8.2146 8.2231 8.2899 8.3900 8.4172 8.7720 8.8157 8.9839 9.1107 9.4685 9.4941 9.5361 9.7486 9.7688 9.8482 10.1948 10.2669 10.3699 10.4281 10.6802 10.9888 11.5129 11.6432 12.2022 12.2893 13.0506 13.1214 13.4704 13.4874 14.7176 14.7996 17.2703 17.2928 17.5811 17.6630 17.6675 17.7173 18.0866 18.1155 18.7411 18.8738 k = 0.0000 0.1618-0.0000 ( 6931 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.2453 3.2454 6.2475 6.2583 6.3262 6.3414 6.3482 6.4266 6.7433 6.8486 6.8810 6.9423 7.0678 7.0766 7.0996 7.2031 7.2718 7.3141 7.6867 7.7790 7.8683 8.0334 8.1733 8.1832 8.2411 8.3052 8.3758 8.4010 8.7630 8.8271 8.9808 9.1264 9.4822 9.5066 9.5322 9.7633 9.7895 9.8755 10.1714 10.2517 10.3595 10.4261 10.6560 10.9337 11.5233 11.6431 12.2378 12.2841 13.0301 13.1256 13.4521 13.4776 14.8530 14.9411 17.1648 17.1694 17.4687 17.5412 17.5823 17.6500 18.0248 18.0551 18.7542 18.8975 k = 0.0000 0.1765-0.0000 ( 6940 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.2818 3.2819 6.2292 6.2385 6.3198 6.3394 6.3454 6.4235 6.7211 6.8444 6.8584 6.9392 7.0772 7.0877 7.1135 7.2115 7.2773 7.3236 7.6851 7.7677 7.8680 7.9969 8.1323 8.1615 8.2722 8.3159 8.3379 8.4095 8.7589 8.8401 8.9770 9.1387 9.4993 9.5050 9.5444 9.7768 9.8071 9.9011 10.1473 10.2358 10.3505 10.4264 10.6340 10.8845 11.5343 11.6460 12.2685 12.2704 13.0154 13.1343 13.4327 13.4704 14.9824 15.0771 17.0488 17.0612 17.3621 17.4229 17.4981 17.5855 17.9674 17.9991 18.7670 18.9196 k = 0.0000 0.1912-0.0000 ( 6924 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.3214 3.3216 6.2078 6.2155 6.3127 6.3370 6.3430 6.4196 6.6995 6.8364 6.8413 6.9360 7.0868 7.0988 7.1275 7.2185 7.2813 7.3315 7.6755 7.7655 7.8686 7.9504 8.1025 8.1376 8.2998 8.3059 8.3218 8.4198 8.7608 8.8537 8.9738 9.1480 9.4954 9.5185 9.5664 9.7897 9.8208 9.9242 10.1228 10.2191 10.3436 10.4302 10.6124 10.8410 11.5465 11.6521 12.2500 12.2936 13.0071 13.1445 13.4123 13.4675 15.1012 15.2032 16.9329 16.9610 17.2635 17.3108 17.4161 17.5238 17.9161 17.9490 18.7799 18.9407 k = 0.0000 0.2059-0.0000 ( 6920 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.3640 3.3642 6.1826 6.1888 6.3053 6.3344 6.3407 6.4150 6.6789 6.8158 6.8391 6.9327 7.0967 7.1098 7.1411 7.2237 7.2836 7.3379 7.6570 7.7732 7.8703 7.8974 8.0820 8.1120 8.2627 8.3191 8.3452 8.4313 8.7685 8.8665 8.9723 9.1551 9.4838 9.5384 9.5918 9.8027 9.8306 9.9437 10.0982 10.2016 10.3379 10.4390 10.5900 10.8031 11.5605 11.6611 12.2249 12.3129 13.0054 13.1532 13.3913 13.4705 15.2035 15.3130 16.8237 16.8654 17.1757 17.2086 17.3371 17.4652 17.8733 17.9065 18.7927 18.9612 k = 0.0000 0.2206-0.0000 ( 6932 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.4096 3.4099 6.1533 6.1580 6.2976 6.3316 6.3383 6.4096 6.6598 6.7968 6.8378 6.9293 7.1066 7.1206 7.1541 7.2268 7.2840 7.3427 7.6325 7.7883 7.8398 7.8759 8.0681 8.0855 8.2273 8.3150 8.3830 8.4440 8.7816 8.8774 8.9737 9.1608 9.4716 9.5572 9.6192 9.8166 9.8368 9.9584 10.0744 10.1836 10.3324 10.4537 10.5663 10.7707 11.5767 11.6726 12.1966 12.3262 13.0105 13.1578 13.3699 13.4812 15.2830 15.3993 16.7216 16.7741 17.1024 17.1214 17.2619 17.4101 17.8418 17.8743 18.8058 18.9812 k = 0.0000 0.2353-0.0000 ( 6932 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.4582 3.4586 6.1192 6.1227 6.2897 6.3286 6.3357 6.4036 6.6425 6.7799 6.8370 6.9260 7.1162 7.1312 7.1664 7.2276 7.2822 7.3460 7.6047 7.7841 7.8083 7.8814 8.0588 8.0592 8.1939 8.3079 8.4220 8.4573 8.7988 8.8856 8.9786 9.1658 9.4591 9.5732 9.6479 9.8320 9.8402 9.9667 10.0526 10.1653 10.3260 10.4738 10.5416 10.7435 11.5953 11.6861 12.1668 12.3337 13.0221 13.1569 13.3484 13.5000 15.3343 15.4551 16.6246 16.6853 17.0473 17.0554 17.1913 17.3587 17.8257 17.8556 18.8191 19.0010 k = 0.0000 0.2500-0.0000 ( 6912 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.5098 3.5102 6.0798 6.0826 6.2818 6.3255 6.3325 6.3969 6.6273 6.7654 6.8367 6.9227 7.1255 7.1412 7.1778 7.2261 7.2783 7.3476 7.5753 7.7302 7.8317 7.8884 8.0325 8.0548 8.1632 8.3000 8.4614 8.4712 8.8186 8.8912 8.9866 9.1710 9.4468 9.5848 9.6768 9.8424 9.8487 9.9676 10.0343 10.1472 10.3186 10.4928 10.5215 10.7213 11.6165 11.7007 12.1370 12.3358 13.0397 13.1508 13.3272 13.5264 15.3541 15.4759 16.5287 16.5962 17.0113 17.0151 17.1262 17.3113 17.8299 17.8550 18.8329 19.0206 k = 0.0000 0.2647-0.0000 ( 6932 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.5642 3.5648 6.0348 6.0373 6.2739 6.3223 6.3287 6.3897 6.6146 6.7535 6.8365 6.9194 7.1343 7.1507 7.1882 7.2225 7.2723 7.3478 7.5454 7.6796 7.8573 7.8959 8.0074 8.0543 8.1355 8.2932 8.4852 8.5006 8.8398 8.8949 8.9967 9.1771 9.4348 9.5912 9.7036 9.8457 9.8640 9.9639 10.0194 10.1299 10.3101 10.4780 10.5378 10.7035 11.6404 11.7150 12.1088 12.3332 13.0625 13.1406 13.3066 13.5590 15.3434 15.4629 16.4300 16.5048 16.9886 16.9983 17.0684 17.2679 17.8600 17.8779 18.8471 19.0401 k = 0.0000 0.2794-0.0000 ( 6936 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.6215 3.6222 5.9841 5.9866 6.2661 6.3191 6.3241 6.3821 6.6047 6.7443 6.8363 6.9162 7.1424 7.1591 7.1976 7.2172 7.2645 7.3465 7.5160 7.6331 7.8833 7.9031 7.9845 8.0566 8.1118 8.2896 8.4990 8.5393 8.8611 8.8977 9.0077 9.1848 9.4234 9.5917 9.7248 9.8544 9.8704 9.9658 10.0049 10.1137 10.3009 10.4494 10.5693 10.6899 11.6667 11.7277 12.0839 12.3268 13.0896 13.1279 13.2872 13.5960 15.3068 15.4216 16.3272 16.4105 16.9661 16.9960 17.0237 17.2287 17.9200 17.9295 18.8620 19.0595 k = 0.0000 0.2941-0.0000 ( 6940 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.6816 3.6824 5.9276 5.9304 6.2586 6.3159 6.3186 6.3743 6.5976 6.7377 6.8358 6.9128 7.1497 7.1662 7.2060 7.2108 7.2554 7.3439 7.4880 7.5910 7.9063 7.9099 7.9652 8.0605 8.0938 8.2912 8.5123 8.5771 8.8814 8.9004 9.0187 9.1946 9.4127 9.5867 9.7356 9.8618 9.8730 9.9821 9.9886 10.0987 10.2910 10.4190 10.6031 10.6796 11.6954 11.7370 12.0639 12.3172 13.1143 13.1193 13.2699 13.6356 15.2507 15.3603 16.2208 16.3140 16.9308 16.9972 16.9975 17.1934 18.0111 18.0126 18.8780 19.0789 k = 0.0000 0.3088-0.0000 ( 6940 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.7444 3.7453 5.8655 5.8688 6.2515 6.3123 6.3126 6.3663 6.5934 6.7336 6.8348 6.9094 7.1563 7.1710 7.2041 7.2133 7.2460 7.3400 7.4619 7.5534 7.9161 7.9176 7.9547 8.0639 8.0850 8.2998 8.5247 8.6138 8.9001 8.9035 9.0290 9.2069 9.4029 9.5765 9.7352 9.8425 9.9025 9.9685 10.0103 10.0847 10.2807 10.3885 10.6367 10.6722 11.7261 11.7416 12.0500 12.3054 13.1014 13.1495 13.2563 13.6763 15.1819 15.2865 16.1123 16.2159 16.8893 16.9782 16.9956 17.1615 18.1262 18.1306 18.8954 19.0983 k = 0.0000 0.3235-0.0000 ( 6932 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.8099 3.8110 5.7981 5.8020 6.2447 6.3052 6.3095 6.3585 6.5920 6.7318 6.8329 6.9056 7.1622 7.1723 7.1979 7.2194 7.2379 7.3352 7.4383 7.5199 7.9110 7.9219 7.9542 8.0656 8.0901 8.3163 8.5361 8.6490 8.9072 8.9168 9.0382 9.2219 9.3941 9.5614 9.7261 9.8185 9.9401 9.9467 10.0398 10.0748 10.2702 10.3589 10.6666 10.6685 11.7413 11.7583 12.0423 12.2918 13.0908 13.1755 13.2505 13.7162 15.1065 15.2065 16.0029 16.1171 16.8491 16.9576 16.9885 17.1322 18.2659 18.2727 18.9152 19.1177 k = 0.0000 0.3382-0.0000 ( 6932 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.8780 3.8792 5.7259 5.7303 6.2385 6.2976 6.3064 6.3507 6.5932 6.7321 6.8300 6.9015 7.1673 7.1695 7.1919 7.2245 7.2330 7.3296 7.4172 7.4901 7.8983 7.9275 7.9503 8.0650 8.1100 8.3407 8.5461 8.6824 8.9116 8.9311 9.0460 9.2395 9.3865 9.5418 9.7109 9.7928 9.9237 9.9830 10.0435 10.0932 10.2598 10.3308 10.6622 10.6972 11.7369 11.7918 12.0397 12.2772 13.0840 13.1888 13.2601 13.7533 15.0298 15.1252 15.8936 16.0182 16.8127 16.9341 16.9772 17.1048 18.4259 18.4298 18.9396 19.1373 k = 0.0000 0.3529-0.0000 ( 6948 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.9487 3.9500 5.6494 5.6543 6.2330 6.2894 6.3035 6.3433 6.5969 6.7343 6.8259 6.8969 7.1640 7.1718 7.1850 7.2283 7.2321 7.3237 7.3988 7.4635 7.8859 7.9332 7.9409 8.0621 8.1403 8.3719 8.5544 8.7138 8.9169 8.9434 9.0523 9.2591 9.3803 9.5180 9.6914 9.7669 9.9008 10.0288 10.0290 10.1309 10.2495 10.3050 10.6580 10.7211 11.7307 11.8259 12.0399 12.2620 13.0824 13.1897 13.2840 13.7854 14.9567 15.0464 15.7854 15.9196 16.7804 16.9082 16.9637 17.0787 18.5910 18.6001 18.9738 19.1573 k = 0.0000 0.3676-0.0000 ( 6948 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.0218 4.0233 5.5692 5.5744 6.2281 6.2811 6.3008 6.3361 6.6027 6.7381 6.8203 6.8917 7.1576 7.1758 7.1772 7.2310 7.2343 7.3179 7.3829 7.4394 7.8750 7.9289 7.9390 8.0578 8.1762 8.4085 8.5608 8.7426 8.9231 8.9541 9.0568 9.2800 9.3756 9.4906 9.6684 9.7412 9.8790 10.0109 10.0768 10.1718 10.2396 10.2826 10.6533 10.7390 11.7251 11.8600 12.0403 12.2465 13.0872 13.1876 13.3121 13.8095 14.8920 14.9735 15.6787 15.8218 16.7527 16.8809 16.9496 17.0537 18.7363 18.7825 19.0303 19.1782 k = 0.0000 0.3824-0.0000 ( 6940 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.0972 4.0990 5.4858 5.4913 6.2239 6.2727 6.2984 6.3294 6.6104 6.7434 6.8132 6.8859 7.1513 7.1695 7.1794 7.2324 7.2381 7.3126 7.3690 7.4174 7.8658 7.9163 7.9451 8.0524 8.2149 8.4491 8.5651 8.7685 8.9302 8.9636 9.0595 9.3008 9.3725 9.4607 9.6428 9.7162 9.8593 9.9917 10.1244 10.2135 10.2301 10.2650 10.6474 10.7498 11.7224 11.8938 12.0386 12.2309 13.0996 13.1870 13.3386 13.8225 14.8401 14.9091 15.5743 15.7251 16.7293 16.8534 16.9363 17.0299 18.8370 18.9644 19.1154 19.2023 k = 0.0000 0.3971-0.0000 ( 6952 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.1749 4.1769 5.4000 5.4055 6.2205 6.2645 6.2963 6.3232 6.6197 6.7500 6.8046 6.8793 7.1457 7.1625 7.1830 7.2328 7.2429 7.3082 7.3569 7.3972 7.8585 7.9040 7.9513 8.0465 8.2547 8.4924 8.5669 8.7908 8.9383 8.9730 9.0603 9.3185 9.3713 9.4314 9.6151 9.6918 9.8426 9.9717 10.1668 10.2209 10.2551 10.2571 10.6397 10.7524 11.7244 11.9265 12.0332 12.2154 13.1203 13.1897 13.3606 13.8213 14.8051 14.8559 15.4727 15.6298 16.7104 16.8263 16.9244 17.0076 18.8929 19.1236 19.1598 19.2422 k = 0.0000 0.4118-0.0000 ( 6944 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.2547 4.2570 5.3121 5.3176 6.2180 6.2566 6.2947 6.3174 6.6305 6.7576 6.7945 6.8721 7.1412 7.1564 7.1865 7.2320 7.2482 7.3047 7.3463 7.3786 7.8528 7.8926 7.9578 8.0402 8.2945 8.5373 8.5661 8.8086 8.9473 8.9831 9.0591 9.3245 9.3722 9.4114 9.5863 9.6678 9.8296 9.9513 10.1909 10.2116 10.2723 10.2963 10.6298 10.7466 11.7319 11.9579 12.0230 12.2001 13.1496 13.1964 13.3761 13.8041 14.7897 14.8161 15.3744 15.5363 16.6957 16.8004 16.9145 16.9869 18.9270 19.1558 19.2012 19.3304 k = 0.0000 0.4265-0.0000 ( 6928 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.3366 4.3390 5.2228 5.2282 6.2164 6.2492 6.2934 6.3122 6.6424 6.7661 6.7830 6.8641 7.1377 7.1513 7.1902 7.2303 7.2541 7.3024 7.3370 7.3614 7.8487 7.8823 7.9645 8.0338 8.3333 8.5623 8.5826 8.8208 8.9571 8.9954 9.0560 9.3069 9.3753 9.4130 9.5571 9.6441 9.8210 9.9310 10.1942 10.2024 10.3122 10.3364 10.6173 10.7323 11.7452 11.9874 12.0077 12.1849 13.1873 13.2076 13.3839 13.7713 14.7913 14.7942 15.2802 15.4448 16.6852 16.7761 16.9068 16.9680 18.9524 19.1410 19.2310 19.3811 k = 0.0000 0.4412-0.0000 ( 6936 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.4203 4.4230 5.1326 5.1377 6.2157 6.2423 6.2926 6.3076 6.6554 6.7705 6.7753 6.8554 7.1355 7.1471 7.1941 7.2277 7.2604 7.3012 7.3289 7.3454 7.8462 7.8733 7.9714 8.0273 8.3705 8.5553 8.6272 8.8262 8.9678 9.0110 9.0510 9.2730 9.3808 9.4297 9.5283 9.6202 9.8170 9.9110 10.1907 10.1946 10.3612 10.3752 10.6020 10.7101 11.7641 11.9877 12.0149 12.1697 13.2230 13.2328 13.3833 13.7251 14.7825 14.8169 15.1906 15.3557 16.6787 16.7537 16.9016 16.9511 18.9741 19.1236 19.2526 19.3831 k = 0.0000 0.4559-0.0000 ( 6940 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.5056 4.5087 5.0418 5.0467 6.2159 6.2360 6.2924 6.3036 6.6691 6.7569 6.7851 6.8462 7.1343 7.1435 7.1982 7.2244 7.2675 7.3011 7.3219 7.3308 7.8451 7.8655 7.9784 8.0206 8.4054 8.5449 8.6699 8.8243 8.9791 9.0309 9.0440 9.2337 9.3891 9.4515 9.5007 9.5963 9.8174 9.8916 10.1863 10.1887 10.4123 10.4123 10.5836 10.6809 11.7876 11.9635 12.0402 12.1542 13.2424 13.2853 13.3748 13.6688 14.7899 14.8551 15.1066 15.2695 16.6761 16.7337 16.8989 16.9364 18.9940 19.1053 19.2721 19.3726 k = 0.0000 0.4706-0.0000 ( 6948 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.5925 4.5959 4.9509 4.9555 6.2170 6.2305 6.2928 6.3002 6.6834 6.7427 6.7952 6.8364 7.1341 7.1406 7.2026 7.2206 7.2754 7.3020 7.3159 7.3174 7.8453 7.8589 7.9855 8.0137 8.4375 8.5310 8.7095 8.8149 8.9909 9.0355 9.0553 9.1934 9.4002 9.4750 9.4751 9.5722 9.8222 9.8735 10.1827 10.1845 10.4474 10.4633 10.5622 10.6455 11.8148 11.9360 12.0634 12.1383 13.2650 13.3436 13.3593 13.6059 14.8127 14.9056 15.0293 15.1866 16.6773 16.7163 16.8988 16.9240 19.0129 19.0869 19.2906 19.3583 k = 0.0000 0.4853-0.0000 ( 6924 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.6808 4.6844 4.8602 4.8645 6.2190 6.2258 6.2937 6.2974 6.6982 6.7280 6.8056 6.8263 7.1348 7.1381 7.2072 7.2163 7.2842 7.3040 7.3052 7.3109 7.8468 7.8537 7.9926 8.0068 8.4664 8.5132 8.7447 8.7981 9.0028 9.0255 9.0843 9.1542 9.4144 9.4519 9.4992 9.5479 9.8307 9.8569 10.1808 10.1818 10.4802 10.5130 10.5377 10.6050 11.8445 11.9062 12.0845 12.1216 13.2896 13.3386 13.4065 13.5395 14.8497 14.9597 14.9659 15.1077 16.6821 16.7018 16.9013 16.9140 19.0315 19.0684 19.3084 19.3425 k = 0.0000 0.5000-0.0000 ( 6920 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7701 4.7701 4.7740 4.7740 6.2220 6.2220 6.2952 6.2952 6.7131 6.7131 6.8160 6.8160 7.1362 7.1362 7.2118 7.2118 7.2941 7.2941 7.3070 7.3070 7.8496 7.8496 7.9997 7.9997 8.4917 8.4917 8.7745 8.7745 9.0145 9.0145 9.1175 9.1175 9.4316 9.4316 9.5235 9.5235 9.8424 9.8424 10.1805 10.1805 10.5103 10.5103 10.5606 10.5606 11.8754 11.8754 12.1038 12.1038 13.3147 13.3147 13.4724 13.4724 14.8993 14.8993 15.0338 15.0338 16.6903 16.6903 16.9064 16.9064 19.0500 19.0500 19.3257 19.3257 k = 0.0000 0.5000-0.0000 ( 6920 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7701 4.7701 4.7740 4.7740 6.2220 6.2220 6.2952 6.2952 6.7131 6.7131 6.8160 6.8160 7.1362 7.1362 7.2118 7.2118 7.2941 7.2941 7.3070 7.3070 7.8496 7.8496 7.9997 7.9997 8.4917 8.4917 8.7745 8.7745 9.0145 9.0145 9.1175 9.1175 9.4316 9.4316 9.5235 9.5235 9.8424 9.8424 10.1805 10.1805 10.5103 10.5103 10.5606 10.5606 11.8754 11.8754 12.1038 12.1038 13.3147 13.3147 13.4724 13.4724 14.8993 14.8993 15.0338 15.0338 16.6903 16.6903 16.9064 16.9064 19.0500 19.0500 19.3257 19.3257 k = 0.0147 0.5000-0.0000 ( 6920 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7711 4.7711 4.7751 4.7751 6.2222 6.2222 6.2954 6.2954 6.7133 6.7133 6.8162 6.8162 7.1356 7.1356 7.2116 7.2116 7.2924 7.2924 7.3089 7.3089 7.8490 7.8490 8.0002 8.0002 8.4925 8.4925 8.7754 8.7754 9.0121 9.0121 9.1195 9.1195 9.4313 9.4313 9.5236 9.5236 9.8417 9.8417 10.1794 10.1794 10.5036 10.5036 10.5640 10.5640 11.8722 11.8722 12.0987 12.0987 13.3156 13.3156 13.4740 13.4740 14.9005 14.9005 15.0368 15.0368 16.6948 16.6948 16.9106 16.9106 19.0423 19.0423 19.3159 19.3159 k = 0.0294 0.5000-0.0000 ( 6936 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7742 4.7742 4.7784 4.7784 6.2227 6.2227 6.2957 6.2957 6.7139 6.7139 6.8167 6.8167 7.1340 7.1340 7.2111 7.2111 7.2889 7.2889 7.3131 7.3131 7.8474 7.8474 8.0014 8.0014 8.4949 8.4949 8.7778 8.7778 9.0056 9.0056 9.1251 9.1251 9.4302 9.4302 9.5239 9.5239 9.8397 9.8397 10.1763 10.1763 10.4873 10.4873 10.5707 10.5707 11.8629 11.8629 12.0835 12.0835 13.3183 13.3183 13.4787 13.4787 14.9043 14.9043 15.0457 15.0457 16.7080 16.7080 16.9232 16.9232 19.0197 19.0197 19.2872 19.2872 k = 0.0441 0.5000-0.0000 ( 6928 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7794 4.7794 4.7837 4.7837 6.2235 6.2235 6.2963 6.2963 6.7148 6.7148 6.8176 6.8176 7.1315 7.1315 7.2098 7.2098 7.2856 7.2856 7.3178 7.3178 7.8448 7.8448 8.0034 8.0034 8.4989 8.4989 8.7818 8.7818 8.9958 8.9958 9.1332 9.1332 9.4286 9.4286 9.5242 9.5242 9.8363 9.8363 10.1710 10.1710 10.4658 10.4658 10.5762 10.5762 11.8475 11.8475 12.0588 12.0588 13.3231 13.3231 13.4863 13.4863 14.9107 14.9107 15.0595 15.0595 16.7301 16.7301 16.9442 16.9442 18.9834 18.9834 19.2417 19.2417 k = 0.0588 0.5000-0.0000 ( 6926 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7867 4.7867 4.7912 4.7912 6.2246 6.2246 6.2971 6.2971 6.7160 6.7160 6.8188 6.8188 7.1283 7.1283 7.2074 7.2074 7.2832 7.2832 7.3226 7.3226 7.8417 7.8417 8.0060 8.0060 8.5044 8.5044 8.7872 8.7872 8.9837 8.9837 9.1429 9.1429 9.4264 9.4264 9.5242 9.5242 9.8318 9.8318 10.1635 10.1635 10.4412 10.4412 10.5789 10.5789 11.8263 11.8263 12.0255 12.0255 13.3302 13.3302 13.4964 13.4964 14.9197 14.9197 15.0771 15.0771 16.7609 16.7609 16.9733 16.9733 18.9353 18.9353 19.1824 19.1824 k = 0.0735 0.5000-0.0000 ( 6928 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7960 4.7960 4.8008 4.8008 6.2262 6.2262 6.2982 6.2982 6.7175 6.7175 6.8202 6.8202 7.1245 7.1245 7.2035 7.2035 7.2820 7.2820 7.3273 7.3273 7.8382 7.8382 8.0092 8.0092 8.5113 8.5113 8.7938 8.7938 8.9700 8.9700 9.1535 9.1535 9.4239 9.4239 9.5237 9.5237 9.8262 9.8262 10.1536 10.1536 10.4147 10.4147 10.5782 10.5782 11.7994 11.7994 11.9848 11.9848 13.3398 13.3398 13.5088 13.5088 14.9310 14.9310 15.0972 15.0972 16.8002 16.8002 17.0105 17.0105 18.8774 18.8774 19.1123 19.1123 k = 0.0882 0.5000-0.0000 ( 6924 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8073 4.8073 4.8124 4.8124 6.2280 6.2280 6.2996 6.2996 6.7190 6.7190 6.8218 6.8218 7.1201 7.1201 7.1981 7.1981 7.2822 7.2822 7.3318 7.3318 7.8348 7.8348 8.0128 8.0128 8.5196 8.5196 8.8014 8.8014 8.9551 8.9551 9.1645 9.1645 9.4212 9.4212 9.5223 9.5223 9.8199 9.8199 10.1413 10.1413 10.3870 10.3870 10.5738 10.5738 11.7671 11.7672 11.9380 11.9380 13.3519 13.3519 13.5232 13.5232 14.9442 14.9442 15.1188 15.1188 16.8477 16.8477 17.0553 17.0553 18.8119 18.8119 19.0344 19.0344 k = 0.1029 0.5000-0.0000 ( 6924 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8205 4.8205 4.8260 4.8260 6.2303 6.2303 6.3011 6.3012 6.7206 6.7206 6.8234 6.8234 7.1153 7.1153 7.1912 7.1912 7.2835 7.2835 7.3364 7.3364 7.8318 7.8318 8.0168 8.0168 8.5289 8.5289 8.8095 8.8095 8.9394 8.9394 9.1755 9.1755 9.4184 9.4184 9.5196 9.5196 9.8130 9.8130 10.1264 10.1264 10.3590 10.3590 10.5657 10.5657 11.7298 11.7298 11.8865 11.8865 13.3665 13.3665 13.5396 13.5396 14.9587 14.9587 15.1407 15.1407 16.9030 16.9030 17.1073 17.1073 18.7409 18.7409 18.9512 18.9512 k = 0.1176 0.5000-0.0000 ( 6938 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8357 4.8357 4.8416 4.8416 6.2329 6.2329 6.3030 6.3030 6.7221 6.7221 6.8249 6.8249 7.1101 7.1101 7.1831 7.1831 7.2858 7.2858 7.3411 7.3411 7.8294 7.8294 8.0213 8.0213 8.5391 8.5391 8.8179 8.8179 8.9231 8.9231 9.1863 9.1863 9.4158 9.4158 9.5150 9.5150 9.8058 9.8058 10.1087 10.1087 10.3314 10.3315 10.5541 10.5541 11.6876 11.6876 11.8317 11.8317 13.3834 13.3834 13.5581 13.5581 14.9737 14.9737 15.1622 15.1622 16.9653 16.9653 17.1657 17.1657 18.6660 18.6660 18.8649 18.8649 k = 0.1324 0.5000-0.0000 ( 6934 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8528 4.8528 4.8590 4.8591 6.2360 6.2360 6.3051 6.3051 6.7234 6.7234 6.8263 6.8263 7.1043 7.1043 7.1741 7.1741 7.2887 7.2887 7.3460 7.3460 7.8278 7.8278 8.0262 8.0262 8.5498 8.5498 8.8257 8.8257 8.9069 8.9069 9.1968 9.1968 9.4135 9.4135 9.5080 9.5080 9.7988 9.7988 10.0882 10.0882 10.3050 10.3050 10.5392 10.5392 11.6407 11.6407 11.7750 11.7750 13.4026 13.4026 13.5787 13.5787 14.9885 14.9885 15.1826 15.1826 17.0338 17.0338 17.2297 17.2297 18.5889 18.5889 18.7771 18.7771 k = 0.1471 0.5000-0.0000 ( 6930 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8716 4.8716 4.8783 4.8783 6.2394 6.2394 6.3074 6.3074 6.7244 6.7244 6.8274 6.8274 7.0978 7.0978 7.1646 7.1646 7.2922 7.2922 7.3515 7.3515 7.8271 7.8271 8.0315 8.0315 8.5608 8.5608 8.8313 8.8313 8.8923 8.8923 9.2067 9.2067 9.4117 9.4117 9.4984 9.4984 9.7920 9.7920 10.0650 10.0650 10.2804 10.2804 10.5213 10.5213 11.5895 11.5895 11.7175 11.7175 13.4238 13.4238 13.6013 13.6013 15.0026 15.0026 15.2013 15.2013 17.1075 17.1075 17.2980 17.2980 18.5110 18.5110 18.6893 18.6893 k = 0.1618 0.5000-0.0000 ( 6928 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8922 4.8922 4.8993 4.8993 6.2432 6.2432 6.3100 6.3100 6.7250 6.7250 6.8281 6.8281 7.0904 7.0904 7.1547 7.1547 7.2963 7.2963 7.3575 7.3575 7.8276 7.8276 8.0373 8.0373 8.5715 8.5715 8.8312 8.8312 8.8828 8.8828 9.2158 9.2158 9.4106 9.4106 9.4857 9.4857 9.7857 9.7857 10.0392 10.0392 10.2579 10.2579 10.5008 10.5008 11.5345 11.5345 11.6600 11.6600 13.4468 13.4468 13.6259 13.6259 15.0154 15.0154 15.2181 15.2181 17.1847 17.1847 17.3692 17.3692 18.4334 18.4334 18.6026 18.6026 k = 0.1765 0.5000-0.0000 ( 6928 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.9144 4.9144 4.9219 4.9219 6.2474 6.2474 6.3127 6.3127 6.7250 6.7250 6.8285 6.8285 7.0819 7.0819 7.1446 7.1446 7.3010 7.3010 7.3644 7.3644 7.8290 7.8290 8.0435 8.0435 8.5815 8.5815 8.8219 8.8219 8.8819 8.8819 9.2241 9.2241 9.4102 9.4102 9.4700 9.4700 9.7799 9.7799 10.0115 10.0115 10.2378 10.2378 10.4783 10.4783 11.4764 11.4764 11.6031 11.6031 13.4715 13.4715 13.6524 13.6524 15.0267 15.0267 15.2328 15.2328 17.2639 17.2639 17.4412 17.4412 18.3574 18.3574 18.5181 18.5181 k = 0.1912 0.5000-0.0000 ( 6918 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.9382 4.9382 4.9461 4.9461 6.2520 6.2520 6.3157 6.3157 6.7245 6.7245 6.8283 6.8283 7.0723 7.0723 7.1344 7.1344 7.3065 7.3065 7.3721 7.3721 7.8315 7.8315 8.0501 8.0501 8.5900 8.5900 8.8059 8.8059 8.8874 8.8874 9.2311 9.2311 9.4106 9.4106 9.4514 9.4514 9.7744 9.7744 9.9824 9.9824 10.2202 10.2202 10.4543 10.4543 11.4161 11.4161 11.5469 11.5469 13.4979 13.4979 13.6807 13.6807 15.0361 15.0361 15.2451 15.2451 17.3427 17.3428 17.5120 17.5120 18.2839 18.2839 18.4368 18.4368 k = 0.2059 0.5000-0.0000 ( 6922 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.9633 4.9633 4.9716 4.9716 6.2569 6.2569 6.3187 6.3187 6.7233 6.7233 6.8277 6.8277 7.0618 7.0618 7.1242 7.1242 7.3129 7.3129 7.3807 7.3807 7.8349 7.8349 8.0572 8.0572 8.5962 8.5962 8.7874 8.7874 8.8956 8.8956 9.2365 9.2365 9.4111 9.4111 9.4313 9.4313 9.7692 9.7692 9.9527 9.9527 10.2050 10.2050 10.4294 10.4294 11.3543 11.3543 11.4912 11.4912 13.5256 13.5256 13.7105 13.7105 15.0437 15.0437 15.2551 15.2551 17.4188 17.4188 17.5788 17.5788 18.2141 18.2141 18.3598 18.3599 k = 0.2206 0.5000-0.0000 ( 6922 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.9898 4.9898 4.9985 4.9985 6.2621 6.2621 6.3219 6.3219 6.7215 6.7215 6.8265 6.8266 7.0503 7.0503 7.1138 7.1138 7.3204 7.3204 7.3901 7.3901 7.8389 7.8389 8.0645 8.0645 8.5988 8.5988 8.7688 8.7688 8.9049 8.9049 9.2397 9.2397 9.4031 9.4031 9.4190 9.4190 9.7636 9.7636 9.9234 9.9234 10.1923 10.1924 10.4041 10.4041 11.2920 11.2920 11.4361 11.4361 13.5547 13.5547 13.7415 13.7415 15.0494 15.0494 15.2627 15.2627 17.4890 17.4890 17.6385 17.6385 18.1496 18.1496 18.2883 18.2883 k = 0.2353 0.5000-0.0000 ( 6922 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.0174 5.0174 5.0265 5.0265 6.2675 6.2675 6.3251 6.3251 6.7191 6.7191 6.8249 6.8249 7.0383 7.0383 7.1031 7.1031 7.3291 7.3291 7.4004 7.4004 7.8435 7.8435 8.0721 8.0721 8.5965 8.5965 8.7520 8.7520 8.9147 8.9147 9.2393 9.2393 9.3827 9.3827 9.4202 9.4202 9.7570 9.7570 9.8953 9.8953 10.1821 10.1821 10.3791 10.3791 11.2298 11.2298 11.3815 11.3815 13.5849 13.5849 13.7735 13.7735 15.0532 15.0532 15.2681 15.2681 17.5497 17.5497 17.6874 17.6874 18.0923 18.0923 18.2237 18.2237 k = 0.2500 0.5000-0.0000 ( 6934 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.0460 5.0460 5.0554 5.0554 6.2730 6.2730 6.3282 6.3282 6.7160 6.7160 6.8228 6.8228 7.0259 7.0259 7.0920 7.0920 7.3391 7.3391 7.4114 7.4114 7.8482 7.8482 8.0798 8.0798 8.5879 8.5879 8.7386 8.7386 8.9246 8.9246 9.2335 9.2335 9.3636 9.3636 9.4235 9.4235 9.7487 9.7487 9.8697 9.8697 10.1743 10.1743 10.3548 10.3548 11.1682 11.1682 11.3273 11.3273 13.6162 13.6162 13.8061 13.8061 15.0554 15.0554 15.2712 15.2712 17.5971 17.5971 17.7215 17.7215 18.0451 18.0451 18.1676 18.1676 k = 0.2647 0.5000-0.0000 ( 6922 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.0754 5.0754 5.0851 5.0851 6.2785 6.2785 6.3312 6.3312 6.7126 6.7126 6.8203 6.8203 7.0135 7.0135 7.0806 7.0806 7.3502 7.3502 7.4231 7.4231 7.8528 7.8528 8.0874 8.0874 8.5727 8.5727 8.7293 8.7293 8.9343 8.9343 9.2202 9.2202 9.3500 9.3500 9.4271 9.4271 9.7380 9.7380 9.8477 9.8477 10.1688 10.1688 10.3318 10.3318 11.1077 11.1077 11.2735 11.2735 13.6483 13.6483 13.8389 13.8389 15.0560 15.0560 15.2722 15.2722 17.6273 17.6273 17.7368 17.7368 18.0112 18.0112 18.1216 18.1217 k = 0.2794 0.5000-0.0000 ( 6928 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.1054 5.1055 5.1155 5.1155 6.2839 6.2839 6.3339 6.3339 6.7087 6.7087 6.8175 6.8175 7.0014 7.0014 7.0690 7.0690 7.3624 7.3624 7.4352 7.4352 7.8571 7.8571 8.0948 8.0948 8.5518 8.5518 8.7238 8.7238 8.9431 8.9431 9.1996 9.1996 9.3430 9.3430 9.4304 9.4304 9.7245 9.7245 9.8301 9.8301 10.1657 10.1657 10.3103 10.3103 11.0486 11.0486 11.2202 11.2202 13.6811 13.6811 13.8717 13.8717 15.0554 15.0554 15.2711 15.2711 17.6383 17.6383 17.7325 17.7325 17.9917 17.9917 18.0865 18.0865 k = 0.2941 0.5000-0.0000 ( 6928 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.1359 5.1359 5.1461 5.1461 6.2891 6.2891 6.3362 6.3362 6.7048 6.7048 6.8144 6.8144 6.9896 6.9896 7.0572 7.0572 7.3754 7.3754 7.4478 7.4478 7.8608 7.8608 8.1017 8.1017 8.5271 8.5271 8.7208 8.7208 8.9502 8.9502 9.1742 9.1742 9.3412 9.3412 9.4328 9.4328 9.7091 9.7091 9.8169 9.8169 10.1647 10.1648 10.2907 10.2907 10.9912 10.9912 11.1674 11.1674 13.7144 13.7144 13.9041 13.9041 15.0538 15.0538 15.2680 15.2680 17.6313 17.6313 17.7124 17.7124 17.9826 17.9826 18.0609 18.0609 k = 0.3088 0.5000-0.0000 ( 6938 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.1665 5.1665 5.1769 5.1769 6.2939 6.2939 6.3381 6.3381 6.7011 6.7011 6.8112 6.8112 6.9785 6.9785 7.0453 7.0453 7.3891 7.3891 7.4605 7.4605 7.8636 7.8636 8.1075 8.1075 8.5006 8.5006 8.7194 8.7194 8.9545 8.9545 9.1474 9.1474 9.3426 9.3426 9.4338 9.4338 9.6934 9.6934 9.8071 9.8071 10.1659 10.1659 10.2733 10.2733 10.9356 10.9356 11.1153 11.1153 13.7480 13.7480 13.9356 13.9357 15.0515 15.0515 15.2631 15.2631 17.6111 17.6111 17.6826 17.6826 17.9778 17.9778 18.0419 18.0419 k = 0.3235 0.5000-0.0000 ( 6946 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.1970 5.1970 5.2076 5.2076 6.2981 6.2981 6.3393 6.3393 6.6978 6.6978 6.8078 6.8078 6.9681 6.9681 7.0336 7.0336 7.4032 7.4032 7.4732 7.4732 7.8654 7.8654 8.1117 8.1117 8.4742 8.4742 8.7187 8.7187 8.9543 8.9543 9.1226 9.1226 9.3457 9.3457 9.4327 9.4328 9.6794 9.6794 9.7996 9.7996 10.1689 10.1689 10.2583 10.2583 10.8823 10.8823 11.0640 11.0640 13.7816 13.7816 13.9660 13.9660 15.0488 15.0488 15.2564 15.2564 17.5832 17.5833 17.6480 17.6480 17.9725 17.9725 18.0264 18.0264 k = 0.3382 0.5000-0.0000 ( 6938 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.2272 5.2272 5.2377 5.2377 6.3017 6.3017 6.3398 6.3398 6.6952 6.6952 6.8043 6.8043 6.9585 6.9585 7.0220 7.0220 7.4174 7.4174 7.4858 7.4858 7.8663 7.8663 8.1133 8.1133 8.4499 8.4499 8.7180 8.7180 8.9480 8.9480 9.1025 9.1025 9.3494 9.3494 9.4296 9.4296 9.6685 9.6685 9.7937 9.7937 10.1736 10.1736 10.2459 10.2459 10.8314 10.8314 11.0135 11.0135 13.8150 13.8150 13.9946 13.9946 15.0460 15.0460 15.2480 15.2480 17.5521 17.5521 17.6118 17.6118 17.9646 17.9647 18.0122 18.0122 k = 0.3529 0.5000-0.0000 ( 6946 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.2567 5.2567 5.2671 5.2671 6.3044 6.3044 6.3395 6.3395 6.6937 6.6937 6.8008 6.8008 6.9499 6.9499 7.0109 7.0109 7.4316 7.4316 7.4980 7.4980 7.8664 7.8664 8.1112 8.1112 8.4298 8.4298 8.7165 8.7165 8.9358 8.9358 9.0879 9.0879 9.3532 9.3532 9.4247 9.4247 9.6617 9.6617 9.7885 9.7885 10.1794 10.1794 10.2363 10.2363 10.7832 10.7832 10.9641 10.9641 13.8481 13.8481 14.0212 14.0213 15.0436 15.0436 15.2380 15.2380 17.5207 17.5207 17.5759 17.5759 17.9540 17.9541 17.9978 17.9979 k = 0.3676 0.5000-0.0000 ( 6946 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.2852 5.2852 5.2954 5.2954 6.3063 6.3063 6.3383 6.3383 6.6935 6.6936 6.7973 6.7973 6.9423 6.9423 7.0002 7.0002 7.4454 7.4454 7.5095 7.5095 7.8660 7.8660 8.1044 8.1044 8.4153 8.4153 8.7132 8.7132 8.9198 8.9198 9.0776 9.0776 9.3566 9.3566 9.4188 9.4188 9.6590 9.6590 9.7837 9.7837 10.1858 10.1858 10.2299 10.2299 10.7382 10.7382 10.9158 10.9158 13.8805 13.8806 14.0454 14.0454 15.0417 15.0417 15.2267 15.2267 17.4906 17.4906 17.5415 17.5415 17.9415 17.9415 17.9829 17.9829 k = 0.3824 0.5000-0.0000 ( 6946 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3123 5.3123 5.3221 5.3221 6.3074 6.3074 6.3362 6.3362 6.6948 6.6948 6.7936 6.7936 6.9357 6.9357 6.9900 6.9900 7.4587 7.4587 7.5200 7.5200 7.8656 7.8656 8.0925 8.0925 8.4077 8.4077 8.7067 8.7067 8.9038 8.9038 9.0690 9.0690 9.3595 9.3595 9.4130 9.4130 9.6600 9.6600 9.7790 9.7790 10.1920 10.1920 10.2273 10.2273 10.6967 10.6967 10.8690 10.8690 13.9121 13.9121 14.0665 14.0666 15.0409 15.0409 15.2141 15.2141 17.4629 17.4630 17.5095 17.5095 17.9280 17.9280 17.9674 17.9674 k = 0.3971 0.5000-0.0000 ( 6946 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3377 5.3377 5.3469 5.3469 6.3078 6.3078 6.3333 6.3333 6.6977 6.6977 6.7898 6.7898 6.9304 6.9304 6.9804 6.9804 7.4714 7.4714 7.5292 7.5292 7.8656 7.8656 8.0759 8.0759 8.4071 8.4071 8.6958 8.6958 8.8915 8.8915 9.0598 9.0598 9.3619 9.3619 9.4080 9.4080 9.6639 9.6639 9.7741 9.7741 10.1971 10.1971 10.2287 10.2287 10.6594 10.6594 10.8238 10.8238 13.9425 13.9425 14.0844 14.0844 15.0413 15.0413 15.2004 15.2004 17.4384 17.4384 17.4802 17.4802 17.9146 17.9146 17.9516 17.9516 k = 0.4118 0.5000-0.0000 ( 6942 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3610 5.3610 5.3694 5.3694 6.3076 6.3076 6.3297 6.3297 6.7020 6.7020 6.7856 6.7856 6.9263 6.9263 6.9713 6.9713 7.4833 7.4833 7.5368 7.5368 7.8667 7.8667 8.0554 8.0554 8.4129 8.4129 8.6798 8.6798 8.8850 8.8850 9.0487 9.0487 9.3641 9.3641 9.4041 9.4041 9.6701 9.6701 9.7689 9.7689 10.2014 10.2014 10.2333 10.2333 10.6270 10.6270 10.7805 10.7805 13.9715 13.9715 14.0987 14.0987 15.0434 15.0434 15.1858 15.1858 17.4172 17.4172 17.4541 17.4541 17.9021 17.9021 17.9359 17.9360 k = 0.4265 0.5000-0.0000 ( 6946 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3817 5.3817 5.3892 5.3892 6.3070 6.3070 6.3257 6.3257 6.7078 6.7078 6.7809 6.7809 6.9236 6.9236 6.9629 6.9629 7.4945 7.4945 7.5424 7.5424 7.8695 7.8695 8.0326 8.0326 8.4240 8.4240 8.6590 8.6590 8.8848 8.8848 9.0353 9.0353 9.3667 9.3667 9.4011 9.4011 9.6778 9.6778 9.7631 9.7631 10.2057 10.2057 10.2393 10.2393 10.6006 10.6006 10.7395 10.7395 13.9987 13.9987 14.1089 14.1089 15.0473 15.0473 15.1706 15.1706 17.3997 17.3997 17.4312 17.4312 17.8912 17.8912 17.9211 17.9211 k = 0.4412 0.5000-0.0000 ( 6948 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3995 5.3995 5.4059 5.4059 6.3064 6.3064 6.3215 6.3215 6.7147 6.7147 6.7756 6.7756 6.9222 6.9222 6.9550 6.9550 7.5048 7.5048 7.5457 7.5457 7.8745 7.8745 8.0088 8.0088 8.4393 8.4393 8.6348 8.6348 8.8901 8.8901 9.0196 9.0196 9.3698 9.3698 9.3985 9.3985 9.6866 9.6866 9.7567 9.7567 10.2109 10.2109 10.2446 10.2446 10.5811 10.5811 10.7011 10.7011 14.0240 14.0240 14.1151 14.1151 15.0531 15.0531 15.1550 15.1550 17.3859 17.3859 17.4117 17.4117 17.8824 17.8824 17.9074 17.9074 k = 0.4559 0.5000-0.0000 ( 6950 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4141 5.4141 5.4190 5.4190 6.3060 6.3060 6.3174 6.3174 6.7224 6.7224 6.7696 6.7696 6.9223 6.9223 6.9477 6.9477 7.5144 7.5144 7.5468 7.5468 7.8823 7.8823 7.9852 7.9852 8.4581 8.4581 8.6086 8.6086 8.9000 8.9000 9.0022 9.0022 9.3735 9.3735 9.3960 9.3960 9.6959 9.6959 9.7496 9.7496 10.2172 10.2172 10.2477 10.2477 10.5697 10.5697 10.6659 10.6659 14.0469 14.0469 14.1170 14.1170 15.0608 15.0608 15.1393 15.1393 17.3760 17.3760 17.3957 17.3957 17.8760 17.8760 17.8955 17.8955 k = 0.4706 0.5000-0.0000 ( 6954 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4250 5.4250 5.4284 5.4284 6.3060 6.3060 6.3137 6.3137 6.7306 6.7306 6.7628 6.7628 6.9238 6.9238 6.9412 6.9412 7.5230 7.5230 7.5455 7.5455 7.8929 7.8929 7.9625 7.9625 8.4795 8.4795 8.5816 8.5816 8.9132 8.9132 8.9837 8.9837 9.3776 9.3777 9.3931 9.3931 9.7056 9.7056 9.7419 9.7419 10.2245 10.2245 10.2478 10.2478 10.5670 10.5670 10.6345 10.6345 14.0671 14.0671 14.1148 14.1148 15.0705 15.0705 15.1238 15.1238 17.3699 17.3699 17.3832 17.3832 17.8723 17.8723 17.8857 17.8857 k = 0.4853 0.5000-0.0000 ( 6968 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4320 5.4320 5.4338 5.4338 6.3067 6.3067 6.3105 6.3106 6.7391 6.7391 6.7554 6.7554 6.9265 6.9265 6.9353 6.9353 7.5307 7.5307 7.5423 7.5423 7.9064 7.9064 7.9415 7.9415 8.5031 8.5031 8.5546 8.5546 8.9289 8.9289 8.9648 8.9648 9.3819 9.3819 9.3898 9.3898 9.7152 9.7152 9.7335 9.7335 10.2321 10.2321 10.2448 10.2448 10.5729 10.5729 10.6079 10.6079 14.0843 14.0843 14.1084 14.1084 15.0818 15.0818 15.1088 15.1088 17.3676 17.3676 17.3743 17.3743 17.8715 17.8715 17.8782 17.8782 k = 0.5000 0.5000-0.0000 ( 6968 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4350 5.4350 5.4350 5.4350 6.3082 6.3082 6.3082 6.3082 6.7474 6.7474 6.7474 6.7474 6.9304 6.9304 6.9304 6.9304 7.5372 7.5372 7.5372 7.5372 7.9227 7.9227 7.9227 7.9227 8.5282 8.5282 8.5282 8.5282 8.9463 8.9463 8.9463 8.9463 9.3860 9.3860 9.3860 9.3860 9.7246 9.7246 9.7246 9.7246 10.2392 10.2392 10.2392 10.2392 10.5870 10.5870 10.5870 10.5870 14.0982 14.0982 14.0982 14.0982 15.0947 15.0947 15.0947 15.0947 17.3691 17.3691 17.3691 17.3691 17.8734 17.8734 17.8735 17.8735 k = 0.5000 0.5000-0.0000 ( 6968 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4350 5.4350 5.4350 5.4350 6.3082 6.3082 6.3082 6.3082 6.7474 6.7474 6.7474 6.7474 6.9304 6.9304 6.9304 6.9304 7.5372 7.5372 7.5372 7.5372 7.9227 7.9227 7.9227 7.9227 8.5282 8.5282 8.5282 8.5282 8.9463 8.9463 8.9463 8.9463 9.3860 9.3860 9.3860 9.3860 9.7246 9.7246 9.7246 9.7246 10.2392 10.2392 10.2392 10.2392 10.5870 10.5870 10.5870 10.5870 14.0982 14.0982 14.0982 14.0982 15.0947 15.0947 15.0947 15.0947 17.3691 17.3691 17.3691 17.3691 17.8734 17.8734 17.8735 17.8735 k = 0.4896 0.4896-0.0000 ( 6968 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4290 5.4299 5.4358 5.4368 6.3068 6.3077 6.3088 6.3121 6.7331 6.7387 6.7560 6.7594 6.9186 6.9235 6.9407 6.9427 7.5295 7.5340 7.5399 7.5420 7.9039 7.9168 7.9322 7.9428 8.4943 8.5212 8.5356 8.5610 8.9230 8.9414 8.9519 8.9710 9.3741 9.3786 9.3937 9.3997 9.7102 9.7212 9.7286 9.7376 10.2248 10.2337 10.2447 10.2529 10.5755 10.5800 10.5974 10.6091 14.0648 14.0790 14.1079 14.1156 15.0717 15.0830 15.1152 15.1307 17.3658 17.3683 17.3710 17.3785 17.8663 17.8733 17.8786 17.8815 k = 0.4792 0.4792-0.0000 ( 6958 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4125 5.4141 5.4391 5.4411 6.3060 6.3066 6.3110 6.3190 6.7176 6.7302 6.7642 6.7677 6.9075 6.9207 6.9531 6.9555 7.5188 7.5305 7.5411 7.5451 7.8864 7.9147 7.9451 7.9640 8.4597 8.5147 8.5429 8.5923 8.9017 8.9375 8.9575 8.9966 9.3638 9.3715 9.4017 9.4150 9.6952 9.7184 9.7331 9.7489 10.2100 10.2281 10.2498 10.2665 10.5711 10.5790 10.6125 10.6415 14.0176 14.0513 14.1060 14.1175 15.0632 15.0805 15.1438 15.1771 17.3650 17.3708 17.3747 17.3948 17.8594 17.8782 17.8872 17.8923 k = 0.4688 0.4687-0.0000 ( 6948 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3858 5.3881 5.4450 5.4479 6.3044 6.3051 6.3158 6.3284 6.7019 6.7223 6.7713 6.7721 6.8976 6.9226 6.9656 6.9700 7.5057 7.5266 7.5392 7.5482 7.8701 7.9158 7.9606 7.9862 8.4249 8.5087 8.5496 8.6218 8.8829 8.9352 8.9628 9.0226 9.3552 9.3649 9.4098 9.4318 9.6804 9.7164 9.7380 9.7582 10.1955 10.2217 10.2545 10.2812 10.5678 10.5864 10.6355 10.6832 13.9595 14.0159 14.0885 14.1084 15.0685 15.0876 15.1793 15.2310 17.3641 17.3741 17.3851 17.4180 17.8527 17.8870 17.8975 17.9088 k = 0.4583 0.4583-0.0000 ( 6936 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3499 5.3527 5.4533 5.4571 6.3022 6.3030 6.3222 6.3398 6.6867 6.7153 6.7710 6.7787 6.8892 6.9290 6.9773 6.9867 7.4907 7.5220 7.5348 7.5514 7.8550 7.9197 7.9778 8.0090 8.3906 8.5033 8.5551 8.6490 8.8675 8.9347 8.9672 9.0488 9.3480 9.3588 9.4182 9.4494 9.6668 9.7149 9.7430 9.7655 10.1819 10.2137 10.2602 10.2976 10.5654 10.5978 10.6695 10.7334 13.8930 13.9732 14.0556 14.0918 15.0850 15.1043 15.2210 15.2899 17.3631 17.3771 17.4030 17.4481 17.8461 17.8974 17.9114 17.9309 k = 0.4479 0.4479-0.0000 ( 6934 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3057 5.3090 5.4640 5.4688 6.2994 6.3004 6.3295 6.3525 6.6727 6.7097 6.7669 6.7847 6.8823 6.9389 6.9885 7.0048 7.4744 7.5166 7.5285 7.5548 7.8411 7.9256 7.9958 8.0315 8.3575 8.4984 8.5586 8.6736 8.8562 8.9365 8.9702 9.0748 9.3423 9.3533 9.4269 9.4672 9.6555 9.7136 9.7481 9.7712 10.1696 10.2043 10.2679 10.3162 10.5643 10.6101 10.7159 10.7915 13.8203 13.9230 14.0117 14.0684 15.1088 15.1306 15.2678 15.3518 17.3621 17.3804 17.4275 17.4848 17.8394 17.9073 17.9311 17.9583 k = 0.4375 0.4375-0.0000 ( 6936 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.2544 5.2580 5.4771 5.4828 6.2961 6.2975 6.3367 6.3657 6.6603 6.7058 6.7608 6.7899 6.8770 6.9508 6.9994 7.0242 7.4574 7.5098 7.5213 7.5582 7.8284 7.9328 8.0139 8.0526 8.3267 8.4938 8.5597 8.6949 8.8494 8.9408 8.9719 9.1005 9.3380 9.3480 9.4354 9.4845 9.6479 9.7123 9.7533 9.7759 10.1587 10.1942 10.2780 10.3368 10.5644 10.6226 10.7739 10.8572 13.7431 13.8645 13.9622 14.0392 15.1375 15.1647 15.3190 15.4153 17.3610 17.3840 17.4581 17.5281 17.8327 17.9172 17.9557 17.9905 k = 0.4271 0.4271-0.0000 ( 6942 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.1970 5.2007 5.4926 5.4991 6.2924 6.2942 6.3431 6.3788 6.6497 6.7037 6.7537 6.7945 6.8732 6.9636 7.0103 7.0444 7.4400 7.5014 7.5138 7.5615 7.8169 7.9403 8.0316 8.0706 8.2997 8.4894 8.5582 8.7123 8.8474 8.9476 8.9722 9.1257 9.3349 9.3433 9.4430 9.5008 9.6453 9.7106 9.7586 9.7803 10.1491 10.1848 10.2904 10.3593 10.5658 10.6351 10.8423 10.9302 13.6626 13.7977 13.9112 14.0053 15.1701 15.2040 15.3736 15.4792 17.3598 17.3881 17.4945 17.5773 17.8259 17.9275 17.9846 18.0271 k = 0.4167 0.4167-0.0000 ( 6934 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.1343 5.1381 5.5104 5.5176 6.2885 6.2907 6.3482 6.3909 6.6414 6.7036 6.7467 6.7988 6.8706 6.9762 7.0217 7.0654 7.4226 7.4914 7.5063 7.5646 7.8069 7.9474 8.0487 8.0835 8.2784 8.4850 8.5545 8.7252 8.8495 8.9565 8.9721 9.1502 9.3324 9.3395 9.4483 9.5161 9.6481 9.7085 9.7640 9.7855 10.1405 10.1773 10.3049 10.3834 10.5682 10.6477 10.9203 11.0106 13.5799 13.7232 13.8607 13.9679 15.2059 15.2462 15.4310 15.5427 17.3583 17.3924 17.5359 17.6317 17.8195 17.9388 18.0167 18.0675 k = 0.4062 0.4062-0.0000 ( 6938 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.0674 5.0711 5.5303 5.5383 6.2845 6.2872 6.3518 6.4016 6.6354 6.7053 6.7404 6.8030 6.8689 6.9881 7.0340 7.0867 7.4055 7.4802 7.4986 7.5674 7.7985 7.9531 8.0649 8.0894 8.2645 8.4806 8.5494 8.7338 8.8541 8.9641 8.9751 9.1739 9.3294 9.3376 9.4507 9.5310 9.6551 9.7069 9.7692 9.7926 10.1329 10.1726 10.3211 10.4086 10.5717 10.6605 11.0072 11.0980 13.4958 13.6429 13.8118 13.9280 15.2443 15.2898 15.4905 15.6055 17.3564 17.3971 17.5817 17.6892 17.8145 17.9515 18.0512 18.1108 k = 0.3958 0.3958-0.0000 ( 6938 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.9969 5.0006 5.5522 5.5609 6.2805 6.2836 6.3538 6.4103 6.6320 6.7083 6.7356 6.8077 6.8679 6.9987 7.0473 7.1084 7.3888 7.4681 7.4905 7.5697 7.7918 7.9563 8.0800 8.0884 8.2586 8.4760 8.5438 8.7385 8.8591 8.9664 8.9859 9.1965 9.3258 9.3379 9.4503 9.5457 9.6624 9.7085 9.7746 9.8023 10.1263 10.1711 10.3388 10.4346 10.5763 10.6732 11.1023 11.1923 13.4110 13.5584 13.7645 13.8867 15.2844 15.3337 15.5515 15.6672 17.3539 17.4018 17.6309 17.7422 17.8181 17.9662 18.0869 18.1561 k = 0.3854 0.3854-0.0000 ( 6926 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.9237 4.9271 5.5761 5.5854 6.2766 6.2801 6.3544 6.4168 6.6312 6.7120 6.7329 6.8130 6.8672 7.0083 7.0616 7.1302 7.3728 7.4554 7.4820 7.5711 7.7871 7.9560 8.0813 8.0951 8.2587 8.4713 8.5387 8.7401 8.8621 8.9682 8.9997 9.2173 9.3221 9.3399 9.4486 9.5590 9.6649 9.7171 9.7812 9.8150 10.1211 10.1728 10.3576 10.4608 10.5820 10.6860 11.2053 11.2933 13.3260 13.4712 13.7191 13.8446 15.3258 15.3773 15.6137 15.7277 17.3505 17.4065 17.6818 17.7654 17.8536 17.9845 18.1223 18.2020 k = 0.3750 0.3750-0.0000 ( 6926 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.8483 4.8515 5.6018 5.6116 6.2730 6.2768 6.3538 6.4207 6.6329 6.7150 6.7336 6.8190 6.8666 7.0168 7.0766 7.1519 7.3575 7.4423 7.4731 7.5717 7.7846 7.9517 8.0736 8.1080 8.2620 8.4665 8.5348 8.7393 8.8623 8.9713 9.0137 9.2356 9.3183 9.3443 9.4474 9.5690 9.6628 9.7312 9.7910 9.8309 10.1179 10.1775 10.3773 10.4867 10.5889 10.6987 11.3154 11.4007 13.2414 13.3825 13.6757 13.8025 15.3677 15.4202 15.6766 15.7869 17.3459 17.4107 17.7317 17.7636 17.9142 18.0092 18.1553 18.2466 k = 0.3646 0.3646-0.0000 ( 6923 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.7713 4.7743 5.6291 5.6394 6.2698 6.2737 6.3523 6.4224 6.6369 6.7170 6.7377 6.8259 6.8661 7.0247 7.0920 7.1735 7.3432 7.4287 7.4639 7.5711 7.7843 7.9434 8.0665 8.1194 8.2664 8.4619 8.5322 8.7366 8.8599 8.9752 9.0266 9.2500 9.3138 9.3525 9.4478 9.5729 9.6609 9.7454 9.8059 9.8505 10.1168 10.1850 10.3978 10.5117 10.5971 10.7114 11.4322 11.5140 13.1577 13.2933 13.6345 13.7609 15.4098 15.4620 15.7401 15.8449 17.3397 17.4141 17.7498 17.7836 17.9736 18.0476 18.1834 18.2867 k = 0.3542 0.3542-0.0000 ( 6935 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.6933 4.6960 5.6578 5.6687 6.2670 6.2710 6.3502 6.4220 6.6426 6.7188 6.7445 6.8334 6.8657 7.0322 7.1074 7.1947 7.3298 7.4149 7.4543 7.5694 7.7862 7.9320 8.0610 8.1286 8.2709 8.4576 8.5308 8.7323 8.8562 8.9789 9.0369 9.2603 9.3081 9.3659 9.4506 9.5687 9.6622 9.7570 9.8258 9.8752 10.1181 10.1949 10.4187 10.5348 10.6070 10.7239 11.5548 11.6328 13.0753 13.2044 13.5958 13.7205 15.4514 15.5025 15.8040 15.9017 17.3313 17.4159 17.7379 17.8247 18.0203 18.1052 18.2037 18.3179 k = 0.3438 0.3437-0.0000 ( 6929 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.6147 4.6172 5.6878 5.6991 6.2647 6.2687 6.3477 6.4200 6.6496 6.7214 6.7527 6.8413 6.8656 7.0393 7.1225 7.2156 7.3174 7.4008 7.4445 7.5667 7.7900 7.9189 8.0571 8.1353 8.2755 8.4538 8.5302 8.7265 8.8524 8.9815 9.0432 9.2675 9.3015 9.3839 9.4555 9.5570 9.6673 9.7668 9.8479 9.9059 10.1216 10.2070 10.4403 10.5553 10.6189 10.7364 11.6825 11.7565 12.9945 13.1169 13.5597 13.6816 15.4918 15.5413 15.8684 15.9576 17.3202 17.4153 17.7234 17.8575 18.0590 18.1645 18.2208 18.3333 k = 0.3333 0.3333-0.0000 ( 6939 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.5358 4.5381 5.7188 5.7306 6.2629 6.2668 6.3452 6.4169 6.6574 6.7251 6.7621 6.8493 6.8662 7.0461 7.1370 7.2360 7.3062 7.3866 7.4345 7.5633 7.7954 7.9052 8.0543 8.1393 8.2805 8.4506 8.5300 8.7196 8.8495 8.9825 9.0442 9.2732 9.2945 9.4046 9.4620 9.5403 9.6749 9.7762 9.8699 9.9427 10.1274 10.2209 10.4625 10.5724 10.6330 10.7490 11.8141 11.8844 12.9158 13.0316 13.5264 13.6448 15.5301 15.5783 15.9332 16.0127 17.3054 17.4108 17.7078 17.8788 18.0897 18.1786 18.2703 18.3259 k = 0.3229 0.3229-0.0000 ( 6927 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.4572 4.4592 5.7506 5.7630 6.2616 6.2653 6.3428 6.4131 6.6654 6.7300 6.7721 6.8569 6.8682 7.0527 7.1505 7.2559 7.2962 7.3725 7.4244 7.5596 7.8018 7.8919 8.0522 8.1408 8.2860 8.4481 8.5296 8.7116 8.8480 8.9819 9.0393 9.2769 9.2896 9.4250 9.4688 9.5224 9.6842 9.7862 9.8915 9.9839 10.1351 10.2363 10.4855 10.5860 10.6485 10.7618 11.9481 12.0159 12.8396 12.9498 13.4962 13.6106 15.5654 15.6133 15.9985 16.0672 17.2861 17.4007 17.6921 17.8847 18.0919 18.1720 18.2938 18.3396 k = 0.3125 0.3125-0.0000 ( 6923 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.3790 4.3808 5.7830 5.7960 6.2609 6.2644 6.3406 6.4089 6.6732 6.7358 6.7827 6.8628 6.8729 7.0592 7.1626 7.2749 7.2874 7.3585 7.4144 7.5562 7.8088 7.8796 8.0506 8.1405 8.2920 8.4463 8.5288 8.7030 8.8482 8.9793 9.0289 9.2738 9.2926 9.4401 9.4716 9.5125 9.6949 9.7975 9.9129 10.0276 10.1448 10.2526 10.5098 10.5968 10.6644 10.7752 12.0819 12.1500 12.7665 12.8735 13.4691 13.5796 15.5963 15.6459 16.0642 16.1215 17.2609 17.3831 17.6769 17.8660 18.0584 18.1592 18.2693 18.3993 k = 0.3021 0.3021-0.0000 ( 6933 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.3017 4.3032 5.8156 5.8294 6.2605 6.2639 6.3389 6.4048 6.6807 6.7424 6.7936 6.8674 6.8807 7.0654 7.1728 7.2794 7.2930 7.3454 7.4047 7.5535 7.8154 7.8689 8.0493 8.1394 8.2982 8.4453 8.5274 8.6937 8.8500 8.9741 9.0150 9.2666 9.3004 9.4369 9.4726 9.5206 9.7072 9.8101 9.9343 10.0716 10.1569 10.2692 10.5357 10.6055 10.6791 10.7896 12.2109 12.2857 12.6971 12.8064 13.4454 13.5525 15.6216 15.6755 16.1301 16.1760 17.2286 17.3559 17.6619 17.8126 18.0171 18.1199 18.2729 18.4461 k = 0.2917 0.2917-0.0000 ( 6931 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.2253 4.2267 5.8483 5.8630 6.2604 6.2639 6.3376 6.4011 6.6876 6.7490 6.8048 6.8721 6.8905 7.0713 7.1810 7.2730 7.3062 7.3359 7.3958 7.5521 7.8197 7.8613 8.0479 8.1386 8.3042 8.4448 8.5256 8.6838 8.8530 8.9635 9.0017 9.2587 9.3087 9.4153 9.4797 9.5393 9.7216 9.8240 9.9559 10.1124 10.1735 10.2857 10.5631 10.6127 10.6918 10.8055 12.3246 12.4207 12.6333 12.7574 13.4251 13.5304 15.6400 15.7009 16.1956 16.2318 17.1876 17.3175 17.6450 17.7322 17.9668 18.0917 18.2843 18.4769 k = 0.2812 0.2812-0.0000 ( 6911 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.1503 4.1515 5.8808 5.8966 6.2606 6.2644 6.3369 6.3979 6.6939 6.7552 6.8163 6.8773 6.9023 7.0770 7.1869 7.2677 7.3058 7.3383 7.3892 7.5526 7.8188 7.8593 8.0465 8.1392 8.3099 8.4445 8.5238 8.6734 8.8564 8.9456 8.9931 9.2506 9.3146 9.3901 9.4871 9.5608 9.7384 9.8390 9.9776 10.1435 10.1991 10.3020 10.5901 10.6211 10.7019 10.8234 12.4006 12.5288 12.6006 12.7471 13.4085 13.5151 15.6504 15.7205 16.2591 16.2909 17.1362 17.2665 17.6161 17.6506 17.9111 18.0866 18.2914 18.4941 k = 0.2708 0.2708-0.0000 ( 6923 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.0767 4.0778 5.9129 5.9300 6.2609 6.2655 6.3366 6.3956 6.6996 6.7605 6.8283 6.8827 6.9160 7.0823 7.1905 7.2632 7.2954 7.3461 7.3880 7.5552 7.8122 7.8631 8.0447 8.1418 8.3151 8.4439 8.5225 8.6623 8.8584 8.9234 8.9887 9.2425 9.3120 9.3710 9.4939 9.5823 9.7580 9.8546 9.9995 10.1631 10.2332 10.3185 10.6064 10.6406 10.7097 10.8437 12.4166 12.5007 12.7047 12.7971 13.3961 13.5087 15.6515 15.7322 16.3189 16.3552 17.0737 17.2020 17.5473 17.6072 17.8678 18.0933 18.2931 18.5023 k = 0.2604 0.2604-0.0000 ( 6925 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 4.0049 4.0058 5.9444 5.9629 6.2613 6.2670 6.3368 6.3943 6.7048 6.7649 6.8408 6.8882 6.9313 7.0872 7.1919 7.2588 7.2840 7.3476 7.3963 7.5604 7.8024 7.8697 8.0429 8.1470 8.3198 8.4425 8.5217 8.6505 8.8545 8.9040 8.9869 9.2345 9.2938 9.3665 9.5001 9.6024 9.7804 9.8706 10.0212 10.1766 10.2665 10.3379 10.6099 10.6699 10.7186 10.8667 12.3893 12.4514 12.8234 12.8911 13.3896 13.5145 15.6421 15.7339 16.3757 16.4243 17.0009 17.1245 17.4788 17.5722 17.8440 18.1056 18.2916 18.5055 k = 0.2500 0.2500-0.0000 ( 6923 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.9349 3.9357 5.9751 5.9951 6.2618 6.2689 6.3373 6.3941 6.7095 6.7683 6.8532 6.8943 6.9476 7.0916 7.1913 7.2532 7.2747 7.3442 7.4113 7.5681 7.7916 7.8770 8.0414 8.1546 8.3242 8.4398 8.5215 8.6380 8.8376 8.8960 8.9870 9.2255 9.2668 9.3715 9.5058 9.6209 9.8050 9.8866 10.0426 10.1873 10.2906 10.3642 10.6088 10.6884 10.7415 10.8927 12.3466 12.4048 12.9252 12.9981 13.3937 13.5361 15.6211 15.7235 16.4313 16.4966 16.9208 17.0378 17.4273 17.5381 17.8372 18.1212 18.2895 18.5069 k = 0.2396 0.2396-0.0000 ( 6925 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.8668 3.8675 6.0049 6.0265 6.2623 6.2713 6.3380 6.3950 6.7139 6.7712 6.8645 6.9016 6.9639 7.0953 7.1889 7.2449 7.2693 7.3398 7.4292 7.5784 7.7806 7.8842 8.0409 8.1642 8.3285 8.4356 8.5214 8.6249 8.8116 8.8962 8.9886 9.2112 9.2428 9.3797 9.5111 9.6376 9.8311 9.9026 10.0631 10.1961 10.3038 10.3974 10.6055 10.6894 10.7828 10.9217 12.3014 12.3624 13.0066 13.0916 13.4180 13.5765 15.5877 15.6993 16.4857 16.5712 16.8378 16.9490 17.3937 17.5099 17.8419 18.1392 18.2887 18.5083 k = 0.2292 0.2292-0.0000 ( 6915 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 3.8009 3.8015 6.0338 6.0569 6.2631 6.2739 6.3389 6.3970 6.7181 6.7738 6.8738 6.9108 6.9794 7.0982 7.1847 7.2349 7.2670 7.3367 7.4483 7.5913 7.7703 7.8908 8.0419 8.1753 8.3330 8.4296 8.5204 8.6111 8.7838 8.8986 8.9917 9.1855 9.2309 9.3890 9.5159 9.6529 9.8577 9.9188 10.0821 10.2029 10.3099 10.4334 10.6011 10.6825 10.8324 10.9539 12.2586 12.3248 13.0670 13.1518 13.4740 13.6353 15.5416 15.6604 16.5371 16.6475 16.7574 16.8672 17.3761 17.4910 17.8542 18.1592 18.2906 18.5110 k = 0.2188 0.2187-0.0000 ( 6923 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.7373 3.7378 6.0616 6.0860 6.2640 6.2768 6.3400 6.3998 6.7225 6.7765 6.8806 6.9217 6.9932 7.1002 7.1789 7.2249 7.2658 7.3358 7.4679 7.6067 7.7610 7.8969 8.0449 8.1869 8.3380 8.4219 8.5176 8.5964 8.7579 8.9006 8.9959 9.1551 9.2264 9.3989 9.5204 9.6667 9.8833 9.9360 10.0984 10.2073 10.3121 10.4693 10.5966 10.6714 10.8865 10.9892 12.2201 12.2923 13.1089 13.1778 13.5577 13.7072 15.4833 15.6070 16.5773 16.6847 16.7242 16.8073 17.3728 17.4831 17.8715 18.1808 18.2956 18.5154 k = 0.2083 0.2083-0.0000 ( 6929 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.6761 3.6765 6.0883 6.1139 6.2653 6.2799 6.3413 6.4032 6.7271 6.7794 6.8858 6.9331 7.0049 7.1011 7.1717 7.2160 7.2644 7.3377 7.4878 7.6244 7.7536 7.9033 8.0498 8.1983 8.3437 8.4122 8.5124 8.5799 8.7367 8.9007 9.0007 9.1255 9.2253 9.4092 9.5245 9.6793 9.9058 9.9554 10.1108 10.2085 10.3129 10.5030 10.5937 10.6577 10.9436 11.0272 12.1868 12.2651 13.1370 13.1835 13.6515 13.7840 15.4138 15.5404 16.5856 16.6267 16.7752 16.8182 17.3820 17.4868 17.8923 18.2039 18.3039 18.5220 k = 0.1979 0.1979-0.0000 ( 6931 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.6173 3.6176 6.1138 6.1403 6.2668 6.2833 6.3428 6.4071 6.7323 6.7826 6.8901 6.9440 7.0142 7.1006 7.1633 7.2083 7.2624 7.3419 7.5077 7.6441 7.7487 7.9109 8.0563 8.2086 8.3505 8.4007 8.5049 8.5609 8.7218 8.8980 9.0053 9.0997 9.2266 9.4196 9.5282 9.6906 9.9238 9.9780 10.1178 10.2053 10.3148 10.5315 10.5959 10.6431 11.0026 11.0676 12.1590 12.2434 13.1560 13.1796 13.7414 13.8571 15.3349 15.4627 16.5594 16.5870 16.8122 16.8954 17.4020 17.5017 17.9158 18.2282 18.3156 18.5308 k = 0.1875 0.1875-0.0000 ( 6927 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.5610 3.5613 6.1381 6.1653 6.2687 6.2869 6.3445 6.4110 6.7382 6.7862 6.8941 6.9535 7.0210 7.0987 7.1542 7.2020 7.2599 7.3473 7.5274 7.6644 7.7478 7.9209 8.0639 8.2165 8.3583 8.3876 8.4949 8.5400 8.7135 8.8916 9.0086 9.0800 9.2301 9.4300 9.5316 9.7005 9.9375 10.0029 10.1185 10.1970 10.3195 10.5472 10.6109 10.6294 11.0625 11.1099 12.1367 12.2271 13.1667 13.1734 13.8187 13.9191 15.2490 15.3766 16.5343 16.5618 16.8701 16.9791 17.4315 17.5272 17.9414 18.2532 18.3307 18.5417 k = 0.1771 0.1771-0.0000 ( 6931 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.5075 3.5077 6.1612 6.1888 6.2709 6.2907 6.3464 6.4149 6.7450 6.7903 6.8983 6.9610 7.0256 7.0955 7.1448 7.1966 7.2570 7.3529 7.5468 7.6828 7.7531 7.9347 8.0721 8.2209 8.3670 8.3736 8.4810 8.5206 8.7108 8.8812 9.0096 9.0682 9.2358 9.4403 9.5347 9.7086 9.9476 10.0281 10.1128 10.1843 10.3272 10.5486 10.6185 10.6406 11.1221 11.1537 12.1198 12.2162 13.1578 13.1806 13.8784 13.9644 15.1584 15.2846 16.5271 16.5550 16.9380 17.0650 17.4691 17.5624 17.9685 18.2783 18.3491 18.5547 k = 0.1667 0.1667-0.0000 ( 6925 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.4566 3.4568 6.1830 6.2107 6.2735 6.2948 6.3484 6.4186 6.7527 6.7948 6.9029 6.9666 7.0281 7.0912 7.1354 7.1915 7.2539 7.3574 7.5659 7.6961 7.7675 7.9533 8.0803 8.2209 8.3595 8.3757 8.4621 8.5065 8.7121 8.8674 9.0082 9.0637 9.2436 9.4502 9.5376 9.7147 9.9539 10.0500 10.1035 10.1697 10.3373 10.5424 10.6131 10.6776 11.1789 11.1999 12.1077 12.2104 13.1447 13.1880 13.9175 13.9892 15.0653 15.1886 16.5424 16.5710 17.0115 17.1527 17.5136 17.6062 17.9969 18.3029 18.3708 18.5693 k = 0.1562 0.1562-0.0000 ( 6927 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.4086 3.4087 6.2035 6.2310 6.2765 6.2993 6.3505 6.4220 6.7616 6.7999 6.9082 6.9702 7.0289 7.0859 7.1262 7.1865 7.2503 7.3601 7.5845 7.7044 7.7897 7.9777 8.0877 8.2160 8.3461 8.3821 8.4420 8.4977 8.7159 8.8520 9.0059 9.0638 9.2532 9.4596 9.5404 9.7184 9.9550 10.0554 10.1034 10.1568 10.3485 10.5327 10.6131 10.7192 11.2282 11.2513 12.1001 12.2093 13.1305 13.1940 13.9356 13.9919 14.9713 15.0901 16.5821 16.6113 17.0889 17.2417 17.5641 17.6576 18.0264 18.3263 18.3957 18.5855 k = 0.1458 0.1458-0.0000 ( 6925 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.3633 3.3635 6.2225 6.2497 6.2799 6.3041 6.3525 6.4250 6.7714 6.8055 6.9143 6.9723 7.0283 7.0802 7.1175 7.1811 7.2462 7.3606 7.6021 7.7113 7.8153 8.0085 8.0934 8.2071 8.3337 8.3790 8.4300 8.4925 8.7213 8.8372 9.0036 9.0658 9.2645 9.4682 9.5430 9.7192 9.9486 10.0364 10.1206 10.1501 10.3598 10.5217 10.6181 10.7650 11.2704 11.3061 12.0961 12.2124 13.1159 13.1986 13.9341 13.9738 14.8771 14.9898 16.6460 16.6753 17.1695 17.3319 17.6200 17.7155 18.0565 18.3484 18.4232 18.6027 k = 0.1354 0.1354-0.0000 ( 6933 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.3210 3.3211 6.2400 6.2666 6.2836 6.3095 6.3543 6.4276 6.7822 6.8118 6.9211 6.9730 7.0265 7.0740 7.1097 7.1753 7.2412 7.3585 7.6181 7.7198 7.8405 8.0457 8.0964 8.1961 8.3221 8.3630 8.4294 8.4912 8.7276 8.8248 9.0012 9.0679 9.2773 9.4759 9.5457 9.7170 9.9330 10.0070 10.1395 10.1554 10.3706 10.5109 10.6275 10.8147 11.3082 11.3597 12.0947 12.2186 13.1015 13.2020 13.9156 13.9388 14.7831 14.8880 16.7325 16.7607 17.2526 17.4228 17.6805 17.7789 18.0873 18.3691 18.4524 18.6204 k = 0.1250 0.1250-0.0000 ( 6943 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.2817 3.2817 6.2559 6.2815 6.2877 6.3156 6.3560 6.4297 6.7934 6.8192 6.9286 6.9727 7.0238 7.0674 7.1030 7.1693 7.2353 7.3538 7.6316 7.7318 7.8628 8.0889 8.0962 8.1856 8.3109 8.3417 8.4300 8.4961 8.7345 8.8160 8.9985 9.0689 9.2913 9.4825 9.5483 9.7116 9.9088 9.9728 10.1540 10.1743 10.3805 10.5008 10.6412 10.8684 11.3419 11.4105 12.0947 12.2267 13.0886 13.2043 13.8798 13.8964 14.6888 14.7850 16.8385 16.8644 17.3381 17.5141 17.7453 17.8469 18.1184 18.3885 18.4823 18.6380 k = 0.1146 0.1146-0.0000 ( 6949 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.2453 3.2454 6.2702 6.2913 6.2951 6.3227 6.3574 6.4314 6.8047 6.8282 6.9364 6.9719 7.0205 7.0605 7.0977 7.1632 7.2287 7.3463 7.6421 7.7478 7.8800 8.0933 8.1366 8.1775 8.2999 8.3201 8.4255 8.5088 8.7418 8.8111 8.9951 9.0681 9.3065 9.4882 9.5511 9.7031 9.8787 9.9358 10.1713 10.1969 10.3893 10.4913 10.6596 10.9261 11.3711 11.4576 12.0942 12.2349 13.0787 13.2055 13.8268 13.8564 14.5939 14.6809 16.9604 16.9824 17.4258 17.6053 17.8139 17.9188 18.1499 18.4066 18.5119 18.6545 k = 0.1042 0.1042-0.0000 ( 6945 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.2120 3.2120 6.2829 6.2960 6.3053 6.3308 6.3587 6.4326 6.8151 6.8395 6.9440 6.9708 7.0168 7.0533 7.0941 7.1573 7.2216 7.3363 7.6502 7.7674 7.8902 8.0907 8.1692 8.1904 8.2860 8.3027 8.4163 8.5275 8.7493 8.8098 8.9907 9.0646 9.3226 9.4929 9.5540 9.6914 9.8457 9.8973 10.1922 10.2195 10.3968 10.4823 10.6833 10.9878 11.3953 11.5006 12.0910 12.2408 13.0740 13.2060 13.7691 13.8159 14.4983 14.5760 17.0940 17.1109 17.5153 17.6958 17.8860 17.9937 18.1817 18.4234 18.5403 18.6690 k = 0.0938 0.0937-0.0000 ( 6947 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.1817 3.1817 6.2940 6.3007 6.3137 6.3394 6.3599 6.4334 6.8247 6.8529 6.9506 6.9699 7.0131 7.0458 7.0920 7.1520 7.2141 7.3239 7.6567 7.7892 7.8916 8.0916 8.1659 8.2420 8.2657 8.2942 8.4046 8.5501 8.7572 8.8112 8.9850 9.0577 9.3394 9.4969 9.5571 9.6768 9.8122 9.8582 10.2149 10.2414 10.4030 10.4737 10.7131 11.0535 11.4140 11.5395 12.0825 12.2419 13.0769 13.2070 13.7139 13.7756 14.4017 14.4705 17.2353 17.2462 17.6066 17.7850 17.9610 18.0708 18.2138 18.4389 18.5665 18.6801 k = 0.0833 0.0833-0.0000 ( 6945 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.1546 3.1546 6.3037 6.3055 6.3204 6.3472 6.3620 6.4336 6.8338 6.8681 6.9549 6.9701 7.0095 7.0384 7.0917 7.1475 7.2067 7.3093 7.6623 7.8122 7.8842 8.0979 8.1638 8.2384 8.2858 8.3020 8.3931 8.5752 8.7653 8.8144 8.9778 9.0467 9.3570 9.5004 9.5604 9.6598 9.7797 9.8195 10.2381 10.2625 10.4076 10.4651 10.7495 11.1229 11.4266 11.5742 12.0667 12.2352 13.0896 13.2103 13.6653 13.7373 14.3044 14.3647 17.3781 17.3863 17.6995 17.8721 18.0384 18.1490 18.2464 18.4533 18.5897 18.6863 k = 0.0729 0.0729-0.0000 ( 6955 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.1306 3.1306 6.3103 6.3120 6.3259 6.3518 6.3666 6.4333 6.8428 6.8843 6.9557 6.9718 7.0064 7.0313 7.0930 7.1442 7.1995 7.2930 7.6676 7.8353 7.8699 8.1091 8.1638 8.2120 8.2853 8.3426 8.3927 8.6018 8.7734 8.8185 8.9692 9.0308 9.3754 9.5035 9.5641 9.6413 9.7492 9.7820 10.2607 10.2823 10.4105 10.4564 10.7931 11.1960 11.4327 11.6053 12.0423 12.2180 13.1135 13.2187 13.6257 13.7023 14.2067 14.2592 17.5153 17.5304 17.7934 17.9561 18.1175 18.2269 18.2804 18.4670 18.6088 18.6860 k = 0.0625 0.0625-0.0000 ( 6959 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.1097 3.1097 6.3151 6.3190 6.3306 6.3531 6.3736 6.4324 6.8519 6.9009 6.9539 6.9739 7.0037 7.0245 7.0960 7.1424 7.1926 7.2751 7.6731 7.8485 7.8608 8.1233 8.1646 8.1871 8.2829 8.3456 8.4321 8.6293 8.7812 8.8230 8.9589 9.0095 9.3945 9.5066 9.5680 9.6226 9.7198 9.7473 10.2821 10.3008 10.4116 10.4474 10.8435 11.2724 11.4314 11.6332 12.0098 12.1883 13.1494 13.2352 13.5958 13.6711 14.1089 14.1544 17.6454 17.6719 17.8869 18.0356 18.1968 18.2986 18.3205 18.4810 18.6230 18.6782 k = 0.0521 0.0521-0.0000 ( 6955 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0920 3.0920 6.3198 6.3250 6.3344 6.3525 6.3813 6.4309 6.8613 6.9172 6.9503 6.9754 7.0013 7.0183 7.1010 7.1423 7.1863 7.2562 7.6792 7.8286 7.8824 8.1342 8.1549 8.1805 8.2798 8.3321 8.4876 8.6568 8.7880 8.8279 8.9471 8.9825 9.4146 9.5097 9.5716 9.6057 9.6897 9.7173 10.3020 10.3179 10.4109 10.4380 10.9002 11.3516 11.4221 11.6587 11.9709 12.1451 13.1965 13.2624 13.5750 13.6438 14.0117 14.0507 17.7665 17.8052 17.9770 18.1081 18.2743 18.3454 18.3841 18.4969 18.6314 18.6627 k = 0.0417 0.0417-0.0000 ( 6959 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0775 3.0775 6.3245 6.3299 6.3374 6.3512 6.3888 6.4287 6.8710 6.9319 6.9461 6.9766 6.9984 7.0126 7.1081 7.1438 7.1804 7.2365 7.6861 7.8067 7.9052 8.1160 8.1632 8.1889 8.2752 8.3156 8.5454 8.6837 8.7924 8.8337 8.9336 8.9502 9.4358 9.5133 9.5715 9.5952 9.6578 9.6929 10.3205 10.3335 10.4083 10.4282 10.9620 11.4001 11.4371 11.6826 11.9287 12.0892 13.2539 13.3016 13.5619 13.6205 13.9156 13.9486 17.8769 17.9255 18.0584 18.1695 18.3468 18.3859 18.4508 18.5164 18.6329 18.6416 k = 0.0312 0.0312-0.0000 ( 6951 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0662 3.0662 6.3289 6.3339 6.3395 6.3492 6.3958 6.4259 6.8810 6.9355 6.9506 6.9779 6.9951 7.0069 7.1175 7.1467 7.1749 7.2165 7.6943 7.7852 7.9285 8.0878 8.1810 8.2007 8.2690 8.2977 8.6032 8.7091 8.7932 8.8412 8.9097 8.9219 9.4582 9.5173 9.5634 9.5962 9.6255 9.6725 10.3377 10.3476 10.4041 10.4177 11.0274 11.3721 11.5205 11.7057 11.8866 12.0223 13.3200 13.3528 13.5552 13.6008 13.8212 13.8488 17.9760 18.0282 18.1245 18.2135 18.4077 18.4295 18.5087 18.5387 18.6183 18.6305 k = 0.0208 0.0208-0.0000 ( 6955 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0582 3.0582 6.3331 6.3370 6.3408 6.3468 6.4023 6.4224 6.8910 6.9286 6.9630 6.9796 6.9915 7.0006 7.1293 7.1505 7.1697 7.1968 7.7042 7.7649 7.9525 8.0590 8.2002 8.2139 8.2610 8.2790 8.6601 8.7323 8.7896 8.8501 8.8684 8.9062 9.4821 9.5221 9.5527 9.5938 9.6035 9.6549 10.3536 10.3604 10.3982 10.4066 11.0945 11.3323 11.6068 11.7290 11.8470 11.9470 13.3929 13.4151 13.5538 13.5844 13.7293 13.7517 18.0631 18.1093 18.1704 18.2337 18.4511 18.4716 18.5530 18.5593 18.6058 18.6229 k = 0.0104 0.0104-0.0000 ( 6955 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0533 3.0533 6.3370 6.3392 6.3411 6.3439 6.4082 6.4183 6.9010 6.9201 6.9746 6.9819 6.9880 6.9933 7.1435 7.1550 7.1647 7.1777 7.7161 7.7465 7.9775 8.0308 8.2199 8.2272 8.2512 8.2596 8.7156 8.7524 8.7815 8.8194 8.8638 8.8912 9.5075 9.5278 9.5429 9.5635 9.6136 9.6393 10.3683 10.3718 10.3908 10.3947 11.1611 11.2826 11.6940 11.7536 11.8117 11.8658 13.4707 13.4877 13.5569 13.5709 13.6410 13.6582 18.1366 18.1649 18.1938 18.2266 18.4785 18.4915 18.5777 18.5847 18.6044 18.6138 k = 0.0000 0.0000 0.0000 ( 6931 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0517 3.0517 6.3406 6.3406 6.3406 6.3406 6.4136 6.4136 6.9108 6.9108 6.9847 6.9847 6.9847 6.9847 7.1598 7.1598 7.1598 7.1598 7.7301 7.7301 8.0036 8.0036 8.2398 8.2398 8.2398 8.2398 8.7690 8.7690 8.7690 8.7690 8.8768 8.8768 9.5347 9.5347 9.5347 9.5347 9.6256 9.6256 10.3820 10.3820 10.3820 10.3820 11.2247 11.2247 11.7808 11.7808 11.7808 11.7808 13.5468 13.5468 13.5695 13.5695 13.5695 13.5695 18.1928 18.1928 18.1928 18.1928 18.4910 18.4910 18.5998 18.5998 18.5998 18.5998 k = 0.0000 0.0000 0.0000 ( 6931 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0517 3.0517 6.3406 6.3406 6.3406 6.3406 6.4136 6.4136 6.9108 6.9108 6.9847 6.9847 6.9847 6.9847 7.1598 7.1598 7.1598 7.1598 7.7301 7.7301 8.0036 8.0036 8.2398 8.2398 8.2398 8.2398 8.7690 8.7690 8.7690 8.7690 8.8768 8.8768 9.5347 9.5347 9.5347 9.5347 9.6256 9.6256 10.3820 10.3820 10.3820 10.3820 11.2247 11.2247 11.7808 11.7808 11.7808 11.7808 13.5468 13.5468 13.5695 13.5695 13.5695 13.5695 18.1928 18.1928 18.1928 18.1928 18.4910 18.4910 18.5998 18.5998 18.5998 18.5998 k = 0.0085 0.0085 0.0085 ( 6949 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0533 3.0533 6.3370 6.3397 6.3406 6.3440 6.4082 6.4183 6.9010 6.9201 6.9747 6.9818 6.9878 6.9934 7.1434 7.1569 7.1623 7.1783 7.7161 7.7464 7.9775 8.0307 8.2216 8.2249 8.2536 8.2579 8.7144 8.7594 8.7744 8.8209 8.8638 8.8911 9.5066 9.5343 9.5364 9.5644 9.6136 9.6392 10.3697 10.3702 10.3920 10.3938 11.1614 11.2823 11.6945 11.7533 11.8117 11.8655 13.4705 13.4880 13.5582 13.5706 13.6421 13.6560 18.1366 18.1667 18.1906 18.2283 18.4772 18.4933 18.5807 18.5822 18.6008 18.6165 k = 0.0169 0.0169 0.0169 ( 6955 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0581 3.0581 6.3331 6.3379 6.3396 6.3470 6.4023 6.4224 6.8911 6.9286 6.9637 6.9790 6.9910 7.0008 7.1298 7.1538 7.1646 7.1982 7.7042 7.7649 7.9526 8.0589 8.2034 8.2093 8.2658 8.2756 8.6578 8.7449 8.7766 8.8529 8.8693 8.9053 9.4801 9.5357 9.5387 9.5960 9.6038 9.6547 10.3563 10.3571 10.4004 10.4050 11.0952 11.3317 11.6080 11.7282 11.8467 11.9466 13.3936 13.4136 13.5577 13.5867 13.7295 13.7460 18.0626 18.1129 18.1622 18.2400 18.4387 18.4879 18.5578 18.5648 18.5838 18.6321 k = 0.0254 0.0254 0.0254 ( 6949 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0661 3.0661 6.3291 6.3352 6.3377 6.3496 6.3959 6.4259 6.8812 6.9361 6.9515 6.9766 6.9945 7.0067 7.1197 7.1505 7.1666 7.2190 7.6941 7.7853 7.9284 8.0880 8.1852 8.1941 8.2766 8.2927 8.6002 8.7254 8.7764 8.8445 8.9136 8.9185 9.4548 9.5390 9.5406 9.5966 9.6297 9.6719 10.3401 10.3442 10.4076 10.4155 11.0287 11.3707 11.5224 11.7043 11.8855 12.0212 13.3235 13.3491 13.5629 13.6069 13.8188 13.8383 17.9741 18.0333 18.1127 18.2251 18.3696 18.4623 18.5430 18.5494 18.5667 18.6472 k = 0.0339 0.0339 0.0339 ( 6958 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0773 3.0773 6.3250 6.3317 6.3348 6.3517 6.3888 6.4287 6.8715 6.9383 6.9419 6.9749 6.9982 7.0111 7.1136 7.1472 7.1686 7.2400 7.6855 7.8074 7.9046 8.1175 8.1673 8.1802 8.2859 8.3088 8.5425 8.7017 8.7742 8.8382 8.9301 8.9532 9.4307 9.5405 9.5441 9.5933 9.6656 9.6913 10.3212 10.3311 10.4136 10.4252 10.9639 11.3986 11.4386 11.6807 11.9255 12.0857 13.2632 13.2981 13.5732 13.6312 13.9086 13.9320 17.8735 17.9311 18.0484 18.1830 18.2789 18.4040 18.5352 18.5387 18.5674 18.6629 k = 0.0424 0.0424 0.0424 ( 6958 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2493 -87.2493 -87.2493 -87.2493 3.0917 3.0917 6.3208 6.3273 6.3311 6.3531 6.3813 6.4308 6.8623 6.9243 6.9453 6.9746 7.0021 7.0138 7.1114 7.1442 7.1708 7.2606 7.6778 7.8307 7.8807 8.1470 8.1498 8.1688 8.2942 8.3228 8.4865 8.6747 8.7707 8.8331 8.9396 8.9877 9.4078 9.5375 9.5507 9.5943 9.7038 9.7129 10.2994 10.3179 10.4188 10.4341 10.9025 11.3570 11.4160 11.6570 11.9628 12.1355 13.2162 13.2649 13.5883 13.6592 13.9982 14.0262 17.7629 17.8104 17.9746 18.1171 18.1757 18.3235 18.5320 18.5337 18.5807 18.6803 k = 0.0508 0.0508 0.0508 ( 6952 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.1093 3.1093 6.3167 6.3222 6.3266 6.3538 6.3734 6.4321 6.8536 6.9098 6.9457 6.9761 7.0062 7.0154 7.1128 7.1417 7.1732 7.2804 7.6707 7.8546 7.8561 8.1328 8.1611 8.1762 8.3020 8.3316 8.4359 8.6451 8.7662 8.8288 8.9469 9.0166 9.3860 9.5319 9.5585 9.5989 9.7371 9.7439 10.2746 10.3048 10.4231 10.4419 10.8456 11.2781 11.4242 11.6328 11.9916 12.1663 13.1864 13.2539 13.6079 13.6903 14.0868 14.1203 17.6439 17.6755 17.8955 18.0339 18.0656 18.2312 18.5323 18.5337 18.6006 18.7001 k = 0.0593 0.0593 0.0593 ( 6970 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.1299 3.1300 6.3126 6.3161 6.3213 6.3537 6.3651 6.4325 6.8455 6.8951 6.9435 6.9792 7.0103 7.0163 7.1170 7.1399 7.1760 7.2988 7.6635 7.8306 7.8783 8.1165 8.1577 8.2042 8.3099 8.3231 8.4032 8.6137 8.7613 8.8246 8.9523 9.0399 9.3657 9.5247 9.5668 9.6058 9.7640 9.7857 10.2472 10.2918 10.4268 10.4488 10.7938 11.2024 11.4247 11.6079 12.0066 12.1750 13.1772 13.2675 13.6314 13.7239 14.1738 14.2135 17.5178 17.5305 17.8141 17.9403 17.9522 18.1329 18.5358 18.5377 18.6248 18.7226 k = 0.0678 0.0678 0.0678 ( 6964 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.1538 3.1538 6.3085 6.3093 6.3154 6.3527 6.3568 6.4319 6.8383 6.8806 6.9398 6.9828 7.0141 7.0172 7.1231 7.1392 7.1792 7.3152 7.6558 7.8044 7.9012 8.1012 8.1588 8.2304 8.2876 8.3187 8.3988 8.5815 8.7564 8.8201 8.9560 9.0576 9.3468 9.5165 9.5751 9.6139 9.7937 9.8284 10.2175 10.2790 10.4299 10.4545 10.7474 11.1302 11.4190 11.5822 12.0041 12.1618 13.1906 13.3054 13.6583 13.7591 14.2585 14.3052 17.3789 17.3856 17.7324 17.8379 17.8424 18.0323 18.5421 18.5448 18.6524 18.7477 k = 0.0763 0.0763 0.0763 ( 6958 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.1807 3.1807 6.3016 6.3046 6.3088 6.3486 6.3507 6.4303 6.8317 6.8665 6.9350 6.9864 7.0175 7.0184 7.1306 7.1400 7.1827 7.3290 7.6469 7.7785 7.9225 8.0870 8.1637 8.2415 8.2540 8.3288 8.4068 8.5491 8.7521 8.8151 8.9586 9.0696 9.3296 9.5078 9.5830 9.6225 9.8260 9.8713 10.1863 10.2668 10.4327 10.4591 10.7062 11.0619 11.4083 11.5556 11.9829 12.1295 13.2255 13.3641 13.6881 13.7952 14.3403 14.3946 17.2238 17.2490 17.6522 17.7246 17.7444 17.9320 18.5510 18.5545 18.6829 18.7755 k = 0.0847 0.0847 0.0847 ( 6955 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.2107 3.2107 6.2930 6.3008 6.3018 6.3408 6.3476 6.4277 6.8259 6.8530 6.9298 6.9898 7.0201 7.0202 7.1389 7.1426 7.1866 7.3397 7.6358 7.7542 7.9415 8.0743 8.1713 8.1950 8.2746 8.3408 8.4175 8.5178 8.7489 8.8094 8.9608 9.0764 9.3145 9.4988 9.5901 9.6309 9.8608 9.9133 10.1546 10.2552 10.4352 10.4626 10.6698 10.9978 11.3936 11.5283 11.9445 12.0822 13.2784 13.4386 13.7204 13.8313 14.4183 14.4809 17.0680 17.1097 17.5748 17.6140 17.6496 17.8340 18.5625 18.5667 18.7162 18.8056 k = 0.0932 0.0932 0.0932 ( 6940 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.2437 3.2438 6.2836 6.2945 6.2972 6.3335 6.3436 6.4239 6.8207 6.8402 6.9244 6.9926 7.0219 7.0226 7.1472 7.1475 7.1906 7.3469 7.6213 7.7336 7.9574 8.0633 8.1512 8.1799 8.2919 8.3544 8.4284 8.4891 8.7475 8.8028 8.9633 9.0782 9.3014 9.4897 9.5962 9.6389 9.8974 9.9529 10.1235 10.2447 10.4375 10.4652 10.6374 10.9384 11.3756 11.5002 11.8921 12.0243 13.3440 13.5237 13.7548 13.8665 14.4917 14.5633 16.9140 16.9700 17.5013 17.5074 17.5603 17.7403 18.5762 18.5811 18.7522 18.8381 k = 0.1017 0.1017 0.1017 ( 6919 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.2797 3.2798 6.2735 6.2869 6.2937 6.3267 6.3384 6.4189 6.8160 6.8280 6.9189 6.9947 7.0225 7.0258 7.1540 7.1561 7.1945 7.3500 7.6028 7.7179 7.9699 8.0539 8.1115 8.1868 8.3058 8.3693 8.4386 8.4652 8.7481 8.7953 8.9671 9.0756 9.2905 9.4804 9.6011 9.6460 9.9355 9.9883 10.0941 10.2357 10.4399 10.4672 10.6082 10.8842 11.3551 11.4714 11.8288 11.9591 13.4162 13.6144 13.7912 13.8998 14.5597 14.6408 16.7647 16.8323 17.4061 17.4324 17.4783 17.6526 18.5921 18.5977 18.7906 18.8727 k = 0.1102 0.1102 0.1102 ( 6934 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.3187 3.3189 6.2630 6.2793 6.2904 6.3207 6.3322 6.4126 6.8117 6.8165 6.9132 6.9961 7.0220 7.0297 7.1630 7.1645 7.1984 7.3492 7.5810 7.7071 7.9788 8.0447 8.0783 8.1890 8.3162 8.3854 8.4476 8.4486 8.7510 8.7869 8.9731 9.0692 9.2816 9.4710 9.6047 9.6520 9.9742 10.0174 10.0673 10.2286 10.4426 10.4692 10.5816 10.8358 11.3323 11.4419 11.7576 11.8894 13.4886 13.7064 13.8296 13.9301 14.6215 14.7123 16.6226 16.6994 17.3112 17.3687 17.4050 17.5729 18.6100 18.6164 18.8315 18.9092 k = 0.1186 0.1186 0.1186 ( 6931 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.3606 3.3608 6.2524 6.2717 6.2874 6.3152 6.3250 6.4051 6.8054 6.8076 6.9075 6.9966 7.0206 7.0344 7.1723 7.1741 7.2019 7.3445 7.5574 7.7004 7.9840 8.0285 8.0592 8.1842 8.3224 8.4025 8.4417 8.4551 8.7559 8.7778 8.9821 9.0600 9.2745 9.4617 9.6070 9.6564 10.0129 10.0382 10.0440 10.2234 10.4459 10.4719 10.5569 10.7940 11.3078 11.4118 11.6809 11.8170 13.5551 13.7952 13.8702 13.9563 14.6760 14.7768 16.4912 16.5749 17.2238 17.3104 17.3419 17.5032 18.6297 18.6373 18.8746 18.9476 k = 0.1271 0.1271 0.1271 ( 6919 PWs) bands (ev): -87.2498 -87.2498 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.4054 3.4056 6.2418 6.2643 6.2844 6.3103 6.3169 6.3963 6.7945 6.8034 6.9016 6.9961 7.0183 7.0396 7.1791 7.1871 7.2051 7.3368 7.5339 7.6963 7.9858 8.0042 8.0553 8.1714 8.3244 8.4206 8.4448 8.4609 8.7628 8.7683 8.9948 9.0486 9.2690 9.4525 9.6081 9.6592 10.0246 10.0496 10.0508 10.2189 10.4502 10.4761 10.5337 10.7597 11.2817 11.3812 11.6007 11.7434 13.6101 13.8763 13.9122 13.9773 14.7225 14.8331 16.3742 16.4624 17.1450 17.2571 17.2903 17.4458 18.6512 18.6602 18.9196 18.9876 k = 0.1356 0.1356 0.1356 ( 6931 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.4529 3.4532 6.2316 6.2572 6.2815 6.3061 6.3082 6.3864 6.7836 6.7990 6.8953 6.9946 7.0155 7.0454 7.1845 7.2017 7.2079 7.3271 7.5117 7.6938 7.9800 7.9845 8.0579 8.1524 8.3225 8.4389 8.4562 8.4647 8.7590 8.7715 9.0115 9.0358 9.2649 9.4435 9.6079 9.6601 10.0095 10.0521 10.0868 10.2129 10.4561 10.4821 10.5114 10.7341 11.2542 11.3500 11.5182 11.6698 13.6501 13.9448 13.9526 13.9922 14.7601 14.8801 16.2758 16.3664 17.0753 17.2084 17.2514 17.4026 18.6742 18.6852 18.9660 19.0290 k = 0.1441 0.1441 0.1441 ( 6931 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.5032 3.5036 6.2219 6.2506 6.2782 6.2993 6.3024 6.3752 6.7724 6.7941 6.8883 6.9921 7.0122 7.0516 7.1879 7.2102 7.2177 7.3168 7.4918 7.6920 7.9581 7.9806 8.0645 8.1298 8.3175 8.4566 8.4665 8.4728 8.7504 8.7822 9.0221 9.0320 9.2620 9.4347 9.6066 9.6594 9.9987 10.0473 10.1199 10.2029 10.4643 10.4889 10.4899 10.7183 11.2254 11.3184 11.4349 11.5970 13.6740 13.9862 13.9957 13.9999 14.7883 14.9165 16.2010 16.2918 17.0155 17.1643 17.2263 17.3749 18.6983 18.7122 19.0124 19.0717 k = 0.1525 0.1525 0.1525 ( 6934 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.5562 3.5566 6.2130 6.2446 6.2736 6.2913 6.2992 6.3629 6.7607 6.7886 6.8805 6.9886 7.0087 7.0581 7.1889 7.2121 7.2349 7.3075 7.4746 7.6901 7.9385 7.9744 8.0741 8.1062 8.3102 8.4660 8.4725 8.4917 8.7437 8.7952 9.0079 9.0562 9.2604 9.4262 9.6042 9.6571 9.9917 10.0373 10.1488 10.1877 10.4689 10.4755 10.4943 10.7136 11.1953 11.2863 11.3517 11.5259 13.6823 13.9997 14.0065 14.0246 14.8067 14.9411 16.1542 16.2434 16.9656 17.1250 17.2157 17.3630 18.7230 18.7414 19.0526 19.1156 k = 0.1610 0.1610 0.1610 ( 6928 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.6118 3.6123 6.2051 6.2392 6.2662 6.2856 6.2966 6.3495 6.7483 6.7822 6.8718 6.9843 7.0050 7.0648 7.1870 7.2136 7.2530 7.3004 7.4601 7.6875 7.9211 7.9662 8.0837 8.0862 8.3016 8.4633 8.4859 8.5103 8.7400 8.8110 8.9937 9.0832 9.2602 9.4180 9.6007 9.6537 9.9882 10.0235 10.1674 10.1724 10.4483 10.4904 10.4960 10.7199 11.1634 11.2539 11.2702 11.4571 13.6758 13.9910 14.0083 14.0281 14.8150 14.9528 16.1387 16.2253 16.9254 17.0908 17.2200 17.3663 18.7470 18.7726 19.0485 19.1605 k = 0.1695 0.1695 0.1695 ( 6916 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.6699 3.6705 6.1983 6.2344 6.2558 6.2826 6.2945 6.3353 6.7351 6.7748 6.8621 6.9794 7.0014 7.0714 7.1826 7.2146 7.2718 7.2961 7.4481 7.6839 7.9056 7.9563 8.0636 8.1002 8.2923 8.4582 8.4963 8.5263 8.7409 8.8297 8.9794 9.1123 9.2612 9.4101 9.5962 9.6494 9.9874 10.0067 10.1432 10.1899 10.4282 10.4933 10.5092 10.7355 11.1283 11.1926 11.2210 11.3915 13.6551 13.9736 13.9891 14.0050 14.8134 14.9508 16.1559 16.2393 16.8940 17.0615 17.2391 17.3837 18.7669 18.8059 18.9629 19.0858 k = 0.1780 0.1780 0.1780 ( 6935 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.7305 3.7312 6.1927 6.2302 6.2436 6.2810 6.2930 6.3205 6.7211 6.7662 6.8514 6.9740 6.9979 7.0779 7.1766 7.2154 7.2910 7.2946 7.4382 7.6789 7.8919 7.9449 8.0472 8.1155 8.2831 8.4511 8.5039 8.5383 8.7474 8.8514 8.9653 9.1427 9.2637 9.4026 9.5909 9.6447 9.9877 9.9887 10.1164 10.2011 10.4086 10.4868 10.5318 10.7572 11.0831 11.1272 11.1878 11.3300 13.6201 13.9474 13.9497 13.9564 14.8021 14.9353 16.2043 16.2847 16.8701 17.0361 17.2723 17.4140 18.7723 18.8413 18.8548 18.9927 k = 0.1864 0.1864 0.1864 ( 6923 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.7934 3.7943 6.1886 6.2264 6.2302 6.2803 6.2920 6.3054 6.7065 6.7564 6.8402 6.9680 6.9945 7.0838 7.1701 7.2158 7.2951 7.3104 7.4297 7.6729 7.8798 7.9325 8.0349 8.1317 8.2743 8.4420 8.5090 8.5455 8.7599 8.8756 8.9512 9.1738 9.2677 9.3953 9.5847 9.6400 9.9668 9.9913 10.0880 10.2060 10.3897 10.4775 10.5568 10.7812 11.0207 11.0818 11.1544 11.2739 13.5708 13.8853 13.8937 13.9126 14.7818 14.9072 16.2800 16.3584 16.8515 17.0125 17.3188 17.4556 18.7385 18.7470 18.8787 18.9450 k = 0.1949 0.1949 0.1949 ( 6935 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.8586 3.8596 6.1859 6.2158 6.2222 6.2803 6.2910 6.2915 6.6916 6.7452 6.8286 6.9614 6.9912 7.0890 7.1644 7.2158 7.2968 7.3297 7.4219 7.6664 7.8692 7.9191 8.0269 8.1480 8.2663 8.4314 8.5120 8.5488 8.7776 8.9019 8.9372 9.2048 9.2732 9.3884 9.5779 9.6355 9.9443 9.9944 10.0590 10.2052 10.3717 10.4664 10.5826 10.8038 10.9550 11.0447 11.1207 11.2251 13.5068 13.7957 13.8261 13.8699 14.7530 14.8681 16.3776 16.4559 16.8361 16.9874 17.3772 17.5072 18.6477 18.6653 18.9183 18.9473 k = 0.2034 0.2034 0.2034 ( 6941 PWs) bands (ev): -87.2497 -87.2497 -87.2494 -87.2494 -87.2494 -87.2494 -87.2493 -87.2493 3.9259 3.9271 6.1848 6.2007 6.2166 6.2785 6.2807 6.2915 6.6769 6.7327 6.8172 6.9539 6.9882 7.0931 7.1602 7.2154 7.2992 7.3485 7.4140 7.6601 7.8600 7.9051 8.0230 8.1638 8.2595 8.4199 8.5138 8.5494 8.7991 8.9229 8.9294 9.2349 9.2803 9.3817 9.5704 9.6315 9.9204 9.9974 10.0302 10.1994 10.3552 10.4542 10.6058 10.8207 10.8956 11.0091 11.0868 11.1864 13.4284 13.6915 13.7516 13.8200 14.7166 14.8198 16.4891 16.5725 16.8231 16.9565 17.4462 17.5672 18.5632 18.5851 18.9600 18.9720 k = 0.2119 0.2119 0.2119 ( 6941 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 3.9953 3.9966 6.1848 6.1854 6.2079 6.2699 6.2815 6.2919 6.6627 6.7189 6.8062 6.9455 6.9854 7.0956 7.1580 7.2146 7.3019 7.3665 7.4055 7.6550 7.8522 7.8908 8.0226 8.1781 8.2538 8.4084 8.5149 8.5488 8.8228 8.9083 8.9576 9.2636 9.2889 9.3751 9.5625 9.6282 9.8954 9.9995 10.0022 10.1891 10.3405 10.4411 10.6211 10.8277 10.8488 10.9739 11.0528 11.1611 13.3365 13.5764 13.6741 13.7636 14.6734 14.7639 16.5960 16.7042 16.8223 16.9149 17.5246 17.6343 18.4993 18.5163 19.0038 19.0054 k = 0.2203 0.2203 0.2203 ( 6941 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.0665 4.0680 6.1682 6.1877 6.1951 6.2664 6.2826 6.2929 6.6495 6.7037 6.7960 6.9359 6.9827 7.0967 7.1581 7.2134 7.3046 7.3834 7.3962 7.6516 7.8456 7.8766 8.0252 8.1896 8.2495 8.3981 8.5158 8.5482 8.8476 8.8931 8.9857 9.2902 9.2990 9.3686 9.5542 9.6257 9.8698 9.9751 9.9999 10.1750 10.3282 10.4274 10.6210 10.8216 10.8221 10.9392 11.0189 11.1516 13.2331 13.4534 13.5956 13.7017 14.6243 14.7020 16.6458 16.8473 16.8581 16.8782 17.6111 17.7073 18.4607 18.4675 19.0435 19.0498 k = 0.2288 0.2288 0.2288 ( 6938 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.1396 4.1413 6.1510 6.1788 6.1918 6.2674 6.2841 6.2942 6.6378 6.6874 6.7866 6.9252 6.9802 7.0963 7.1600 7.2119 7.3071 7.3859 7.3986 7.6504 7.8402 7.8629 8.0302 8.1968 8.2464 8.3906 8.5171 8.5484 8.8724 8.8772 9.0130 9.3106 9.3138 9.3621 9.5458 9.6243 9.8437 9.9494 9.9982 10.1579 10.3188 10.4133 10.6024 10.8028 10.8165 10.9071 10.9851 11.1570 13.1210 13.3250 13.5170 13.6352 14.5699 14.6352 16.6176 16.7832 16.9990 17.0052 17.7048 17.7852 18.4433 18.4502 19.0847 19.0980 k = 0.2373 0.2373 0.2373 ( 6929 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.2142 4.2161 6.1334 6.1605 6.1977 6.2720 6.2858 6.2959 6.6278 6.6700 6.7781 6.9135 6.9778 7.0949 7.1632 7.2099 7.3093 7.3751 7.4118 7.6513 7.8358 7.8500 8.0372 8.1982 8.2447 8.3876 8.5189 8.5500 8.8603 8.8966 9.0387 9.3235 9.3340 9.3556 9.5375 9.6240 9.8178 9.9251 9.9937 10.1385 10.3127 10.3989 10.5724 10.7747 10.8161 10.8859 10.9515 11.1737 13.0029 13.1931 13.4386 13.5650 14.5111 14.5646 16.5495 16.6894 17.1568 17.1615 17.8047 17.8674 18.4457 18.4680 19.1286 19.1484 k = 0.2458 0.2458 0.2458 ( 6935 PWs) bands (ev): -87.2497 -87.2497 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.2903 4.2925 6.1153 6.1412 6.2055 6.2794 6.2878 6.2980 6.6199 6.6517 6.7703 6.9011 6.9756 7.0928 7.1671 7.2076 7.3113 7.3642 7.4225 7.6539 7.8323 7.8384 8.0459 8.1927 8.2441 8.3902 8.5216 8.5534 8.8424 8.9196 9.0622 9.3377 9.3490 9.3502 9.5294 9.6249 9.7923 9.9022 9.9865 10.1182 10.3101 10.3843 10.5395 10.7411 10.7974 10.8907 10.9184 11.1974 12.8810 13.0594 13.3606 13.4920 14.4485 14.4911 16.4569 16.5780 17.3186 17.3298 17.9102 17.9536 18.4743 18.5119 19.1749 19.2010 k = 0.2542 0.2542 0.2542 ( 6935 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.3677 4.3702 6.0971 6.1214 6.2151 6.2890 6.2899 6.3004 6.6142 6.6326 6.7625 6.8887 6.9735 7.0903 7.1714 7.2048 7.3129 7.3536 7.4304 7.6577 7.8283 7.8295 8.0559 8.1809 8.2446 8.3981 8.5251 8.5586 8.8234 8.9409 9.0825 9.3422 9.3530 9.3621 9.5217 9.6270 9.7678 9.8808 9.9765 10.0983 10.3110 10.3696 10.5078 10.7047 10.7640 10.8859 10.9128 11.2250 12.7576 12.9251 13.2832 13.4168 14.3828 14.4153 16.3455 16.4515 17.4827 17.5048 18.0208 18.0435 18.5269 18.5784 19.2236 19.2560 k = 0.2627 0.2627 0.2627 ( 6950 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.4463 4.4489 6.0790 6.1017 6.2265 6.2921 6.3006 6.3030 6.6109 6.6129 6.7541 6.8774 6.9715 7.0876 7.1756 7.2017 7.3142 7.3439 7.4353 7.6622 7.8201 7.8273 8.0672 8.1639 8.2460 8.4100 8.5293 8.5656 8.8032 8.9602 9.0986 9.3353 9.3693 9.3697 9.5145 9.6304 9.7445 9.8610 9.9643 10.0803 10.3151 10.3548 10.4790 10.6673 10.7258 10.8542 10.9403 11.2544 12.6343 12.7913 13.2066 13.3403 14.3144 14.3377 16.2191 16.3130 17.6473 17.6840 18.1362 18.1369 18.6005 18.6637 19.2747 19.3133 k = 0.2712 0.2712 0.2712 ( 6950 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.5257 4.5287 6.0610 6.0824 6.2396 6.2943 6.3058 6.3138 6.5930 6.6099 6.7442 6.8685 6.9696 7.0846 7.1796 7.1982 7.3152 7.3353 7.4369 7.6669 7.8137 7.8252 8.0797 8.1434 8.2483 8.4247 8.5342 8.5744 8.7819 8.9769 9.1097 9.3284 9.3733 9.3864 9.5081 9.6351 9.7226 9.8427 9.9503 10.0654 10.3218 10.3399 10.4533 10.6299 10.6855 10.8237 10.9692 11.2843 12.5124 12.6589 13.1311 13.2630 14.2439 14.2590 16.0808 16.1649 17.8108 17.8655 18.2334 18.2562 18.6918 18.7644 19.3284 19.3731 k = 0.2797 0.2797 0.2797 ( 6947 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.6058 4.6091 6.0435 6.0637 6.2541 6.2965 6.3089 6.3286 6.5730 6.6113 6.7321 6.8631 6.9679 7.0814 7.1832 7.1944 7.3160 7.3280 7.4355 7.6713 7.8091 7.8230 8.0931 8.1208 8.2512 8.4408 8.5392 8.5848 8.7597 8.9908 9.1149 9.3217 9.3733 9.4041 9.5031 9.6409 9.7024 9.8260 9.9354 10.0545 10.3250 10.3305 10.4307 10.5931 10.6441 10.7947 10.9977 11.3138 12.3932 12.5290 13.0572 13.1855 14.1716 14.1793 15.9335 16.0098 17.9714 18.0480 18.3326 18.3807 18.7976 18.8775 19.3850 19.4353 k = 0.2881 0.2881 0.2881 ( 6947 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.6864 4.6900 6.0267 6.0460 6.2696 6.2986 6.3124 6.3445 6.5534 6.6149 6.7176 6.8619 6.9664 7.0782 7.1863 7.1903 7.3165 7.3221 7.4312 7.6751 7.8061 7.8203 8.0970 8.1075 8.2545 8.4575 8.5439 8.5964 8.7370 9.0014 9.1139 9.3154 9.3697 9.4224 9.5005 9.6478 9.6839 9.8110 9.9202 10.0479 10.3101 10.3408 10.4106 10.5573 10.6022 10.7674 11.0249 11.3420 12.2780 12.4023 12.9850 13.1084 14.0979 14.0992 15.7793 15.8494 18.1278 18.2303 18.4338 18.5096 18.9150 19.0007 19.4450 19.5000 k = 0.2966 0.2966 0.2966 ( 6935 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.7672 4.7712 6.0107 6.0294 6.2849 6.3005 6.3167 6.3610 6.5349 6.6208 6.7016 6.8649 6.9651 7.0749 7.1862 7.1889 7.3170 7.3176 7.4244 7.6780 7.8044 7.8165 8.0732 8.1226 8.2578 8.4738 8.5478 8.6089 8.7141 9.0083 9.1069 9.3101 9.3623 9.4411 9.5014 9.6555 9.6672 9.7977 9.9057 10.0453 10.2951 10.3520 10.3926 10.5228 10.5603 10.7425 11.0501 11.3679 12.1680 12.2802 12.9150 13.0319 14.0188 14.0231 15.6200 15.6851 18.2788 18.4108 18.5367 18.6423 19.0410 19.1319 19.5090 19.5673 k = 0.3051 0.3051 0.3051 ( 6929 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.8479 4.8523 5.9958 6.0140 6.2978 6.3021 6.3235 6.3774 6.5183 6.6288 6.6855 6.8717 6.9642 7.0717 7.1821 7.1909 7.3144 7.3173 7.4156 7.6800 7.8037 7.8110 8.0502 8.1383 8.2608 8.4887 8.5501 8.6220 8.6920 9.0110 9.0947 9.3062 9.3511 9.4598 9.5064 9.6521 9.6637 9.7863 9.8924 10.0459 10.2801 10.3635 10.3762 10.4897 10.5190 10.7202 11.0725 11.3903 12.0646 12.1641 12.8474 12.9567 13.9383 13.9474 15.4570 15.5183 18.4239 18.5883 18.6404 18.7778 19.1727 19.2693 19.5783 19.6373 k = 0.3136 0.3136 0.3136 ( 6938 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 4.9283 4.9331 5.9821 6.0001 6.3032 6.3056 6.3336 6.3925 6.5053 6.6388 6.6710 6.8817 6.9636 7.0685 7.1782 7.1924 7.3122 7.3175 7.4052 7.6810 7.8033 7.8036 8.0289 8.1542 8.2629 8.5008 8.5503 8.6351 8.6718 9.0091 9.0786 9.3042 9.3366 9.4785 9.5157 9.6387 9.6720 9.7768 9.8813 10.0488 10.2650 10.3606 10.3746 10.4583 10.4791 10.7013 11.0912 11.4073 11.9692 12.0561 12.7824 12.8829 13.8580 13.8710 15.2915 15.3497 18.5630 18.7447 18.7611 18.9147 19.3065 19.4109 19.6546 19.7098 k = 0.3220 0.3220 0.3220 ( 6947 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.0081 5.0133 5.9698 5.9876 6.3039 6.3092 6.3436 6.4048 6.4985 6.6506 6.6603 6.8944 6.9636 7.0654 7.1748 7.1933 7.3111 7.3175 7.3938 7.6810 7.7927 7.8038 8.0101 8.1702 8.2637 8.5085 8.5479 8.6478 8.6553 9.0025 9.0597 9.3044 9.3194 9.4969 9.5287 9.6268 9.6799 9.7692 9.8734 10.0532 10.2497 10.3447 10.3849 10.4286 10.4419 10.6862 11.1049 11.4158 11.8838 11.9599 12.7203 12.8110 13.7781 13.7942 15.1245 15.1803 18.6965 18.8490 18.9276 19.0509 19.4377 19.5542 19.7405 19.7847 k = 0.3305 0.3305 0.3305 ( 6953 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.0869 5.0925 5.9590 5.9768 6.3039 6.3105 6.3485 6.4122 6.5008 6.6560 6.6641 6.9095 6.9640 7.0625 7.1722 7.1937 7.3108 7.3174 7.3817 7.6803 7.7790 7.8042 7.9942 8.1859 8.2623 8.5094 8.5428 8.6447 8.6596 8.9911 9.0391 9.3000 9.3073 9.5146 9.5452 9.6163 9.6867 9.7637 9.8694 10.0580 10.2340 10.3265 10.3937 10.4010 10.4096 10.6756 11.1124 11.4110 11.8103 11.8804 12.6611 12.7412 13.6986 13.7171 14.9567 15.0106 18.8251 18.9529 19.0858 19.1844 19.5611 19.6963 19.8382 19.8616 k = 0.3390 0.3390 0.3390 ( 6947 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.1645 5.1706 5.9498 5.9676 6.3031 6.3102 6.3462 6.4132 6.5139 6.6598 6.6792 6.9266 6.9652 7.0599 7.1705 7.1936 7.3113 7.3171 7.3694 7.6788 7.7624 7.8045 7.9814 8.2011 8.2580 8.5027 8.5352 8.6409 8.6700 8.9753 9.0173 9.2785 9.3129 9.5314 9.5651 9.6075 9.6919 9.7602 9.8704 10.0625 10.2178 10.3036 10.3757 10.3848 10.4007 10.6697 11.1123 11.3873 11.7509 11.8237 12.6051 12.6737 13.6197 13.6399 14.7887 14.8411 18.9495 19.0561 19.2340 19.3134 19.6730 19.8328 19.9400 19.9461 k = 0.3475 0.3475 0.3475 ( 6941 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.2405 5.2470 5.9422 5.9601 6.3015 6.3082 6.3377 6.4074 6.5364 6.6722 6.6957 6.9451 6.9670 7.0576 7.1702 7.1931 7.3126 7.3164 7.3572 7.6769 7.7433 7.8047 7.9713 8.2155 8.2501 8.4895 8.5256 8.6428 8.6785 8.9553 8.9945 9.2548 9.3213 9.5466 9.5883 9.6006 9.6951 9.7588 9.8768 10.0656 10.2009 10.2757 10.3528 10.3682 10.4058 10.6687 11.1038 11.3426 11.7070 11.7922 12.5522 12.6088 13.5415 13.5627 14.6212 14.6725 19.0702 19.1585 19.3707 19.4366 19.7733 19.9584 20.0189 20.0540 k = 0.3559 0.3559 0.3559 ( 6935 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.3147 5.3216 5.9364 5.9544 6.2990 6.3042 6.3261 6.3959 6.5656 6.6923 6.7134 6.9647 6.9697 7.0557 7.1715 7.1923 7.3147 7.3153 7.3453 7.6746 7.7226 7.8047 7.9633 8.2288 8.2378 8.4724 8.5151 8.6478 8.6845 8.9317 8.9706 9.2288 9.3324 9.5590 9.5969 9.6152 9.6964 9.7592 9.8889 10.0669 10.1832 10.2451 10.3327 10.3578 10.4089 10.6724 11.0872 11.2809 11.6791 11.7823 12.5027 12.5467 13.4641 13.4856 14.4546 14.5051 19.1877 19.2597 19.4953 19.5534 19.8645 20.0681 20.0972 20.1465 k = 0.3644 0.3644 0.3644 ( 6944 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.3866 5.3939 5.9323 5.9504 6.2953 6.2969 6.3144 6.3804 6.5996 6.7183 6.7323 6.9733 6.9848 7.0542 7.1750 7.1910 7.3135 7.3177 7.3341 7.6722 7.7014 7.8045 7.9567 8.2208 8.2410 8.4536 8.5045 8.6537 8.6876 8.9052 8.9454 9.1998 9.3461 9.5662 9.5984 9.6458 9.6961 9.7614 9.9063 10.0655 10.1643 10.2139 10.3155 10.3516 10.4107 10.6803 11.0643 11.2091 11.6661 11.7875 12.4565 12.4877 13.3876 13.4087 14.2895 14.3394 19.3024 19.3597 19.6080 19.6635 19.9486 20.1594 20.1738 20.2179 k = 0.3729 0.3729 0.3729 ( 6950 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.4559 5.4636 5.9301 5.9483 6.2851 6.2904 6.3049 6.3623 6.6368 6.7484 6.7521 6.9778 7.0046 7.0533 7.1812 7.1893 7.3108 7.3217 7.3237 7.6699 7.6805 7.8041 7.9508 8.1991 8.2520 8.4347 8.4945 8.6590 8.6874 8.8762 8.9187 9.1676 9.3623 9.5680 9.6058 9.6799 9.6950 9.7651 9.9287 10.0613 10.1443 10.1837 10.3012 10.3485 10.4115 10.6917 11.0376 11.1333 11.6657 11.8020 12.4137 12.4319 13.3121 13.3321 14.1264 14.1758 19.4144 19.4583 19.7102 19.7674 20.0258 20.2339 20.2473 20.2754 k = 0.3814 0.3814 0.3814 ( 6944 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.5225 5.5305 5.9296 5.9479 6.2704 6.2843 6.2966 6.3428 6.6764 6.7727 6.7811 6.9834 7.0233 7.0529 7.1873 7.1907 7.3071 7.3145 7.3272 7.6610 7.6679 7.8033 7.9450 8.1731 8.2620 8.4168 8.4854 8.6626 8.6836 8.8453 8.8902 9.1318 9.3808 9.5677 9.6158 9.6935 9.7169 9.7697 9.9553 10.0541 10.1232 10.1552 10.2900 10.3479 10.4120 10.7057 11.0100 11.0573 11.6754 11.8224 12.3745 12.3797 13.2377 13.2560 13.9655 14.0148 19.5239 19.5555 19.8036 19.8656 20.0962 20.2955 20.3169 20.3265 k = 0.3898 0.3898 0.3898 ( 6938 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.5861 5.5942 5.9310 5.9492 6.2549 6.2769 6.2880 6.3228 6.7175 6.7940 6.8152 6.9901 7.0402 7.0531 7.1849 7.2037 7.3018 7.3067 7.3347 7.6439 7.6663 7.8022 7.9388 8.1435 8.2709 8.4005 8.4774 8.6640 8.6760 8.8133 8.8600 9.0923 9.4014 9.5677 9.6263 9.6921 9.7557 9.7750 9.9858 10.0447 10.1010 10.1287 10.2817 10.3496 10.4124 10.7219 10.9833 10.9837 11.6931 11.8468 12.3312 12.3388 13.1645 13.1804 13.8075 13.8568 19.6310 19.6511 19.8900 19.9589 20.1595 20.3484 20.3751 20.3822 k = 0.3983 0.3983 0.3983 ( 6947 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.6463 5.6545 5.9341 5.9523 6.2394 6.2682 6.2784 6.3027 6.7591 6.8157 6.8495 6.9978 7.0539 7.0546 7.1821 7.2200 7.2948 7.3006 7.3451 7.6298 7.6654 7.8006 7.9316 8.1114 8.2790 8.3866 8.4703 8.6626 8.6644 8.7807 8.8282 9.0494 9.4238 9.5692 9.6368 9.6912 9.7803 9.7938 10.0195 10.0345 10.0777 10.1048 10.2763 10.3533 10.4132 10.7394 10.9127 10.9602 11.7170 11.8741 12.2866 12.3068 13.0925 13.1055 13.6529 13.7023 19.7358 19.7452 19.9709 20.0479 20.2163 20.3955 20.4225 20.4428 k = 0.4068 0.4068 0.4068 ( 6941 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7031 5.7112 5.9389 5.9570 6.2243 6.2581 6.2677 6.2829 6.8005 6.8378 6.8830 7.0066 7.0553 7.0665 7.1788 7.2385 7.2857 7.2966 7.3595 7.6195 7.6653 7.7987 7.9232 8.0776 8.2867 8.3754 8.4640 8.6488 8.6582 8.7484 8.7949 9.0032 9.4478 9.5725 9.6470 9.6910 9.7852 9.8273 10.0250 10.0534 10.0560 10.0861 10.2736 10.3587 10.4143 10.7580 10.8463 10.9403 11.7460 11.9036 12.2465 12.2787 13.0218 13.0313 13.5020 13.5517 19.8377 19.8383 20.0476 20.1334 20.2676 20.4389 20.4691 20.4990 k = 0.4153 0.4153 0.4153 ( 6935 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7562 5.7641 5.9455 5.9634 6.2098 6.2466 6.2558 6.2637 6.8405 6.8601 6.9147 7.0164 7.0574 7.0762 7.1751 7.2577 7.2745 7.2951 7.3794 7.6134 7.6663 7.7961 7.9132 8.0429 8.2943 8.3673 8.4584 8.6294 8.6508 8.7169 8.7606 8.9543 9.4731 9.5779 9.6571 9.6917 9.7892 9.8506 10.0136 10.0282 10.0801 10.0947 10.2737 10.3655 10.4159 10.7771 10.7846 10.9242 11.7791 11.9352 12.2110 12.2546 12.9525 12.9580 13.3554 13.4057 19.9283 19.9385 20.1205 20.2157 20.3146 20.4798 20.5144 20.5510 k = 0.4237 0.4237 0.4237 ( 6923 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8057 5.8131 5.9536 5.9712 6.1960 6.2339 6.2427 6.2450 6.8783 6.8825 6.9438 7.0269 7.0601 7.0839 7.1709 7.2611 7.2760 7.2965 7.4054 7.6115 7.6683 7.7929 7.9015 8.0081 8.3022 8.3625 8.4535 8.6066 8.6402 8.6868 8.7255 8.9033 9.4994 9.5857 9.6669 9.6933 9.7920 9.8600 9.9957 10.0021 10.0952 10.1347 10.2765 10.3731 10.4178 10.7277 10.7964 10.9119 11.8157 11.9685 12.1806 12.2350 12.8847 12.8856 13.2138 13.2647 20.0170 20.0365 20.1902 20.2952 20.3588 20.5188 20.5579 20.5992 k = 0.4322 0.4322 0.4322 ( 6917 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8513 5.8580 5.9633 5.9805 6.1828 6.2200 6.2271 6.2287 6.9049 6.9128 6.9697 7.0377 7.0633 7.0898 7.1664 7.2459 7.2932 7.3013 7.4374 7.6138 7.6716 7.7890 7.8879 7.9738 8.3109 8.3613 8.4496 8.5812 8.6267 8.6584 8.6899 8.8507 9.5264 9.5959 9.6768 9.6959 9.7934 9.8573 9.9724 9.9753 10.1276 10.1753 10.2817 10.3811 10.4199 10.6758 10.8154 10.9031 11.8555 12.0037 12.1558 12.2201 12.8143 12.8184 13.0778 13.1296 20.1035 20.1322 20.2564 20.3722 20.4013 20.5564 20.5991 20.6438 k = 0.4407 0.4407 0.4407 ( 6923 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8932 5.8988 5.9745 5.9912 6.1702 6.2050 6.2099 6.2137 6.9271 6.9434 6.9920 7.0481 7.0670 7.0941 7.1614 7.2292 7.3093 7.3096 7.4739 7.6199 7.6762 7.7843 7.8726 7.9403 8.3209 8.3635 8.4468 8.5546 8.6106 8.6316 8.6544 8.7974 9.5540 9.6084 9.6866 9.6994 9.7932 9.8474 9.9466 9.9477 10.1692 10.2154 10.2894 10.3890 10.4220 10.6285 10.8340 10.8976 11.8981 12.0406 12.1373 12.2105 12.7443 12.7537 12.9482 13.0009 20.1874 20.2256 20.3187 20.4434 20.4467 20.5927 20.6377 20.6851 k = 0.4492 0.4492 0.4492 ( 6911 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 5.9313 5.9356 5.9870 6.0031 6.1581 6.1891 6.1932 6.1979 6.9492 6.9700 7.0109 7.0575 7.0711 7.0966 7.1561 7.2114 7.3213 7.3249 7.5133 7.6295 7.6820 7.7789 7.8556 7.9081 8.3327 8.3692 8.4454 8.5284 8.5922 8.6063 8.6196 8.7442 9.5820 9.6233 9.6964 9.7040 9.7914 9.8339 9.9197 9.9197 10.2138 10.2541 10.2994 10.3965 10.4238 10.5857 10.8515 10.8949 11.9433 12.0793 12.1257 12.2066 12.6758 12.6907 12.8258 12.8795 20.2680 20.3163 20.3759 20.4864 20.5189 20.6276 20.6730 20.7234 k = 0.4576 0.4576 0.4576 ( 6917 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 5.9658 5.9685 6.0007 6.0160 6.1464 6.1724 6.1771 6.1814 6.9710 6.9928 7.0264 7.0649 7.0754 7.0971 7.1505 7.1930 7.3355 7.3399 7.5540 7.6421 7.6891 7.7727 7.8372 7.8771 8.3468 8.3781 8.4457 8.5043 8.5720 8.5823 8.5859 8.6918 9.6102 9.6403 9.7063 9.7095 9.7881 9.8192 9.8913 9.8922 10.2577 10.2901 10.3116 10.4029 10.4249 10.5470 10.8675 10.8947 11.9906 12.1197 12.1217 12.2093 12.6089 12.6294 12.7116 12.7663 20.3443 20.4043 20.4267 20.5318 20.5886 20.6607 20.7047 20.7587 k = 0.4661 0.4661 0.4661 ( 6911 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 5.9967 5.9977 6.0155 6.0299 6.1348 6.1550 6.1612 6.1644 6.9924 7.0125 7.0392 7.0701 7.0796 7.0956 7.1448 7.1744 7.3505 7.3540 7.5943 7.6572 7.6972 7.7658 7.8177 7.8475 8.3635 8.3899 8.4479 8.4838 8.5504 8.5542 8.5599 8.6413 9.6386 9.6594 9.7160 9.7161 9.7834 9.8043 9.8628 9.8644 10.2981 10.3225 10.3258 10.4079 10.4250 10.5121 10.8815 10.8964 12.0398 12.1261 12.1621 12.2193 12.5442 12.5699 12.6068 12.6619 20.4144 20.4702 20.4890 20.5798 20.6555 20.6914 20.7319 20.7913 k = 0.4746 0.4746 0.4746 ( 6893 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0234 6.0243 6.0313 6.0445 6.1231 6.1372 6.1454 6.1472 7.0133 7.0296 7.0495 7.0729 7.0831 7.0919 7.1391 7.1566 7.3646 7.3665 7.6330 7.6744 7.7061 7.7585 7.7973 7.8190 8.3834 8.4045 8.4520 8.4685 8.5255 8.5280 8.5393 8.5936 9.6670 9.6804 9.7235 9.7259 9.7774 9.7898 9.8345 9.8364 10.3335 10.3420 10.3503 10.4109 10.4235 10.4804 10.8928 10.8995 12.0900 12.1392 12.2063 12.2375 12.4823 12.5122 12.5131 12.5674 20.4756 20.5062 20.5697 20.6297 20.7185 20.7189 20.7537 20.8209 k = 0.4831 0.4831 0.4831 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0460 6.0479 6.0487 6.0594 6.1109 6.1191 6.1295 6.1299 7.0336 7.0446 7.0577 7.0735 7.0843 7.0862 7.1338 7.1410 7.3759 7.3766 7.6693 7.6931 7.7154 7.7507 7.7763 7.7910 8.4067 8.4215 8.4577 8.4595 8.5010 8.5053 8.5209 8.5500 9.6953 9.7031 9.7319 9.7356 9.7704 9.7762 9.8065 9.8084 10.3600 10.3626 10.3729 10.4114 10.4197 10.4517 10.9009 10.9030 12.1394 12.1606 12.2525 12.2648 12.4247 12.4331 12.4564 12.4835 20.5233 20.5347 20.6453 20.6796 20.7406 20.7684 20.7750 20.8213 k = 0.4915 0.4915 0.4915 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0652 6.0658 6.0698 6.0741 6.0977 6.1010 6.1134 6.1135 7.0526 7.0577 7.0642 7.0722 7.0786 7.0803 7.1294 7.1306 7.3831 7.3832 7.7028 7.7131 7.7247 7.7425 7.7550 7.7629 8.4332 8.4405 8.4575 8.4627 8.4816 8.4828 8.5058 8.5135 9.7237 9.7272 9.7414 9.7449 9.7626 9.7636 9.7792 9.7802 10.3799 10.3852 10.3899 10.4086 10.4128 10.4255 10.9056 10.9059 12.1823 12.1864 12.3005 12.3021 12.3732 12.3756 12.4025 12.4110 20.5528 20.5544 20.7136 20.7273 20.7578 20.7741 20.8005 20.8026 k = 0.5000 0.5000 0.5000 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0830 6.0830 6.0830 6.0830 6.0830 6.0830 6.1029 6.1029 7.0690 7.0690 7.0690 7.0690 7.0690 7.0690 7.1274 7.1274 7.3855 7.3855 7.7338 7.7338 7.7338 7.7338 7.7338 7.7338 8.4611 8.4611 8.4611 8.4611 8.4611 8.4611 8.4979 8.4979 9.7520 9.7520 9.7520 9.7520 9.7520 9.7520 9.7547 9.7547 10.4017 10.4017 10.4017 10.4017 10.4017 10.4017 10.9071 10.9071 12.2015 12.2015 12.3506 12.3506 12.3506 12.3506 12.3506 12.3506 20.5621 20.5621 20.7699 20.7699 20.7699 20.7699 20.7699 20.7699 k = 0.5000 0.5000 0.5000 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0830 6.0830 6.0830 6.0830 6.0830 6.0830 6.1029 6.1029 7.0690 7.0690 7.0690 7.0690 7.0690 7.0690 7.1274 7.1274 7.3855 7.3855 7.7338 7.7338 7.7338 7.7338 7.7338 7.7338 8.4611 8.4611 8.4611 8.4611 8.4611 8.4611 8.4979 8.4979 9.7520 9.7520 9.7520 9.7520 9.7520 9.7520 9.7547 9.7547 10.4017 10.4017 10.4017 10.4017 10.4017 10.4017 10.9071 10.9071 12.2015 12.2015 12.3506 12.3506 12.3506 12.3506 12.3506 12.3506 20.5621 20.5621 20.7699 20.7699 20.7699 20.7699 20.7699 20.7699 k = 0.4896 0.5000 0.4896 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0653 6.0653 6.0719 6.0719 6.0995 6.0995 6.1135 6.1135 7.0546 7.0546 7.0680 7.0680 7.0801 7.0801 7.1300 7.1300 7.3831 7.3831 7.7066 7.7066 7.7339 7.7339 7.7600 7.7600 8.4367 8.4367 8.4597 8.4597 8.4826 8.4826 8.5099 8.5099 9.7256 9.7256 9.7421 9.7421 9.7644 9.7644 9.7792 9.7792 10.3812 10.3812 10.3984 10.3984 10.4213 10.4213 10.9058 10.9058 12.1842 12.1842 12.3011 12.3012 12.3744 12.3744 12.4071 12.4072 20.5535 20.5535 20.7190 20.7190 20.7668 20.7668 20.8023 20.8023 k = 0.4792 0.5000 0.4792 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0465 6.0465 6.0541 6.0541 6.1153 6.1153 6.1298 6.1298 7.0381 7.0381 7.0649 7.0649 7.0870 7.0870 7.1373 7.1373 7.3762 7.3762 7.6782 7.6782 7.7342 7.7342 7.7854 7.7854 8.4137 8.4138 8.4588 8.4588 8.5000 8.5000 8.5390 8.5390 9.6995 9.6995 9.7318 9.7318 9.7759 9.7759 9.8065 9.8065 10.3595 10.3595 10.3889 10.3889 10.4406 10.4406 10.9018 10.9018 12.1498 12.1498 12.2585 12.2585 12.4284 12.4284 12.4712 12.4713 20.5285 20.5285 20.6582 20.6582 20.7560 20.7560 20.7995 20.7995 k = 0.4688 0.5000 0.4687 ( 6902 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0261 6.0261 6.0348 6.0348 6.1305 6.1305 6.1466 6.1466 7.0202 7.0202 7.0598 7.0598 7.0900 7.0900 7.1480 7.1480 7.3654 7.3654 7.6488 7.6488 7.7348 7.7348 7.8102 7.8102 8.3933 8.3933 8.4615 8.4615 8.5179 8.5179 8.5754 8.5754 9.6740 9.6740 9.7220 9.7220 9.7875 9.7875 9.8340 9.8340 10.3360 10.3360 10.3737 10.3737 10.4601 10.4601 10.8955 10.8955 12.1140 12.1140 12.2221 12.2221 12.4964 12.4964 12.5430 12.5430 20.4885 20.4885 20.5912 20.5912 20.7338 20.7338 20.7747 20.7747 k = 0.4583 0.5000 0.4583 ( 6922 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0043 6.0043 6.0144 6.0144 6.1454 6.1454 6.1633 6.1633 7.0010 7.0010 7.0528 7.0528 7.0903 7.0903 7.1602 7.1602 7.3520 7.3520 7.6185 7.6185 7.7358 7.7359 7.8346 7.8346 8.3753 8.3753 8.4684 8.4684 8.5373 8.5373 8.6158 8.6158 9.6492 9.6492 9.7130 9.7130 9.7989 9.7989 9.8614 9.8614 10.3104 10.3104 10.3541 10.3541 10.4802 10.4802 10.8875 10.8875 12.0818 12.0818 12.1916 12.1916 12.5729 12.5729 12.6223 12.6223 20.4358 20.4358 20.5198 20.5198 20.7007 20.7007 20.7501 20.7501 k = 0.4479 0.5000 0.4479 ( 6914 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 5.9811 5.9811 5.9927 5.9927 6.1602 6.1602 6.1799 6.1800 6.9808 6.9808 7.0439 7.0439 7.0886 7.0886 7.1723 7.1723 7.3375 7.3375 7.5881 7.5881 7.7375 7.7375 7.8589 7.8589 8.3596 8.3596 8.4795 8.4795 8.5578 8.5578 8.6588 8.6588 9.6251 9.6251 9.7048 9.7048 9.8099 9.8099 9.8887 9.8887 10.2823 10.2823 10.3311 10.3311 10.5014 10.5014 10.8783 10.8783 12.0544 12.0544 12.1662 12.1662 12.6561 12.6561 12.7088 12.7088 20.3729 20.3729 20.4452 20.4452 20.6623 20.6624 20.7250 20.7250 k = 0.4375 0.5000 0.4375 ( 6910 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.9563 5.9563 5.9695 5.9695 6.1748 6.1748 6.1965 6.1965 6.9594 6.9594 7.0331 7.0331 7.0853 7.0853 7.1834 7.1834 7.3234 7.3234 7.5579 7.5579 7.7401 7.7401 7.8830 7.8830 8.3460 8.3460 8.4939 8.4939 8.5789 8.5789 8.7034 8.7034 9.6018 9.6018 9.6975 9.6975 9.8201 9.8201 9.9156 9.9156 10.2520 10.2520 10.3060 10.3060 10.5241 10.5241 10.8688 10.8688 12.0318 12.0318 12.1457 12.1457 12.7454 12.7454 12.8019 12.8019 20.3019 20.3019 20.3678 20.3678 20.6211 20.6211 20.6974 20.6974 k = 0.4271 0.5000 0.4271 ( 6906 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.9301 5.9301 5.9448 5.9448 6.1895 6.1895 6.2132 6.2132 6.9369 6.9369 7.0202 7.0202 7.0805 7.0805 7.1922 7.1922 7.3114 7.3114 7.5288 7.5288 7.7438 7.7438 7.9070 7.9070 8.3344 8.3344 8.5108 8.5108 8.6002 8.6002 8.7487 8.7487 9.5793 9.5793 9.6911 9.6911 9.8292 9.8292 9.9418 9.9419 10.2201 10.2201 10.2797 10.2797 10.5486 10.5486 10.8598 10.8598 12.0137 12.0137 12.1295 12.1295 12.8401 12.8401 12.9011 12.9011 20.2247 20.2247 20.2880 20.2880 20.5772 20.5772 20.6662 20.6662 k = 0.4167 0.5000 0.4167 ( 6922 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.9023 5.9023 5.9185 5.9185 6.2043 6.2043 6.2298 6.2298 6.9132 6.9132 7.0054 7.0054 7.0746 7.0746 7.1980 7.1980 7.3030 7.3030 7.5014 7.5014 7.7488 7.7488 7.9307 7.9307 8.3247 8.3247 8.5293 8.5293 8.6214 8.6214 8.7940 8.7940 9.5578 9.5578 9.6856 9.6856 9.8366 9.8366 9.9670 9.9670 10.1879 10.1879 10.2530 10.2530 10.5753 10.5753 10.8522 10.8522 11.9997 11.9997 12.1173 12.1173 12.9402 12.9402 13.0058 13.0058 20.1424 20.1424 20.2060 20.2060 20.5299 20.5299 20.6307 20.6308 k = 0.4062 0.5000 0.4062 ( 6922 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8731 5.8731 5.8906 5.8906 6.2192 6.2192 6.2466 6.2466 6.8882 6.8882 6.9887 6.9887 7.0676 7.0676 7.2002 7.2002 7.2988 7.2988 7.4765 7.4765 7.7552 7.7552 7.9539 7.9539 8.3170 8.3170 8.5483 8.5483 8.6424 8.6424 8.8386 8.8386 9.5372 9.5372 9.6808 9.6808 9.8417 9.8417 9.9904 9.9904 10.1568 10.1568 10.2267 10.2267 10.6044 10.6044 10.8470 10.8470 11.9894 11.9894 12.1086 12.1086 13.0452 13.0452 13.1153 13.1154 20.0560 20.0560 20.1218 20.1218 20.4784 20.4784 20.5900 20.5900 k = 0.3958 0.5000 0.3958 ( 6944 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8424 5.8424 5.8610 5.8610 6.2341 6.2341 6.2635 6.2635 6.8620 6.8620 6.9705 6.9705 7.0600 7.0600 7.1992 7.1992 7.2983 7.2983 7.4548 7.4548 7.7630 7.7630 7.9761 7.9761 8.3114 8.3114 8.5668 8.5668 8.6632 8.6632 8.8817 8.8817 9.5176 9.5176 9.6765 9.6765 9.8438 9.8438 10.0110 10.0110 10.1286 10.1286 10.2020 10.2020 10.6361 10.6361 10.8450 10.8450 11.9821 11.9821 12.1032 12.1032 13.1548 13.1548 13.2294 13.2294 19.9660 19.9660 20.0355 20.0355 20.4216 20.4216 20.5425 20.5425 k = 0.3854 0.5000 0.3854 ( 6944 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8103 5.8103 5.8297 5.8297 6.2491 6.2491 6.2804 6.2804 6.8348 6.8348 6.9510 6.9510 7.0519 7.0519 7.1962 7.1962 7.2999 7.2999 7.4369 7.4369 7.7722 7.7722 7.9969 7.9969 8.3079 8.3079 8.5840 8.5840 8.6839 8.6839 8.9227 8.9227 9.4991 9.4991 9.6723 9.6723 9.8423 9.8423 10.0270 10.0270 10.1052 10.1052 10.1808 10.1808 10.6703 10.6703 10.8471 10.8471 11.9776 11.9776 12.1008 12.1008 13.2689 13.2689 13.3475 13.3475 19.8726 19.8726 19.9471 19.9471 20.3582 20.3582 20.4863 20.4863 k = 0.3750 0.5000 0.3750 ( 6940 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7768 5.7768 5.7968 5.7968 6.2640 6.2640 6.2974 6.2974 6.8071 6.8071 6.9307 6.9307 7.0437 7.0437 7.1924 7.1924 7.3018 7.3018 7.4233 7.4233 7.7826 7.7826 8.0159 8.0159 8.3068 8.3068 8.5989 8.5989 8.7047 8.7047 8.9611 8.9611 9.4817 9.4817 9.6674 9.6674 9.8372 9.8372 10.0350 10.0350 10.0885 10.0885 10.1661 10.1661 10.7067 10.7067 10.8543 10.8543 11.9754 11.9754 12.1013 12.1013 13.3869 13.3869 13.4693 13.4693 19.7759 19.7759 19.8567 19.8567 20.2865 20.2865 20.4197 20.4198 k = 0.3646 0.5000 0.3646 ( 6940 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7420 5.7420 5.7624 5.7625 6.2786 6.2786 6.3142 6.3142 6.7790 6.7790 6.9100 6.9100 7.0357 7.0357 7.1885 7.1885 7.3027 7.3027 7.4143 7.4143 7.7941 7.7941 8.0325 8.0325 8.3082 8.3082 8.6110 8.6110 8.7258 8.7258 8.9965 8.9965 9.4656 9.4656 9.6612 9.6612 9.8291 9.8291 10.0324 10.0324 10.0792 10.0793 10.1605 10.1605 10.7448 10.7448 10.8677 10.8677 11.9753 11.9753 12.1043 12.1043 13.5087 13.5087 13.5944 13.5944 19.6756 19.6756 19.7643 19.7643 20.2048 20.2048 20.3414 20.3414 k = 0.3542 0.5000 0.3542 ( 6938 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7060 5.7060 5.7267 5.7267 6.2929 6.2929 6.3309 6.3309 6.7511 6.7511 6.8894 6.8894 7.0283 7.0283 7.1851 7.1851 7.3020 7.3020 7.4097 7.4097 7.8064 7.8064 8.0463 8.0463 8.3124 8.3124 8.6201 8.6201 8.7474 8.7474 9.0285 9.0285 9.4508 9.4508 9.6530 9.6530 9.8194 9.8194 10.0212 10.0212 10.0757 10.0757 10.1637 10.1637 10.7835 10.7835 10.8887 10.8887 11.9771 11.9771 12.1097 12.1097 13.6339 13.6339 13.7225 13.7225 19.5715 19.5715 19.6700 19.6700 20.1113 20.1113 20.2511 20.2511 k = 0.3438 0.5000 0.3437 ( 6942 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.6690 5.6690 5.6897 5.6897 6.3065 6.3065 6.3472 6.3472 6.7239 6.7239 6.8694 6.8694 7.0216 7.0216 7.1822 7.1822 7.2998 7.2998 7.4086 7.4086 7.8192 7.8192 8.0570 8.0570 8.3192 8.3192 8.6260 8.6260 8.7695 8.7695 9.0569 9.0569 9.4375 9.4375 9.6422 9.6422 9.8096 9.8096 10.0061 10.0061 10.0761 10.0761 10.1722 10.1722 10.8219 10.8219 10.9183 10.9183 11.9806 11.9806 12.1175 12.1175 13.7621 13.7621 13.8534 13.8534 19.4630 19.4630 19.5736 19.5736 20.0050 20.0050 20.1500 20.1500 k = 0.3333 0.5000 0.3333 ( 6942 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.6310 5.6311 5.6516 5.6516 6.3191 6.3191 6.3629 6.3629 6.6979 6.6979 6.8503 6.8503 7.0159 7.0159 7.1800 7.1800 7.2967 7.2967 7.4102 7.4102 7.8319 7.8319 8.0646 8.0646 8.3281 8.3281 8.6292 8.6292 8.7920 8.7920 9.0814 9.0814 9.4257 9.4257 9.6290 9.6291 9.8006 9.8006 9.9902 9.9902 10.0801 10.0801 10.1828 10.1828 10.8597 10.8597 10.9567 10.9567 11.9858 11.9858 12.1274 12.1274 13.8931 13.8931 13.9866 13.9866 19.3496 19.3496 19.4752 19.4752 19.8863 19.8863 20.0400 20.0400 k = 0.3229 0.5000 0.3229 ( 6946 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.5923 5.5923 5.6125 5.6125 6.3306 6.3306 6.3776 6.3776 6.6736 6.6736 6.8326 6.8326 7.0114 7.0114 7.1785 7.1785 7.2932 7.2932 7.4132 7.4132 7.8442 7.8442 8.0696 8.0696 8.3386 8.3386 8.6300 8.6300 8.8149 8.8149 9.1020 9.1020 9.4155 9.4155 9.6143 9.6143 9.7924 9.7924 9.9753 9.9753 10.0871 10.0871 10.1937 10.1937 10.8978 10.8978 11.0026 11.0026 11.9926 11.9926 12.1395 12.1395 14.0265 14.0265 14.1219 14.1219 19.2306 19.2306 19.3742 19.3742 19.7569 19.7569 19.9235 19.9235 k = 0.3125 0.5000 0.3125 ( 6938 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.5530 5.5530 5.5727 5.5727 6.3404 6.3404 6.3909 6.3909 6.6517 6.6517 6.8167 6.8167 7.0081 7.0081 7.1776 7.1776 7.2898 7.2898 7.4170 7.4170 7.8555 7.8555 8.0725 8.0725 8.3499 8.3499 8.6292 8.6292 8.8381 8.8381 9.1187 9.1187 9.4070 9.4070 9.5989 9.5989 9.7845 9.7845 9.9626 9.9626 10.0962 10.0962 10.2045 10.2045 10.9377 10.9377 11.0541 11.0541 12.0011 12.0011 12.1537 12.1537 14.1619 14.1620 14.2590 14.2590 19.1055 19.1055 19.2701 19.2701 19.6199 19.6199 19.8028 19.8028 k = 0.3021 0.5000 0.3021 ( 6930 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.5132 5.5132 5.5324 5.5324 6.3484 6.3484 6.4023 6.4023 6.6328 6.6328 6.8029 6.8029 7.0061 7.0061 7.1773 7.1773 7.2867 7.2867 7.4209 7.4209 7.8652 7.8652 8.0741 8.0741 8.3609 8.3609 8.6275 8.6275 8.8615 8.8615 9.1318 9.1318 9.4002 9.4002 9.5839 9.5839 9.7766 9.7766 9.9527 9.9527 10.1068 10.1068 10.2150 10.2150 10.9801 10.9801 11.1096 11.1096 12.0113 12.0113 12.1699 12.1699 14.2991 14.2991 14.3975 14.3975 18.9741 18.9741 19.1614 19.1614 19.4793 19.4793 19.6805 19.6805 k = 0.2917 0.5000 0.2917 ( 6952 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2493 -87.2493 -87.2493 5.4731 5.4731 5.4916 5.4916 6.3541 6.3541 6.4111 6.4111 6.6176 6.6176 6.7915 6.7915 7.0055 7.0055 7.1777 7.1777 7.2842 7.2842 7.4246 7.4246 7.8728 7.8728 8.0749 8.0749 8.3710 8.3710 8.6255 8.6255 8.8850 8.8850 9.1416 9.1416 9.3950 9.3950 9.5701 9.5701 9.7682 9.7682 9.9455 9.9455 10.1180 10.1180 10.2257 10.2257 11.0253 11.0253 11.1678 11.1678 12.0234 12.0234 12.1882 12.1882 14.4374 14.4374 14.5369 14.5369 18.8363 18.8363 19.0463 19.0463 19.3395 19.3395 19.5586 19.5586 k = 0.2812 0.5000 0.2812 ( 6952 PWs) bands (ev): -87.2496 -87.2495 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4329 5.4329 5.4507 5.4507 6.3573 6.3573 6.4167 6.4167 6.6070 6.6070 6.7825 6.7825 7.0064 7.0064 7.1786 7.1786 7.2821 7.2821 7.4276 7.4276 7.8779 7.8779 8.0755 8.0755 8.3794 8.3794 8.6240 8.6240 8.9084 8.9084 9.1488 9.1488 9.3911 9.3911 9.5583 9.5583 9.7594 9.7594 9.9411 9.9411 10.1291 10.1291 10.2373 10.2373 11.0733 11.0733 11.2279 11.2279 12.0376 12.0376 12.2087 12.2087 14.5764 14.5764 14.6768 14.6768 18.6927 18.6927 18.9223 18.9223 19.2053 19.2053 19.4390 19.4390 k = 0.2708 0.5000 0.2708 ( 6948 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3928 5.3928 5.4098 5.4098 6.3580 6.3580 6.4187 6.4187 6.6013 6.6013 6.7760 6.7760 7.0088 7.0088 7.1799 7.1799 7.2806 7.2806 7.4300 7.4300 7.8802 7.8802 8.0761 8.0761 8.3862 8.3862 8.6233 8.6233 8.9315 8.9315 9.1542 9.1542 9.3882 9.3882 9.5486 9.5486 9.7503 9.7503 9.9388 9.9388 10.1394 10.1394 10.2503 10.2503 11.1235 11.1235 11.2890 11.2890 12.0542 12.0542 12.2314 12.2314 14.7156 14.7156 14.8166 14.8167 18.5441 18.5441 18.7879 18.7879 19.0804 19.0804 19.3228 19.3228 k = 0.2604 0.5000 0.2604 ( 6926 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3529 5.3529 5.3691 5.3691 6.3562 6.3562 6.4172 6.4172 6.6003 6.6003 6.7718 6.7718 7.0126 7.0126 7.1817 7.1817 7.2796 7.2796 7.4313 7.4313 7.8798 7.8798 8.0767 8.0767 8.3913 8.3913 8.6237 8.6237 8.9537 8.9537 9.1587 9.1587 9.3862 9.3862 9.5413 9.5413 9.7412 9.7412 9.9384 9.9384 10.1487 10.1487 10.2651 10.2651 11.1756 11.1756 11.3504 11.3504 12.0733 12.0733 12.2564 12.2564 14.8541 14.8541 14.9557 14.9557 18.3916 18.3916 18.6440 18.6441 18.9659 18.9659 19.2109 19.2109 k = 0.2500 0.5000 0.2500 ( 6934 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.3134 5.3134 5.3288 5.3288 6.3520 6.3520 6.4128 6.4128 6.6033 6.6033 6.7697 6.7697 7.0178 7.0179 7.1839 7.1839 7.2791 7.2791 7.4316 7.4316 7.8772 7.8772 8.0768 8.0768 8.3953 8.3953 8.6251 8.6251 8.9742 8.9742 9.1634 9.1634 9.3846 9.3846 9.5364 9.5364 9.7326 9.7326 9.9393 9.9393 10.1568 10.1568 10.2817 10.2817 11.2288 11.2288 11.4114 11.4114 12.0955 12.0955 12.2839 12.2839 14.9912 14.9912 15.0931 15.0931 18.2368 18.2368 18.4936 18.4936 18.8609 18.8609 19.1036 19.1036 k = 0.2396 0.5000 0.2396 ( 6918 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.2744 5.2744 5.2890 5.2890 6.3458 6.3458 6.4064 6.4064 6.6092 6.6092 6.7694 6.7694 7.0244 7.0244 7.1863 7.1863 7.2791 7.2791 7.4307 7.4307 7.8727 7.8727 8.0760 8.0760 8.3989 8.3989 8.6274 8.6274 8.9921 8.9921 9.1693 9.1693 9.3834 9.3834 9.5339 9.5339 9.7246 9.7247 9.9414 9.9414 10.1643 10.1643 10.3000 10.3000 11.2825 11.2825 11.4713 11.4713 12.1212 12.1212 12.3141 12.3141 15.1258 15.1258 15.2278 15.2278 18.0810 18.0810 18.3402 18.3402 18.7640 18.7640 19.0015 19.0015 k = 0.2292 0.5000 0.2292 ( 6926 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.2361 5.2361 5.2499 5.2499 6.3381 6.3381 6.3989 6.3989 6.6171 6.6171 6.7705 6.7705 7.0322 7.0322 7.1888 7.1888 7.2794 7.2794 7.4285 7.4285 7.8671 7.8671 8.0739 8.0739 8.4028 8.4028 8.6304 8.6304 9.0066 9.0066 9.1770 9.1770 9.3825 9.3825 9.5334 9.5334 9.7178 9.7178 9.9443 9.9443 10.1714 10.1714 10.3195 10.3195 11.3361 11.3361 11.5294 11.5294 12.1506 12.1507 12.3472 12.3472 15.2563 15.2564 15.3585 15.3585 17.9262 17.9262 18.1870 18.1870 18.6742 18.6742 18.9048 18.9048 k = 0.2188 0.5000 0.2187 ( 6934 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.1987 5.1987 5.2117 5.2117 6.3293 6.3293 6.3907 6.3907 6.6259 6.6259 6.7726 6.7726 7.0410 7.0410 7.1913 7.1913 7.2802 7.2802 7.4250 7.4250 7.8608 7.8608 8.0703 8.0703 8.4074 8.4074 8.6339 8.6339 9.0173 9.0173 9.1868 9.1868 9.3819 9.3819 9.5348 9.5348 9.7124 9.7124 9.9479 9.9479 10.1788 10.1788 10.3399 10.3399 11.3888 11.3888 11.5851 11.5851 12.1844 12.1844 12.3835 12.3835 15.3811 15.3811 15.4834 15.4834 17.7739 17.7739 18.0369 18.0369 18.5913 18.5914 18.8140 18.8140 k = 0.2083 0.5000 0.2083 ( 6930 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.1622 5.1622 5.1745 5.1745 6.3199 6.3199 6.3823 6.3823 6.6352 6.6352 6.7755 6.7755 7.0506 7.0506 7.1938 7.1938 7.2812 7.2812 7.4202 7.4202 7.8544 7.8544 8.0652 8.0652 8.4131 8.4131 8.6377 8.6377 9.0240 9.0240 9.1979 9.1979 9.3821 9.3821 9.5376 9.5376 9.7088 9.7088 9.9522 9.9522 10.1867 10.1867 10.3606 10.3606 11.4400 11.4400 11.6379 11.6379 12.2228 12.2228 12.4232 12.4232 15.4978 15.4978 15.6003 15.6003 17.6265 17.6265 17.8924 17.8924 18.5158 18.5158 18.7300 18.7300 k = 0.1979 0.5000 0.1979 ( 6918 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.1268 5.1268 5.1383 5.1383 6.3103 6.3103 6.3739 6.3739 6.6444 6.6445 6.7790 6.7790 7.0608 7.0608 7.1961 7.1961 7.2826 7.2826 7.4142 7.4142 7.8482 7.8482 8.0589 8.0589 8.4198 8.4198 8.6419 8.6419 9.0276 9.0276 9.2089 9.2089 9.3833 9.3833 9.5413 9.5413 9.7074 9.7074 9.9573 9.9573 10.1957 10.1957 10.3814 10.3815 11.4890 11.4890 11.6873 11.6873 12.2660 12.2660 12.4666 12.4666 15.6031 15.6031 15.7064 15.7064 17.4861 17.4861 17.7562 17.7562 18.4484 18.4484 18.6536 18.6536 k = 0.1875 0.5000 0.1875 ( 6910 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.0926 5.0926 5.1034 5.1034 6.3008 6.3008 6.3657 6.3657 6.6533 6.6533 6.7828 6.7828 7.0713 7.0713 7.1981 7.1981 7.2842 7.2842 7.4070 7.4070 7.8426 7.8426 8.0518 8.0518 8.4273 8.4273 8.6465 8.6465 9.0286 9.0286 9.2183 9.2183 9.3860 9.3860 9.5450 9.5451 9.7086 9.7086 9.9634 9.9634 10.2057 10.2057 10.4021 10.4021 11.5353 11.5353 11.7333 11.7333 12.3139 12.3139 12.5138 12.5138 15.6933 15.6933 15.7982 15.7982 17.3558 17.3558 17.6309 17.6309 18.3909 18.3909 18.5864 18.5864 k = 0.1771 0.5000 0.1771 ( 6908 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.0597 5.0597 5.0699 5.0699 6.2915 6.2915 6.3578 6.3578 6.6616 6.6616 6.7868 6.7868 7.0819 7.0819 7.1998 7.1998 7.2860 7.2860 7.3989 7.3989 7.8378 7.8378 8.0443 8.0443 8.4352 8.4352 8.6517 8.6517 9.0278 9.0278 9.2250 9.2250 9.3904 9.3904 9.5484 9.5484 9.7126 9.7126 9.9708 9.9708 10.2170 10.2170 10.4223 10.4223 11.5784 11.5784 11.7757 11.7757 12.3663 12.3663 12.5648 12.5648 15.7636 15.7636 15.8715 15.8715 17.2389 17.2389 17.5191 17.5191 18.3450 18.3450 18.5300 18.5301 k = 0.1667 0.5000 0.1667 ( 6910 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 5.0283 5.0283 5.0378 5.0378 6.2827 6.2827 6.3503 6.3503 6.6693 6.6693 6.7908 6.7908 7.0922 7.0923 7.2012 7.2012 7.2880 7.2880 7.3900 7.3900 7.8338 7.8338 8.0369 8.0369 8.4431 8.4431 8.6576 8.6576 9.0258 9.0258 9.2284 9.2284 9.3962 9.3962 9.5507 9.5507 9.7194 9.7194 9.9796 9.9796 10.2297 10.2297 10.4419 10.4419 11.6181 11.6181 11.8149 11.8149 12.4228 12.4228 12.6197 12.6197 15.8091 15.8091 15.9216 15.9216 17.1392 17.1392 17.4232 17.4232 18.3131 18.3131 18.4866 18.4866 k = 0.1562 0.5000 0.1562 ( 6906 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.9983 4.9983 5.0072 5.0072 6.2745 6.2745 6.3432 6.3432 6.6761 6.6761 6.7948 6.7948 7.1021 7.1021 7.2022 7.2022 7.2899 7.2899 7.3806 7.3807 7.8306 7.8306 8.0299 8.0299 8.4508 8.4508 8.6644 8.6644 9.0230 9.0230 9.2284 9.2284 9.4030 9.4030 9.5517 9.5517 9.7286 9.7286 9.9902 9.9902 10.2437 10.2437 10.4608 10.4608 11.6542 11.6542 11.8509 11.8509 12.4829 12.4830 12.6783 12.6783 15.8261 15.8261 15.9446 15.9446 17.0595 17.0595 17.3441 17.3441 18.2973 18.2974 18.4585 18.4585 k = 0.1458 0.5000 0.1458 ( 6912 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.9699 4.9699 4.9783 4.9783 6.2669 6.2669 6.3366 6.3366 6.6822 6.6822 6.7986 6.7986 7.1111 7.1111 7.2030 7.2030 7.2917 7.2917 7.3711 7.3711 7.8284 7.8284 8.0237 8.0237 8.4578 8.4578 8.6721 8.6721 9.0198 9.0198 9.2255 9.2255 9.4101 9.4101 9.5515 9.5515 9.7396 9.7397 10.0027 10.0028 10.2590 10.2590 10.4787 10.4787 11.6866 11.6866 11.8841 11.8841 12.5461 12.5461 12.7403 12.7403 15.8134 15.8134 15.9383 15.9383 17.0001 17.0002 17.2809 17.2809 18.2996 18.2996 18.4482 18.4482 k = 0.1354 0.5000 0.1354 ( 6912 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.9432 4.9432 4.9510 4.9510 6.2599 6.2599 6.3305 6.3305 6.6876 6.6876 6.8021 6.8021 7.1191 7.1191 7.2039 7.2039 7.2932 7.2932 7.3617 7.3617 7.8270 7.8270 8.0184 8.0184 8.4640 8.4640 8.6807 8.6807 9.0163 9.0163 9.2203 9.2203 9.4169 9.4169 9.5503 9.5503 9.7517 9.7517 10.0172 10.0172 10.2755 10.2755 10.4956 10.4956 11.7157 11.7157 11.9147 11.9147 12.6118 12.6118 12.8051 12.8051 15.7731 15.7731 15.9046 15.9046 16.9581 16.9581 17.2306 17.2306 18.3206 18.3206 18.4578 18.4578 k = 0.1250 0.5000 0.1250 ( 6924 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.9182 4.9182 4.9255 4.9255 6.2536 6.2536 6.3249 6.3249 6.6922 6.6922 6.8054 6.8054 7.1257 7.1257 7.2049 7.2049 7.2941 7.2941 7.3527 7.3527 7.8264 7.8264 8.0140 8.0140 8.4694 8.4694 8.6901 8.6901 9.0129 9.0129 9.2133 9.2133 9.4229 9.4229 9.5482 9.5482 9.7641 9.7641 10.0333 10.0333 10.2932 10.2932 10.5112 10.5112 11.7415 11.7415 11.9427 11.9427 12.6794 12.6794 12.8721 12.8721 15.7105 15.7105 15.8480 15.8480 16.9275 16.9275 17.1891 17.1891 18.3593 18.3593 18.4885 18.4885 k = 0.1146 0.5000 0.1146 ( 6924 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8951 4.8951 4.9019 4.9019 6.2480 6.2480 6.3198 6.3198 6.6962 6.6962 6.8082 6.8082 7.1308 7.1308 7.2064 7.2064 7.2942 7.2942 7.3447 7.3447 7.8267 7.8267 8.0106 8.0106 8.4739 8.4739 8.7002 8.7002 9.0097 9.0097 9.2050 9.2050 9.4277 9.4277 9.5456 9.5456 9.7761 9.7761 10.0508 10.0508 10.3121 10.3121 10.5255 10.5255 11.7644 11.7644 11.9684 11.9684 12.7483 12.7483 12.9406 12.9406 15.6317 15.6317 15.7749 15.7749 16.9024 16.9024 17.1526 17.1526 18.4136 18.4136 18.5402 18.5402 k = 0.1042 0.5000 0.1042 ( 6924 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8737 4.8737 4.8801 4.8801 6.2430 6.2430 6.3153 6.3153 6.6996 6.6996 6.8106 6.8106 7.1343 7.1343 7.2084 7.2084 7.2932 7.2932 7.3380 7.3380 7.8277 7.8277 8.0079 8.0079 8.4777 8.4777 8.7106 8.7106 9.0069 9.0069 9.1958 9.1958 9.4313 9.4313 9.5427 9.5427 9.7875 9.7875 10.0690 10.0690 10.3320 10.3320 10.5382 10.5382 11.7846 11.7846 11.9917 11.9917 12.8179 12.8179 13.0098 13.0098 15.5428 15.5428 15.6910 15.6910 16.8785 16.8785 17.1186 17.1186 18.4800 18.4800 18.6106 18.6107 k = 0.0938 0.5000 0.0937 ( 6920 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8543 4.8543 4.8602 4.8602 6.2386 6.2386 6.3113 6.3113 6.7025 6.7025 6.8125 6.8125 7.1364 7.1364 7.2107 7.2108 7.2912 7.2912 7.3327 7.3327 7.8293 7.8294 8.0060 8.0060 8.4807 8.4807 8.7211 8.7211 9.0048 9.0048 9.1860 9.1860 9.4337 9.4337 9.5397 9.5397 9.7979 9.7979 10.0873 10.0873 10.3527 10.3527 10.5492 10.5492 11.8024 11.8024 12.0128 12.0128 12.8875 12.8875 13.0788 13.0788 15.4489 15.4489 15.6013 15.6013 16.8538 16.8538 17.0858 17.0858 18.5552 18.5552 18.6963 18.6963 k = 0.0833 0.5000 0.0833 ( 6936 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8368 4.8368 4.8424 4.8424 6.2348 6.2348 6.3077 6.3077 6.7049 6.7049 6.8140 6.8140 7.1374 7.1374 7.2131 7.2131 7.2886 7.2886 7.3286 7.3286 7.8316 7.8316 8.0045 8.0045 8.4832 8.4832 8.7313 8.7313 9.0035 9.0035 9.1758 9.1758 9.4351 9.4351 9.5368 9.5368 9.8073 9.8073 10.1051 10.1051 10.3741 10.3741 10.5583 10.5583 11.8180 11.8180 12.0317 12.0317 12.9564 12.9564 13.1466 13.1466 15.3542 15.3542 15.5095 15.5095 16.8280 16.8280 17.0540 17.0540 18.6355 18.6355 18.7923 18.7923 k = 0.0729 0.5000 0.0729 ( 6928 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8213 4.8213 4.8265 4.8265 6.2316 6.2316 6.3047 6.3047 6.7069 6.7069 6.8151 6.8151 7.1376 7.1376 7.2151 7.2151 7.2862 7.2862 7.3255 7.3255 7.8343 7.8343 8.0034 8.0034 8.4853 8.4853 8.7409 8.7409 9.0031 9.0031 9.1656 9.1656 9.4356 9.4356 9.5340 9.5340 9.8155 9.8155 10.1218 10.1218 10.3959 10.3959 10.5654 10.5654 11.8316 11.8316 12.0484 12.0484 13.0236 13.0236 13.2118 13.2118 15.2621 15.2621 15.4188 15.4188 16.8017 16.8017 17.0236 17.0236 18.7171 18.7171 18.8935 18.8935 k = 0.0625 0.5000 0.0625 ( 6924 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.8077 4.8077 4.8127 4.8127 6.2289 6.2289 6.3021 6.3021 6.7086 6.7086 6.8157 6.8157 7.1374 7.1375 7.2162 7.2162 7.2845 7.2845 7.3227 7.3227 7.8373 7.8373 8.0026 8.0026 8.4870 8.4870 8.7495 8.7495 9.0036 9.0036 9.1555 9.1555 9.4354 9.4354 9.5314 9.5314 9.8227 9.8227 10.1368 10.1368 10.4177 10.4177 10.5702 10.5702 11.8433 11.8433 12.0629 12.0629 13.0881 13.0881 13.2732 13.2732 15.1754 15.1754 15.3319 15.3319 16.7760 16.7760 16.9952 16.9952 18.7960 18.7961 18.9946 18.9946 k = 0.0521 0.5000 0.0521 ( 6920 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7963 4.7963 4.8009 4.8009 6.2267 6.2267 6.3000 6.3000 6.7100 6.7100 6.8161 6.8161 7.1371 7.1371 7.2164 7.2164 7.2842 7.2842 7.3199 7.3199 7.8404 7.8404 8.0018 8.0018 8.4884 8.4884 8.7571 8.7571 9.0050 9.0050 9.1458 9.1458 9.4347 9.4347 9.5291 9.5291 9.8287 9.8287 10.1499 10.1499 10.4391 10.4391 10.5726 10.5726 11.8531 11.8531 12.0753 12.0753 13.1483 13.1483 13.3292 13.3292 15.0968 15.0968 15.2513 15.2513 16.7522 16.7522 16.9697 16.9697 18.8687 18.8687 19.0898 19.0898 k = 0.0417 0.5000 0.0417 ( 6932 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7869 4.7869 4.7913 4.7913 6.2250 6.2250 6.2982 6.2982 6.7112 6.7112 6.8162 6.8162 7.1367 7.1367 7.2157 7.2157 7.2853 7.2853 7.3170 7.3170 7.8433 7.8433 8.0012 8.0012 8.4896 8.4896 8.7634 8.7634 9.0071 9.0071 9.1369 9.1369 9.4339 9.4339 9.5271 9.5271 9.8337 9.8337 10.1608 10.1608 10.4594 10.4594 10.5727 10.5727 11.8611 11.8611 12.0855 12.0855 13.2025 13.2025 13.3781 13.3781 15.0287 15.0287 15.1794 15.1794 16.7311 16.7311 16.9478 16.9478 18.9318 18.9318 19.1736 19.1736 k = 0.0312 0.5000 0.0312 ( 6930 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7795 4.7795 4.7837 4.7837 6.2237 6.2237 6.2969 6.2969 6.7120 6.7120 6.8162 6.8162 7.1365 7.1365 7.2144 7.2144 7.2875 7.2875 7.3140 7.3140 7.8459 7.8459 8.0006 8.0006 8.4905 8.4905 8.7683 8.7683 9.0096 9.0096 9.1291 9.1291 9.4330 9.4330 9.5256 9.5256 9.8375 9.8375 10.1694 10.1694 10.4781 10.4781 10.5706 10.5706 11.8673 11.8673 12.0935 12.0935 13.2487 13.2487 13.4182 13.4182 14.9733 14.9733 15.1190 15.1190 16.7138 16.7138 16.9301 16.9301 18.9827 18.9827 19.2409 19.2409 k = 0.0208 0.5000 0.0208 ( 6934 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7743 4.7743 4.7784 4.7784 6.2227 6.2227 6.2960 6.2960 6.7126 6.7126 6.8161 6.8161 7.1363 7.1363 7.2131 7.2131 7.2903 7.2903 7.3109 7.3109 7.8479 7.8479 8.0001 8.0001 8.4912 8.4912 8.7718 8.7718 9.0120 9.0120 9.1229 9.1229 9.4323 9.4323 9.5244 9.5244 9.8403 9.8403 10.1755 10.1755 10.4941 10.4941 10.5668 10.5668 11.8718 11.8718 12.0992 12.0992 13.2843 13.2843 13.4480 13.4480 14.9325 14.9325 15.0729 15.0729 16.7009 16.7009 16.9170 16.9170 19.0199 19.0199 19.2887 19.2888 k = 0.0104 0.5000 0.0104 ( 6922 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7711 4.7711 4.7751 4.7751 6.2222 6.2222 6.2954 6.2954 6.7130 6.7130 6.8160 6.8160 7.1362 7.1362 7.2121 7.2121 7.2929 7.2929 7.3082 7.3082 7.8492 7.8492 7.9998 7.9998 8.4916 8.4916 8.7738 8.7738 9.0138 9.0138 9.1189 9.1189 9.4318 9.4318 9.5237 9.5237 9.8419 9.8419 10.1792 10.1792 10.5058 10.5058 10.5626 10.5626 11.8745 11.8745 12.1026 12.1026 13.3069 13.3069 13.4662 13.4662 14.9076 14.9076 15.0438 15.0438 16.6930 16.6930 16.9091 16.9091 19.0424 19.0424 19.3167 19.3167 k = 0.0000 0.5000-0.0000 ( 6920 PWs) bands (ev): -87.2496 -87.2496 -87.2496 -87.2496 -87.2493 -87.2493 -87.2493 -87.2493 4.7701 4.7701 4.7740 4.7740 6.2220 6.2220 6.2952 6.2952 6.7131 6.7131 6.8160 6.8160 7.1362 7.1362 7.2118 7.2118 7.2941 7.2941 7.3070 7.3070 7.8496 7.8496 7.9997 7.9997 8.4917 8.4917 8.7745 8.7745 9.0145 9.0145 9.1175 9.1175 9.4316 9.4316 9.5235 9.5235 9.8424 9.8424 10.1805 10.1805 10.5103 10.5103 10.5606 10.5606 11.8754 11.8754 12.1038 12.1038 13.3147 13.3147 13.4724 13.4724 14.8993 14.8993 15.0338 15.0338 16.6903 16.6903 16.9064 16.9064 19.0500 19.0500 19.3257 19.3257 k = 0.5000 0.5000-0.0000 ( 6968 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4350 5.4350 5.4350 5.4350 6.3082 6.3082 6.3082 6.3082 6.7474 6.7474 6.7474 6.7474 6.9304 6.9304 6.9304 6.9304 7.5372 7.5372 7.5372 7.5372 7.9227 7.9227 7.9227 7.9227 8.5282 8.5282 8.5282 8.5282 8.9463 8.9463 8.9463 8.9463 9.3860 9.3860 9.3860 9.3860 9.7246 9.7246 9.7246 9.7246 10.2392 10.2392 10.2392 10.2392 10.5870 10.5870 10.5870 10.5870 14.0982 14.0982 14.0982 14.0982 15.0947 15.0947 15.0947 15.0947 17.3691 17.3691 17.3691 17.3691 17.8734 17.8734 17.8735 17.8735 k = 0.5000 0.5000 0.0147 ( 6968 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4358 5.4358 5.4361 5.4362 6.3076 6.3076 6.3089 6.3089 6.7468 6.7468 6.7485 6.7485 6.9250 6.9250 6.9367 6.9367 7.5290 7.5290 7.5434 7.5434 7.9086 7.9086 7.9368 7.9368 8.5222 8.5222 8.5339 8.5339 8.9422 8.9422 8.9520 8.9520 9.3819 9.3819 9.3909 9.3909 9.7191 9.7191 9.7324 9.7324 10.2362 10.2362 10.2408 10.2408 10.5830 10.5830 10.5896 10.5896 14.0833 14.0833 14.0930 14.0930 15.0843 15.0843 15.0913 15.0913 17.3750 17.3750 17.3879 17.3879 17.8796 17.8796 17.8833 17.8833 k = 0.5000 0.5000 0.0294 ( 6956 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4387 5.4387 5.4393 5.4393 6.3071 6.3071 6.3096 6.3096 6.7466 6.7466 6.7500 6.7500 6.9206 6.9206 6.9439 6.9439 7.5190 7.5190 7.5474 7.5474 7.8945 7.8945 7.9510 7.9510 8.5155 8.5155 8.5392 8.5392 8.9398 8.9398 8.9589 8.9589 9.3786 9.3786 9.3964 9.3964 9.7159 9.7159 9.7429 9.7429 10.2318 10.2318 10.2411 10.2411 10.5779 10.5779 10.5909 10.5909 14.0491 14.0491 14.0680 14.0680 15.0604 15.0604 15.0742 15.0742 17.4054 17.4054 17.4306 17.4306 17.9017 17.9017 17.9087 17.9087 k = 0.5000 0.5000 0.0441 ( 6956 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4436 5.4436 5.4445 5.4445 6.3067 6.3067 6.3104 6.3104 6.7469 6.7469 6.7517 6.7517 6.9173 6.9173 6.9517 6.9517 7.5074 7.5074 7.5493 7.5493 7.8804 7.8804 7.9651 7.9651 8.5082 8.5082 8.5443 8.5443 8.9392 8.9392 8.9668 8.9668 9.3764 9.3764 9.4025 9.4025 9.7146 9.7147 9.7559 9.7559 10.2260 10.2260 10.2401 10.2401 10.5715 10.5715 10.5909 10.5909 13.9973 13.9973 14.0244 14.0244 15.0238 15.0238 15.0438 15.0439 17.4588 17.4588 17.4956 17.4956 17.9390 17.9391 17.9488 17.9488 k = 0.5000 0.5000 0.0588 ( 6948 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4505 5.4505 5.4517 5.4517 6.3062 6.3062 6.3112 6.3112 6.7479 6.7479 6.7537 6.7537 6.9153 6.9153 6.9602 6.9602 7.4945 7.4945 7.5491 7.5491 7.8661 7.8661 7.9790 7.9790 8.5001 8.5001 8.5492 8.5492 8.9405 8.9405 8.9751 8.9751 9.3754 9.3754 9.4092 9.4092 9.7153 9.7153 9.7716 9.7716 10.2190 10.2190 10.2378 10.2378 10.5640 10.5640 10.5897 10.5897 13.9302 13.9302 13.9645 13.9645 14.9755 14.9755 15.0011 15.0011 17.5333 17.5333 17.5806 17.5807 17.9908 17.9909 18.0027 18.0027 k = 0.5000 0.5000 0.0735 ( 6948 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4592 5.4592 5.4607 5.4607 6.3058 6.3058 6.3119 6.3119 6.7495 6.7495 6.7559 6.7559 6.9146 6.9146 6.9692 6.9692 7.4806 7.4806 7.5471 7.5471 7.8517 7.8517 7.9926 7.9926 8.4913 8.4913 8.5539 8.5539 8.9434 8.9434 8.9837 8.9837 9.3758 9.3758 9.4166 9.4166 9.7175 9.7175 9.7898 9.7898 10.2108 10.2108 10.2344 10.2344 10.5555 10.5555 10.5872 10.5872 13.8504 13.8504 13.8906 13.8906 14.9167 14.9167 14.9471 14.9471 17.6260 17.6260 17.6829 17.6829 18.0560 18.0560 18.0691 18.0691 k = 0.5000 0.5000 0.0882 ( 6952 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4699 5.4699 5.4717 5.4717 6.3052 6.3052 6.3126 6.3127 6.7519 6.7519 6.7582 6.7582 6.9153 6.9153 6.9786 6.9786 7.4661 7.4661 7.5434 7.5434 7.8371 7.8371 8.0056 8.0056 8.4819 8.4819 8.5585 8.5585 8.9477 8.9477 8.9918 8.9918 9.3777 9.3777 9.4248 9.4249 9.7212 9.7212 9.8103 9.8103 10.2017 10.2017 10.2299 10.2299 10.5461 10.5461 10.5835 10.5835 13.7607 13.7607 13.8054 13.8054 14.8487 14.8487 14.8831 14.8831 17.7341 17.7341 17.7993 17.7993 18.1333 18.1333 18.1468 18.1468 k = 0.5000 0.5000 0.1029 ( 6944 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4825 5.4825 5.4845 5.4845 6.3046 6.3046 6.3132 6.3132 6.7550 6.7550 6.7607 6.7607 6.9175 6.9175 6.9884 6.9884 7.4513 7.4513 7.5383 7.5383 7.8223 7.8223 8.0176 8.0176 8.4720 8.4720 8.5627 8.5627 8.9532 8.9532 8.9992 8.9992 9.3810 9.3810 9.4343 9.4343 9.7264 9.7264 9.8327 9.8327 10.1919 10.1919 10.2245 10.2245 10.5360 10.5360 10.5787 10.5787 13.6634 13.6634 13.7114 13.7114 14.7730 14.7730 14.8104 14.8104 17.8544 17.8544 17.9268 17.9268 18.2218 18.2218 18.2350 18.2351 k = 0.5000 0.5000 0.1176 ( 6960 PWs) bands (ev): -87.2496 -87.2496 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.4967 5.4967 5.4991 5.4991 6.3037 6.3037 6.3136 6.3136 6.7591 6.7591 6.7635 6.7635 6.9212 6.9212 6.9984 6.9984 7.4364 7.4364 7.5321 7.5321 7.8076 7.8076 8.0283 8.0283 8.4620 8.4620 8.5664 8.5664 8.9593 8.9593 9.0054 9.0054 9.3859 9.3859 9.4451 9.4451 9.7328 9.7328 9.8563 9.8563 10.1818 10.1819 10.2183 10.2183 10.5253 10.5253 10.5729 10.5729 13.5608 13.5608 13.6110 13.6110 14.6907 14.6907 14.7304 14.7304 17.9839 17.9839 18.0619 18.0619 18.3207 18.3207 18.3335 18.3335 k = 0.5000 0.5000 0.1324 ( 6960 PWs) bands (ev): -87.2496 -87.2495 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.5127 5.5127 5.5153 5.5153 6.3026 6.3026 6.3137 6.3137 6.7640 6.7640 6.7665 6.7665 6.9264 6.9264 7.0086 7.0086 7.4219 7.4219 7.5251 7.5251 7.7928 7.7928 8.0375 8.0375 8.4521 8.4521 8.5696 8.5696 8.9656 8.9656 9.0099 9.0099 9.3921 9.3921 9.4575 9.4575 9.7405 9.7405 9.8803 9.8803 10.1722 10.1722 10.2116 10.2116 10.5144 10.5144 10.5663 10.5663 13.4548 13.4548 13.5062 13.5062 14.6031 14.6031 14.6444 14.6444 18.1192 18.1192 18.2010 18.2010 18.4296 18.4296 18.4425 18.4425 k = 0.5000 0.5000 0.1471 ( 6952 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2493 -87.2493 -87.2493 -87.2493 5.5303 5.5303 5.5331 5.5331 6.3012 6.3012 6.3134 6.3135 6.7698 6.7698 6.7699 6.7699 6.9331 6.9331 7.0189 7.0189 7.4078 7.4078 7.5177 7.5177 7.7783 7.7783 8.0447 8.0447 8.4425 8.4425 8.5721 8.5721 8.9717 8.9717 9.0123 9.0123 9.3996 9.3996 9.4717 9.4718 9.7495 9.7495 9.9035 9.9035 10.1639 10.1639 10.2043 10.2043 10.5035 10.5035 10.5588 10.5588 13.3471 13.3471 13.3986 13.3986 14.5111 14.5111 14.5533 14.5533 18.2573 18.2573 18.3400 18.3400 18.5484 18.5484 18.5629 18.5629 k = 0.5000 0.5000 0.1618 ( 6968 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.5494 5.5494 5.5524 5.5524 6.2994 6.2994 6.3128 6.3128 6.7736 6.7737 6.7768 6.7768 6.9412 6.9412 7.0292 7.0292 7.3944 7.3944 7.5100 7.5100 7.7642 7.7642 8.0498 8.0498 8.4335 8.4335 8.5736 8.5736 8.9771 8.9771 9.0125 9.0125 9.4081 9.4081 9.4877 9.4877 9.7598 9.7598 9.9244 9.9244 10.1584 10.1584 10.1969 10.1969 10.4932 10.4932 10.5508 10.5508 13.2392 13.2392 13.2898 13.2898 14.4158 14.4158 14.4581 14.4581 18.3953 18.3953 18.4752 18.4752 18.6769 18.6769 18.6958 18.6958 k = 0.5000 0.5000 0.1765 ( 6968 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.5698 5.5698 5.5731 5.5731 6.2971 6.2971 6.3116 6.3116 6.7780 6.7780 6.7848 6.7848 6.9506 6.9506 7.0395 7.0395 7.3819 7.3819 7.5023 7.5023 7.7507 7.7507 8.0524 8.0524 8.4254 8.4254 8.5741 8.5741 8.9813 8.9813 9.0103 9.0103 9.4173 9.4173 9.5053 9.5053 9.7716 9.7716 9.9408 9.9408 10.1572 10.1572 10.1894 10.1894 10.4840 10.4840 10.5424 10.5424 13.1323 13.1323 13.1811 13.1811 14.3177 14.3177 14.3598 14.3598 18.5311 18.5311 18.6050 18.6050 18.8146 18.8147 18.8401 18.8401 k = 0.5000 0.5000 0.1912 ( 6960 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.5915 5.5915 5.5950 5.5950 6.2942 6.2943 6.3098 6.3098 6.7831 6.7831 6.7939 6.7939 6.9613 6.9613 7.0497 7.0497 7.3702 7.3702 7.4950 7.4950 7.7380 7.7380 8.0526 8.0526 8.4181 8.4181 8.5733 8.5733 8.9839 8.9839 9.0055 9.0055 9.4269 9.4269 9.5241 9.5241 9.7848 9.7848 9.9512 9.9512 10.1615 10.1615 10.1820 10.1820 10.4767 10.4767 10.5339 10.5339 13.0274 13.0274 13.0735 13.0735 14.2178 14.2178 14.2589 14.2589 18.6635 18.6635 18.7297 18.7297 18.9601 18.9601 18.9933 18.9933 k = 0.5000 0.5000 0.2059 ( 6964 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.6143 5.6144 5.6179 5.6180 6.2908 6.2909 6.3073 6.3073 6.7891 6.7891 6.8041 6.8041 6.9731 6.9731 7.0598 7.0598 7.3596 7.3596 7.4882 7.4882 7.7263 7.7263 8.0503 8.0503 8.4118 8.4118 8.5713 8.5713 8.9844 8.9844 8.9981 8.9981 9.4365 9.4365 9.5438 9.5438 9.7996 9.7996 9.9549 9.9549 10.1715 10.1715 10.1748 10.1748 10.4724 10.4724 10.5254 10.5254 12.9255 12.9255 12.9680 12.9680 14.1164 14.1164 14.1562 14.1562 18.7925 18.7925 18.8507 18.8507 19.1109 19.1109 19.1516 19.1516 k = 0.5000 0.5000 0.2206 ( 6948 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.6382 5.6382 5.6419 5.6419 6.2868 6.2868 6.3041 6.3042 6.7959 6.7959 6.8154 6.8154 6.9858 6.9858 7.0698 7.0698 7.3498 7.3498 7.4821 7.4821 7.7159 7.7159 8.0457 8.0457 8.4064 8.4064 8.5678 8.5678 8.9825 8.9825 8.9882 8.9882 9.4459 9.4459 9.5636 9.5636 9.8160 9.8160 9.9530 9.9530 10.1680 10.1680 10.1852 10.1852 10.4723 10.4723 10.5173 10.5173 12.8274 12.8274 12.8653 12.8653 14.0142 14.0142 14.0522 14.0522 18.9184 18.9184 18.9692 18.9692 19.2645 19.2645 19.3117 19.3117 k = 0.5000 0.5000 0.2353 ( 6956 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.6628 5.6628 5.6666 5.6666 6.2821 6.2821 6.3002 6.3002 6.8037 6.8037 6.8277 6.8277 6.9992 6.9992 7.0796 7.0796 7.3410 7.3410 7.4770 7.4770 7.7070 7.7070 8.0389 8.0389 8.4017 8.4017 8.5629 8.5629 8.9758 8.9758 8.9777 8.9777 9.4550 9.4550 9.5829 9.5829 9.8338 9.8338 9.9472 9.9472 10.1617 10.1617 10.2000 10.2000 10.4780 10.4780 10.5098 10.5098 12.7340 12.7340 12.7662 12.7662 13.9116 13.9116 13.9473 13.9474 19.0416 19.0416 19.0859 19.0859 19.4181 19.4181 19.4707 19.4708 k = 0.5000 0.5000 0.2500 ( 6936 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2493 -87.2493 5.6882 5.6882 5.6919 5.6919 6.2767 6.2768 6.2955 6.2955 6.8126 6.8126 6.8410 6.8410 7.0133 7.0133 7.0895 7.0895 7.3328 7.3328 7.4731 7.4731 7.6998 7.6998 8.0303 8.0303 8.3975 8.3976 8.5564 8.5564 8.9609 8.9609 8.9697 8.9697 9.4637 9.4637 9.6010 9.6010 9.8529 9.8529 9.9396 9.9396 10.1558 10.1558 10.2134 10.2134 10.4905 10.4905 10.5032 10.5032 12.6457 12.6457 12.6713 12.6713 13.8089 13.8089 13.8420 13.8420 19.1624 19.1624 19.2010 19.2010 19.5692 19.5692 19.6262 19.6262 k = 0.5000 0.5000 0.2647 ( 6940 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7140 5.7140 5.7177 5.7177 6.2707 6.2707 6.2899 6.2899 6.8226 6.8226 6.8552 6.8552 7.0276 7.0276 7.0994 7.0994 7.3253 7.3253 7.4706 7.4706 7.6945 7.6945 8.0201 8.0201 8.3938 8.3938 8.5485 8.5485 8.9435 8.9435 8.9581 8.9581 9.4723 9.4723 9.6170 9.6170 9.8727 9.8727 9.9318 9.9318 10.1507 10.1507 10.2241 10.2241 10.4977 10.4977 10.5104 10.5104 12.5634 12.5634 12.5812 12.5812 13.7065 13.7065 13.7366 13.7366 19.2808 19.2808 19.3147 19.3147 19.7153 19.7153 19.7760 19.7760 k = 0.5000 0.5000 0.2794 ( 6964 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7403 5.7403 5.7438 5.7438 6.2639 6.2639 6.2835 6.2835 6.8338 6.8338 6.8702 6.8703 7.0419 7.0419 7.1094 7.1094 7.3184 7.3184 7.4698 7.4698 7.6912 7.6912 8.0086 8.0086 8.3903 8.3903 8.5391 8.5391 8.9236 8.9236 8.9427 8.9427 9.4811 9.4811 9.6305 9.6305 9.8925 9.8925 9.9245 9.9245 10.1465 10.1465 10.2321 10.2321 10.4935 10.4935 10.5371 10.5371 12.4875 12.4875 12.4965 12.4965 13.6048 13.6048 13.6315 13.6315 19.3970 19.3970 19.4269 19.4269 19.8543 19.8543 19.9181 19.9181 k = 0.5000 0.5000 0.2941 ( 6952 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7667 5.7667 5.7699 5.7699 6.2564 6.2564 6.2763 6.2763 6.8460 6.8460 6.8859 6.8859 7.0560 7.0560 7.1197 7.1197 7.3118 7.3118 7.4709 7.4709 7.6899 7.6899 7.9960 7.9960 8.3869 8.3870 8.5286 8.5286 8.9012 8.9012 8.9233 8.9233 9.4904 9.4904 9.6410 9.6410 9.9110 9.9110 9.9183 9.9183 10.1440 10.1440 10.2385 10.2385 10.4907 10.4907 10.5691 10.5691 12.4177 12.4177 12.4185 12.4185 13.5040 13.5040 13.5268 13.5268 19.5106 19.5106 19.5375 19.5375 19.9844 19.9844 20.0508 20.0508 k = 0.5000 0.5000 0.3088 ( 6952 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.7932 5.7932 5.7961 5.7961 6.2482 6.2482 6.2682 6.2682 6.8594 6.8594 6.9019 6.9019 7.0694 7.0694 7.1301 7.1301 7.3059 7.3059 7.4742 7.4742 7.6905 7.6905 7.9826 7.9826 8.3838 8.3838 8.5169 8.5169 8.8764 8.8764 8.9000 8.9000 9.5006 9.5006 9.6489 9.6489 9.9129 9.9129 9.9270 9.9270 10.1439 10.1439 10.2447 10.2447 10.4891 10.4891 10.6050 10.6050 12.3455 12.3455 12.3571 12.3571 13.4044 13.4044 13.4230 13.4230 19.6215 19.6216 19.6463 19.6463 20.1040 20.1040 20.1726 20.1726 k = 0.5000 0.5000 0.3235 ( 6944 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8195 5.8195 5.8220 5.8220 6.2393 6.2393 6.2593 6.2593 6.8737 6.8737 6.9182 6.9182 7.0817 7.0817 7.1406 7.1406 7.3007 7.3007 7.4800 7.4800 7.6929 7.6929 7.9685 7.9685 8.3808 8.3808 8.5045 8.5045 8.8493 8.8493 8.8729 8.8729 9.5120 9.5120 9.6545 9.6545 9.9076 9.9076 9.9385 9.9385 10.1477 10.1477 10.2520 10.2520 10.4885 10.4885 10.6430 10.6430 12.2804 12.2804 12.3035 12.3036 13.3062 13.3062 13.3203 13.3203 19.7295 19.7295 19.7530 19.7530 20.2119 20.2119 20.2827 20.2827 k = 0.5000 0.5000 0.3382 ( 6936 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8457 5.8457 5.8476 5.8476 6.2298 6.2298 6.2496 6.2496 6.8890 6.8890 6.9345 6.9345 7.0926 7.0926 7.1506 7.1506 7.2968 7.2968 7.4885 7.4885 7.6968 7.6968 7.9538 7.9538 8.3782 8.3782 8.4916 8.4916 8.8200 8.8200 8.8423 8.8423 9.5248 9.5248 9.6587 9.6587 9.9017 9.9017 9.9443 9.9443 10.1563 10.1563 10.2613 10.2613 10.4886 10.4886 10.6818 10.6818 12.2232 12.2232 12.2584 12.2584 13.2098 13.2098 13.2190 13.2190 19.8343 19.8343 19.8576 19.8576 20.3077 20.3077 20.3805 20.3805 k = 0.5000 0.5000 0.3529 ( 6944 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8714 5.8714 5.8727 5.8727 6.2196 6.2196 6.2391 6.2391 6.9051 6.9051 6.9506 6.9506 7.1017 7.1017 7.1595 7.1595 7.2950 7.2950 7.4998 7.4998 7.7018 7.7018 7.9386 7.9386 8.3761 8.3761 8.4788 8.4788 8.7888 8.7888 8.8088 8.8088 9.5391 9.5391 9.6622 9.6622 9.8944 9.8944 9.9436 9.9436 10.1700 10.1700 10.2731 10.2731 10.4887 10.4887 10.7200 10.7200 12.1744 12.1744 12.2219 12.2219 13.1154 13.1154 13.1192 13.1192 19.9354 19.9354 19.9597 19.9597 20.3914 20.3914 20.4661 20.4661 k = 0.5000 0.5000 0.3676 ( 6932 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.8967 5.8967 5.8972 5.8972 6.2087 6.2087 6.2279 6.2279 6.9218 6.9218 6.9664 6.9664 7.1086 7.1086 7.1661 7.1661 7.2963 7.2963 7.5141 7.5141 7.7075 7.7075 7.9228 7.9228 8.3748 8.3748 8.4665 8.4665 8.7560 8.7560 8.7729 8.7729 9.5551 9.5551 9.6659 9.6659 9.8854 9.8854 9.9369 9.9369 10.1883 10.1883 10.2872 10.2872 10.4885 10.4885 10.7565 10.7565 12.1349 12.1349 12.1945 12.1945 13.0214 13.0214 13.0232 13.0232 20.0325 20.0325 20.0592 20.0592 20.4637 20.4637 20.5403 20.5403 k = 0.5000 0.5000 0.3824 ( 6932 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.9211 5.9211 5.9214 5.9214 6.1973 6.1973 6.2158 6.2158 6.9390 6.9390 6.9817 6.9817 7.1133 7.1133 7.1695 7.1695 7.3015 7.3015 7.5314 7.5314 7.7135 7.7135 7.9063 7.9063 8.3747 8.3747 8.4553 8.4553 8.7222 8.7222 8.7353 8.7353 9.5726 9.5726 9.6703 9.6703 9.8745 9.8745 9.9252 9.9252 10.2100 10.2100 10.3031 10.3031 10.4873 10.4873 10.7901 10.7901 12.1054 12.1054 12.1763 12.1763 12.9259 12.9259 12.9336 12.9336 20.1251 20.1251 20.1559 20.1559 20.5256 20.5256 20.6039 20.6039 k = 0.5000 0.5000 0.3971 ( 6924 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.9442 5.9442 5.9454 5.9454 6.1852 6.1852 6.2031 6.2031 6.9565 6.9565 6.9965 6.9965 7.1155 7.1155 7.1692 7.1692 7.3108 7.3108 7.5514 7.5514 7.7191 7.7191 7.8890 7.8890 8.3762 8.3762 8.4459 8.4459 8.6878 8.6878 8.6968 8.6968 9.5915 9.5915 9.6758 9.6758 9.8620 9.8620 9.9096 9.9096 10.2338 10.2338 10.3203 10.3203 10.4846 10.4846 10.8200 10.8200 12.0865 12.0865 12.1675 12.1675 12.8330 12.8330 12.8469 12.8469 20.2125 20.2126 20.2494 20.2494 20.5787 20.5787 20.6581 20.6581 k = 0.5000 0.5000 0.4118 ( 6924 PWs) bands (ev): -87.2495 -87.2495 -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 5.9665 5.9665 5.9687 5.9687 6.1725 6.1725 6.1897 6.1897 6.9740 6.9740 7.0107 7.0107 7.1152 7.1152 7.1657 7.1657 7.3233 7.3233 7.5739 7.5739 7.7241 7.7241 7.8707 7.8707 8.3796 8.3796 8.4388 8.4388 8.6534 8.6534 8.6581 8.6581 9.6118 9.6118 9.6827 9.6827 9.8480 9.8480 9.8912 9.8912 10.2589 10.2589 10.3378 10.3378 10.4799 10.4799 10.8456 10.8456 12.0787 12.0787 12.1680 12.1680 12.7431 12.7431 12.7633 12.7633 20.2940 20.2940 20.3395 20.3395 20.6244 20.6244 20.7042 20.7043 k = 0.5000 0.5000 0.4265 ( 6908 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 5.9880 5.9880 5.9912 5.9912 6.1592 6.1592 6.1755 6.1755 6.9914 6.9914 7.0242 7.0242 7.1126 7.1126 7.1597 7.1597 7.3376 7.3376 7.5984 7.5984 7.7281 7.7281 7.8513 7.8513 8.3853 8.3853 8.4348 8.4348 8.6197 8.6197 8.6199 8.6199 9.6332 9.6332 9.6911 9.6911 9.8329 9.8329 9.8706 9.8706 10.2844 10.2844 10.3548 10.3548 10.4730 10.4730 10.8663 10.8663 12.0821 12.0821 12.1776 12.1776 12.6568 12.6568 12.6832 12.6832 20.3682 20.3682 20.4258 20.4258 20.6643 20.6643 20.7433 20.7433 k = 0.5000 0.5000 0.4412 ( 6908 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0086 6.0086 6.0129 6.0129 6.1453 6.1453 6.1607 6.1607 7.0085 7.0085 7.0370 7.0370 7.1077 7.1077 7.1521 7.1521 7.3522 7.3522 7.6245 7.6245 7.7309 7.7309 7.8306 7.8306 8.3938 8.3938 8.4343 8.4343 8.5831 8.5831 8.5874 8.5874 9.6557 9.6557 9.7009 9.7009 9.8171 9.8171 9.8485 9.8485 10.3098 10.3098 10.3702 10.3702 10.4636 10.4636 10.8823 10.8823 12.0963 12.0963 12.1962 12.1962 12.5749 12.5749 12.6071 12.6071 20.4334 20.4335 20.5078 20.5078 20.6997 20.6997 20.7758 20.7758 k = 0.5000 0.5000 0.4559 ( 6896 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0284 6.0284 6.0337 6.0337 6.1307 6.1307 6.1453 6.1453 7.0250 7.0250 7.0487 7.0487 7.1008 7.1008 7.1439 7.1439 7.3655 7.3655 7.6516 7.6516 7.7326 7.7326 7.8084 7.8084 8.4054 8.4054 8.4377 8.4377 8.5483 8.5483 8.5573 8.5573 9.6790 9.6790 9.7122 9.7122 9.8010 9.8010 9.8252 9.8252 10.3346 10.3346 10.3833 10.3833 10.4517 10.4517 10.8938 10.8938 12.1202 12.1202 12.2233 12.2233 12.4986 12.4986 12.5353 12.5353 20.4876 20.4876 20.5849 20.5849 20.7304 20.7304 20.8009 20.8009 k = 0.5000 0.5000 0.4706 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0474 6.0474 6.0535 6.0535 6.1155 6.1155 6.1293 6.1293 7.0407 7.0407 7.0588 7.0588 7.0919 7.0919 7.1360 7.1360 7.3762 7.3762 7.6792 7.6792 7.7335 7.7335 7.7849 7.7849 8.4203 8.4203 8.4449 8.4449 8.5161 8.5161 8.5303 8.5303 9.7029 9.7029 9.7248 9.7248 9.7848 9.7848 9.8012 9.8012 10.3584 10.3584 10.3933 10.3933 10.4373 10.4373 10.9015 10.9015 12.1516 12.1516 12.2584 12.2584 12.4300 12.4300 12.4682 12.4682 20.5283 20.5283 20.6558 20.6559 20.7538 20.7538 20.8135 20.8135 k = 0.5000 0.5000 0.4853 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0656 6.0656 6.0717 6.0717 6.0996 6.0996 6.1134 6.1134 7.0554 7.0554 7.0662 7.0662 7.0812 7.0812 7.1299 7.1299 7.3831 7.3831 7.7068 7.7068 7.7338 7.7338 7.7600 7.7600 8.4389 8.4389 8.4548 8.4548 8.4869 8.4869 8.5083 8.5083 9.7273 9.7273 9.7386 9.7386 9.7689 9.7689 9.7767 9.7767 10.3808 10.3808 10.3995 10.3995 10.4206 10.4206 10.9057 10.9057 12.1845 12.1845 12.3010 12.3010 12.3749 12.3749 12.4065 12.4065 20.5535 20.5535 20.7187 20.7187 20.7664 20.7664 20.8038 20.8038 k = 0.5000 0.5000 0.5000 ( 6872 PWs) bands (ev): -87.2495 -87.2495 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 -87.2494 6.0830 6.0830 6.0830 6.0830 6.0830 6.0830 6.1029 6.1029 7.0690 7.0690 7.0690 7.0690 7.0690 7.0690 7.1274 7.1274 7.3855 7.3855 7.7338 7.7338 7.7338 7.7338 7.7338 7.7338 8.4611 8.4611 8.4611 8.4611 8.4611 8.4611 8.4979 8.4979 9.7520 9.7520 9.7520 9.7520 9.7520 9.7520 9.7547 9.7547 10.4017 10.4017 10.4017 10.4017 10.4017 10.4017 10.9071 10.9071 12.2015 12.2015 12.3506 12.3506 12.3506 12.3506 12.3506 12.3506 20.5621 20.5621 20.7699 20.7699 20.7699 20.7699 20.7699 20.7699 Writing output data file BeAu.save init_run : 3.99s CPU 13.48s WALL ( 1 calls) electrons : 1376.96s CPU 1387.06s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.63s CPU 1.47s WALL ( 1 calls) Called by electrons: c_bands : 1376.84s CPU 1386.50s WALL ( 1 calls) v_of_rho : 0.42s CPU 0.98s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.40s CPU 0.59s WALL ( 1 calls) newd : 0.79s CPU 0.99s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.23s WALL ( 263 calls) cegterg : 1301.01s CPU 1307.66s WALL ( 565 calls) Called by sum_band: Called by *egterg: h_psi : 505.94s CPU 513.97s WALL ( 10200 calls) s_psi : 73.34s CPU 73.65s WALL ( 10200 calls) g_psi : 1.73s CPU 1.88s WALL ( 9372 calls) cdiaghg : 498.14s CPU 496.38s WALL ( 9635 calls) cegterg:over : 134.63s CPU 132.60s WALL ( 9372 calls) cegterg:upda : 44.25s CPU 46.53s WALL ( 9372 calls) cegterg:last : 38.01s CPU 38.80s WALL ( 2170 calls) Called by h_psi: h_psi:vloc : 360.89s CPU 366.61s WALL ( 10200 calls) h_psi:vnl : 144.16s CPU 145.67s WALL ( 10200 calls) add_vuspsi : 56.76s CPU 59.28s WALL ( 10200 calls) General routines calbec : 87.31s CPU 86.23s WALL ( 10200 calls) fft : 0.43s CPU 1.23s WALL ( 19 calls) ffts : 0.01s CPU 0.04s WALL ( 4 calls) fftw : 333.39s CPU 336.45s WALL ( 1891260 calls) interpolate : 0.03s CPU 0.06s WALL ( 4 calls) davcio : 0.04s CPU 2.62s WALL ( 526 calls) Parallel routines fft_scatter : 230.85s CPU 230.93s WALL ( 1891283 calls) PWSCF : 24m14.27s CPU 26m50.13s WALL This run was terminated on: 15:43:13 29Aug2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=