Program PWSCF v.5.1.1 starts on 15Oct2015 at 2:27:36 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: ./CuAgS.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D 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 18 14 4 922 626 100 Max 19 15 5 937 647 109 Sum 909 703 211 44649 30639 4961 bravais-lattice index = 14 lattice parameter (alat) = 7.3579 a.u. unit-cell volume = 726.4357 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 237.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.357850 celldm(2)= 1.000000 celldm(3)= 2.047230 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.454406 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.454406 0.890795 0.000000 ) a(3) = ( 0.000000 0.000000 2.047230 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.510113 -0.000000 ) b(2) = ( 0.000000 1.122593 -0.000000 ) b(3) = ( 0.000000 0.000000 0.488465 ) PseudoPot. # 1 for S read from file: /home/autes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cu read from file: /home/autes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad 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 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ag read from file: /home/autes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd 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 1237 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 S 6.00 32.06500 S( 1.00) Cu 11.00 63.54600 Cu( 1.00) Ag 11.00 107.86820 Ag( 1.00) No symmetry found (note: 1 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 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class: E 1 -E -1 Cartesian axes number of k points= 402 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024876 k( 2) = ( 0.0063663 0.0103944 -0.0000000), wk = 0.0024876 k( 3) = ( 0.0127327 0.0207888 -0.0000000), wk = 0.0024876 k( 4) = ( 0.0190990 0.0311831 -0.0000000), wk = 0.0024876 k( 5) = ( 0.0254654 0.0415775 -0.0000000), wk = 0.0024876 k( 6) = ( 0.0318318 0.0519719 -0.0000000), wk = 0.0024876 k( 7) = ( 0.0381981 0.0623663 -0.0000000), wk = 0.0024876 k( 8) = ( 0.0445645 0.0727607 -0.0000000), wk = 0.0024876 k( 9) = ( 0.0509308 0.0831550 -0.0000000), wk = 0.0024876 k( 10) = ( 0.0572972 0.0935494 -0.0000000), wk = 0.0024876 k( 11) = ( 0.0636635 0.1039438 -0.0000000), wk = 0.0024876 k( 12) = ( 0.0700299 0.1143382 -0.0000000), wk = 0.0024876 k( 13) = ( 0.0763962 0.1247326 -0.0000000), wk = 0.0024876 k( 14) = ( 0.0827626 0.1351269 -0.0000000), wk = 0.0024876 k( 15) = ( 0.0891289 0.1455213 -0.0000000), wk = 0.0024876 k( 16) = ( 0.0954953 0.1559157 -0.0000000), wk = 0.0024876 k( 17) = ( 0.1018616 0.1663101 -0.0000000), wk = 0.0024876 k( 18) = ( 0.1082280 0.1767045 -0.0000000), wk = 0.0024876 k( 19) = ( 0.1145943 0.1870989 -0.0000000), wk = 0.0024876 k( 20) = ( 0.1209607 0.1974932 -0.0000000), wk = 0.0024876 k( 21) = ( 0.1273270 0.2078876 -0.0000000), wk = 0.0024876 k( 22) = ( 0.1336934 0.2182820 -0.0000000), wk = 0.0024876 k( 23) = ( 0.1400597 0.2286764 -0.0000000), wk = 0.0024876 k( 24) = ( 0.1464261 0.2390707 -0.0000000), wk = 0.0024876 k( 25) = ( 0.1527924 0.2494651 -0.0000000), wk = 0.0024876 k( 26) = ( 0.1591588 0.2598595 -0.0000000), wk = 0.0024876 k( 27) = ( 0.1655251 0.2702539 -0.0000000), wk = 0.0024876 k( 28) = ( 0.1718915 0.2806483 -0.0000000), wk = 0.0024876 k( 29) = ( 0.1782578 0.2910427 -0.0000000), wk = 0.0024876 k( 30) = ( 0.1846242 0.3014370 -0.0000000), wk = 0.0024876 k( 31) = ( 0.1909905 0.3118314 -0.0000000), wk = 0.0024876 k( 32) = ( 0.1973569 0.3222258 -0.0000000), wk = 0.0024876 k( 33) = ( 0.2037232 0.3326202 -0.0000000), wk = 0.0024876 k( 34) = ( 0.2100896 0.3430146 -0.0000000), wk = 0.0024876 k( 35) = ( 0.2164560 0.3534089 -0.0000000), wk = 0.0024876 k( 36) = ( 0.2228223 0.3638033 -0.0000000), wk = 0.0024876 k( 37) = ( 0.2291886 0.3741977 -0.0000000), wk = 0.0024876 k( 38) = ( 0.2355550 0.3845921 -0.0000000), wk = 0.0024876 k( 39) = ( 0.2419214 0.3949865 -0.0000000), wk = 0.0024876 k( 40) = ( 0.2482877 0.4053808 -0.0000000), wk = 0.0024876 k( 41) = ( 0.2546541 0.4157752 -0.0000000), wk = 0.0024876 k( 42) = ( 0.2610204 0.4261696 -0.0000000), wk = 0.0024876 k( 43) = ( 0.2673868 0.4365640 -0.0000000), wk = 0.0024876 k( 44) = ( 0.2737531 0.4469584 -0.0000000), wk = 0.0024876 k( 45) = ( 0.2801195 0.4573527 -0.0000000), wk = 0.0024876 k( 46) = ( 0.2864858 0.4677471 -0.0000000), wk = 0.0024876 k( 47) = ( 0.2928522 0.4781415 -0.0000000), wk = 0.0024876 k( 48) = ( 0.2992185 0.4885359 -0.0000000), wk = 0.0024876 k( 49) = ( 0.3055849 0.4989303 -0.0000000), wk = 0.0024876 k( 50) = ( 0.3119512 0.5093246 -0.0000000), wk = 0.0024876 k( 51) = ( 0.3183176 0.5197190 -0.0000000), wk = 0.0024876 k( 52) = ( 0.3246839 0.5301134 -0.0000000), wk = 0.0024876 k( 53) = ( 0.3310503 0.5405078 -0.0000000), wk = 0.0024876 k( 54) = ( 0.3374166 0.5509022 -0.0000000), wk = 0.0024876 k( 55) = ( 0.3437830 0.5612966 -0.0000000), wk = 0.0024876 k( 56) = ( 0.3437830 0.5612966 -0.0000000), wk = 0.0024876 k( 57) = ( 0.3315050 0.5612965 -0.0000000), wk = 0.0024876 k( 58) = ( 0.3192271 0.5612965 -0.0000000), wk = 0.0024876 k( 59) = ( 0.3069491 0.5612965 -0.0000000), wk = 0.0024876 k( 60) = ( 0.2946711 0.5612965 -0.0000000), wk = 0.0024876 k( 61) = ( 0.2823932 0.5612965 -0.0000000), wk = 0.0024876 k( 62) = ( 0.2701152 0.5612965 -0.0000000), wk = 0.0024876 k( 63) = ( 0.2578372 0.5612965 -0.0000000), wk = 0.0024876 k( 64) = ( 0.2455593 0.5612965 -0.0000000), wk = 0.0024876 k( 65) = ( 0.2332813 0.5612965 -0.0000000), wk = 0.0024876 k( 66) = ( 0.2210033 0.5612965 -0.0000000), wk = 0.0024876 k( 67) = ( 0.2087254 0.5612965 -0.0000000), wk = 0.0024876 k( 68) = ( 0.1964474 0.5612965 -0.0000000), wk = 0.0024876 k( 69) = ( 0.1841695 0.5612965 -0.0000000), wk = 0.0024876 k( 70) = ( 0.1718915 0.5612965 -0.0000000), wk = 0.0024876 k( 71) = ( 0.1596135 0.5612965 -0.0000000), wk = 0.0024876 k( 72) = ( 0.1473356 0.5612965 -0.0000000), wk = 0.0024876 k( 73) = ( 0.1350576 0.5612965 -0.0000000), wk = 0.0024876 k( 74) = ( 0.1227796 0.5612965 -0.0000000), wk = 0.0024876 k( 75) = ( 0.1105017 0.5612965 -0.0000000), wk = 0.0024876 k( 76) = ( 0.0982237 0.5612965 -0.0000000), wk = 0.0024876 k( 77) = ( 0.0859457 0.5612965 -0.0000000), wk = 0.0024876 k( 78) = ( 0.0736678 0.5612965 -0.0000000), wk = 0.0024876 k( 79) = ( 0.0613898 0.5612965 -0.0000000), wk = 0.0024876 k( 80) = ( 0.0491118 0.5612965 -0.0000000), wk = 0.0024876 k( 81) = ( 0.0368339 0.5612965 -0.0000000), wk = 0.0024876 k( 82) = ( 0.0245559 0.5612965 -0.0000000), wk = 0.0024876 k( 83) = ( 0.0122780 0.5612965 -0.0000000), wk = 0.0024876 k( 84) = ( 0.0000000 0.5612965 -0.0000000), wk = 0.0024876 k( 85) = ( 0.0000000 0.5612965 -0.0000000), wk = 0.0024876 k( 86) = ( 0.0000000 0.5612965 0.0122116), wk = 0.0024876 k( 87) = ( 0.0000000 0.5612965 0.0244232), wk = 0.0024876 k( 88) = ( 0.0000000 0.5612965 0.0366349), wk = 0.0024876 k( 89) = ( 0.0000000 0.5612965 0.0488465), wk = 0.0024876 k( 90) = ( 0.0000000 0.5612965 0.0610581), wk = 0.0024876 k( 91) = ( 0.0000000 0.5612965 0.0732697), wk = 0.0024876 k( 92) = ( 0.0000000 0.5612965 0.0854813), wk = 0.0024876 k( 93) = ( 0.0000000 0.5612965 0.0976930), wk = 0.0024876 k( 94) = ( 0.0000000 0.5612965 0.1099046), wk = 0.0024876 k( 95) = ( 0.0000000 0.5612965 0.1221162), wk = 0.0024876 k( 96) = ( 0.0000000 0.5612965 0.1343278), wk = 0.0024876 k( 97) = ( 0.0000000 0.5612965 0.1465395), wk = 0.0024876 k( 98) = ( 0.0000000 0.5612965 0.1587511), wk = 0.0024876 k( 99) = ( 0.0000000 0.5612965 0.1709627), wk = 0.0024876 k( 100) = ( 0.0000000 0.5612965 0.1831743), wk = 0.0024876 k( 101) = ( 0.0000000 0.5612965 0.1953859), wk = 0.0024876 k( 102) = ( 0.0000000 0.5612965 0.2075976), wk = 0.0024876 k( 103) = ( 0.0000000 0.5612965 0.2198092), wk = 0.0024876 k( 104) = ( 0.0000000 0.5612965 0.2320208), wk = 0.0024876 k( 105) = ( 0.0000000 0.5612965 0.2442324), wk = 0.0024876 k( 106) = ( 0.0000000 0.5612965 0.2442324), wk = 0.0024876 k( 107) = ( 0.0122780 0.5612965 0.2442324), wk = 0.0024876 k( 108) = ( 0.0245559 0.5612965 0.2442324), wk = 0.0024876 k( 109) = ( 0.0368339 0.5612965 0.2442324), wk = 0.0024876 k( 110) = ( 0.0491118 0.5612965 0.2442324), wk = 0.0024876 k( 111) = ( 0.0613898 0.5612965 0.2442324), wk = 0.0024876 k( 112) = ( 0.0736678 0.5612965 0.2442324), wk = 0.0024876 k( 113) = ( 0.0859457 0.5612965 0.2442324), wk = 0.0024876 k( 114) = ( 0.0982237 0.5612965 0.2442324), wk = 0.0024876 k( 115) = ( 0.1105017 0.5612965 0.2442324), wk = 0.0024876 k( 116) = ( 0.1227796 0.5612965 0.2442324), wk = 0.0024876 k( 117) = ( 0.1350576 0.5612965 0.2442324), wk = 0.0024876 k( 118) = ( 0.1473356 0.5612965 0.2442324), wk = 0.0024876 k( 119) = ( 0.1596135 0.5612965 0.2442324), wk = 0.0024876 k( 120) = ( 0.1718915 0.5612965 0.2442324), wk = 0.0024876 k( 121) = ( 0.1841695 0.5612965 0.2442324), wk = 0.0024876 k( 122) = ( 0.1964474 0.5612965 0.2442324), wk = 0.0024876 k( 123) = ( 0.2087254 0.5612965 0.2442324), wk = 0.0024876 k( 124) = ( 0.2210033 0.5612965 0.2442324), wk = 0.0024876 k( 125) = ( 0.2332813 0.5612965 0.2442324), wk = 0.0024876 k( 126) = ( 0.2455593 0.5612965 0.2442324), wk = 0.0024876 k( 127) = ( 0.2578372 0.5612965 0.2442324), wk = 0.0024876 k( 128) = ( 0.2701152 0.5612965 0.2442324), wk = 0.0024876 k( 129) = ( 0.2823932 0.5612965 0.2442324), wk = 0.0024876 k( 130) = ( 0.2946711 0.5612965 0.2442324), wk = 0.0024876 k( 131) = ( 0.3069491 0.5612965 0.2442324), wk = 0.0024876 k( 132) = ( 0.3192271 0.5612965 0.2442324), wk = 0.0024876 k( 133) = ( 0.3315050 0.5612965 0.2442324), wk = 0.0024876 k( 134) = ( 0.3437830 0.5612966 0.2442324), wk = 0.0024876 k( 135) = ( 0.3437830 0.5612966 0.2442324), wk = 0.0024876 k( 136) = ( 0.3374166 0.5509022 0.2442324), wk = 0.0024876 k( 137) = ( 0.3310503 0.5405078 0.2442324), wk = 0.0024876 k( 138) = ( 0.3246839 0.5301134 0.2442324), wk = 0.0024876 k( 139) = ( 0.3183176 0.5197190 0.2442324), wk = 0.0024876 k( 140) = ( 0.3119512 0.5093246 0.2442324), wk = 0.0024876 k( 141) = ( 0.3055849 0.4989303 0.2442324), wk = 0.0024876 k( 142) = ( 0.2992185 0.4885359 0.2442324), wk = 0.0024876 k( 143) = ( 0.2928522 0.4781415 0.2442324), wk = 0.0024876 k( 144) = ( 0.2864858 0.4677471 0.2442324), wk = 0.0024876 k( 145) = ( 0.2801195 0.4573527 0.2442324), wk = 0.0024876 k( 146) = ( 0.2737531 0.4469584 0.2442324), wk = 0.0024876 k( 147) = ( 0.2673868 0.4365640 0.2442324), wk = 0.0024876 k( 148) = ( 0.2610204 0.4261696 0.2442324), wk = 0.0024876 k( 149) = ( 0.2546541 0.4157752 0.2442324), wk = 0.0024876 k( 150) = ( 0.2482877 0.4053808 0.2442324), wk = 0.0024876 k( 151) = ( 0.2419214 0.3949865 0.2442324), wk = 0.0024876 k( 152) = ( 0.2355550 0.3845921 0.2442324), wk = 0.0024876 k( 153) = ( 0.2291886 0.3741977 0.2442324), wk = 0.0024876 k( 154) = ( 0.2228223 0.3638033 0.2442324), wk = 0.0024876 k( 155) = ( 0.2164560 0.3534089 0.2442324), wk = 0.0024876 k( 156) = ( 0.2100896 0.3430146 0.2442324), wk = 0.0024876 k( 157) = ( 0.2037232 0.3326202 0.2442324), wk = 0.0024876 k( 158) = ( 0.1973569 0.3222258 0.2442324), wk = 0.0024876 k( 159) = ( 0.1909905 0.3118314 0.2442324), wk = 0.0024876 k( 160) = ( 0.1846242 0.3014370 0.2442324), wk = 0.0024876 k( 161) = ( 0.1782578 0.2910427 0.2442324), wk = 0.0024876 k( 162) = ( 0.1718915 0.2806483 0.2442324), wk = 0.0024876 k( 163) = ( 0.1655251 0.2702539 0.2442324), wk = 0.0024876 k( 164) = ( 0.1591588 0.2598595 0.2442324), wk = 0.0024876 k( 165) = ( 0.1527924 0.2494651 0.2442324), wk = 0.0024876 k( 166) = ( 0.1464261 0.2390707 0.2442324), wk = 0.0024876 k( 167) = ( 0.1400597 0.2286764 0.2442324), wk = 0.0024876 k( 168) = ( 0.1336934 0.2182820 0.2442324), wk = 0.0024876 k( 169) = ( 0.1273270 0.2078876 0.2442324), wk = 0.0024876 k( 170) = ( 0.1209607 0.1974932 0.2442324), wk = 0.0024876 k( 171) = ( 0.1145943 0.1870989 0.2442324), wk = 0.0024876 k( 172) = ( 0.1082280 0.1767045 0.2442324), wk = 0.0024876 k( 173) = ( 0.1018616 0.1663101 0.2442324), wk = 0.0024876 k( 174) = ( 0.0954953 0.1559157 0.2442324), wk = 0.0024876 k( 175) = ( 0.0891289 0.1455213 0.2442324), wk = 0.0024876 k( 176) = ( 0.0827626 0.1351269 0.2442324), wk = 0.0024876 k( 177) = ( 0.0763962 0.1247326 0.2442324), wk = 0.0024876 k( 178) = ( 0.0700299 0.1143382 0.2442324), wk = 0.0024876 k( 179) = ( 0.0636635 0.1039438 0.2442324), wk = 0.0024876 k( 180) = ( 0.0572972 0.0935494 0.2442324), wk = 0.0024876 k( 181) = ( 0.0509308 0.0831550 0.2442324), wk = 0.0024876 k( 182) = ( 0.0445645 0.0727607 0.2442324), wk = 0.0024876 k( 183) = ( 0.0381981 0.0623663 0.2442324), wk = 0.0024876 k( 184) = ( 0.0318318 0.0519719 0.2442324), wk = 0.0024876 k( 185) = ( 0.0254654 0.0415775 0.2442324), wk = 0.0024876 k( 186) = ( 0.0190990 0.0311831 0.2442324), wk = 0.0024876 k( 187) = ( 0.0127327 0.0207888 0.2442324), wk = 0.0024876 k( 188) = ( 0.0063663 0.0103944 0.2442324), wk = 0.0024876 k( 189) = ( 0.0000000 0.0000000 0.2442324), wk = 0.0024876 k( 190) = ( 0.0000000 0.0000000 0.2442324), wk = 0.0024876 k( 191) = ( 0.0000000 0.0000000 0.2320208), wk = 0.0024876 k( 192) = ( 0.0000000 0.0000000 0.2198092), wk = 0.0024876 k( 193) = ( 0.0000000 0.0000000 0.2075976), wk = 0.0024876 k( 194) = ( 0.0000000 0.0000000 0.1953859), wk = 0.0024876 k( 195) = ( 0.0000000 0.0000000 0.1831743), wk = 0.0024876 k( 196) = ( 0.0000000 0.0000000 0.1709627), wk = 0.0024876 k( 197) = ( 0.0000000 0.0000000 0.1587511), wk = 0.0024876 k( 198) = ( 0.0000000 0.0000000 0.1465395), wk = 0.0024876 k( 199) = ( 0.0000000 0.0000000 0.1343278), wk = 0.0024876 k( 200) = ( 0.0000000 0.0000000 0.1221162), wk = 0.0024876 k( 201) = ( 0.0000000 0.0000000 0.1099046), wk = 0.0024876 k( 202) = ( 0.0000000 0.0000000 0.0976930), wk = 0.0024876 k( 203) = ( 0.0000000 0.0000000 0.0854813), wk = 0.0024876 k( 204) = ( 0.0000000 0.0000000 0.0732697), wk = 0.0024876 k( 205) = ( 0.0000000 0.0000000 0.0610581), wk = 0.0024876 k( 206) = ( 0.0000000 0.0000000 0.0488465), wk = 0.0024876 k( 207) = ( 0.0000000 0.0000000 0.0366349), wk = 0.0024876 k( 208) = ( 0.0000000 0.0000000 0.0244232), wk = 0.0024876 k( 209) = ( 0.0000000 0.0000000 0.0122116), wk = 0.0024876 k( 210) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024876 k( 211) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024876 k( 212) = ( -0.0104167 0.0063800 0.0000000), wk = 0.0024876 k( 213) = ( -0.0208333 0.0127600 0.0000000), wk = 0.0024876 k( 214) = ( -0.0312500 0.0191400 0.0000000), wk = 0.0024876 k( 215) = ( -0.0416667 0.0255200 0.0000000), wk = 0.0024876 k( 216) = ( -0.0520833 0.0319000 0.0000000), wk = 0.0024876 k( 217) = ( -0.0625000 0.0382800 0.0000000), wk = 0.0024876 k( 218) = ( -0.0729167 0.0446600 0.0000000), wk = 0.0024876 k( 219) = ( -0.0833333 0.0510400 0.0000000), wk = 0.0024876 k( 220) = ( -0.0937500 0.0574200 0.0000000), wk = 0.0024876 k( 221) = ( -0.1041667 0.0638000 0.0000000), wk = 0.0024876 k( 222) = ( -0.1145833 0.0701800 0.0000000), wk = 0.0024876 k( 223) = ( -0.1250000 0.0765600 0.0000000), wk = 0.0024876 k( 224) = ( -0.1354167 0.0829400 0.0000000), wk = 0.0024876 k( 225) = ( -0.1458333 0.0893200 0.0000000), wk = 0.0024876 k( 226) = ( -0.1562500 0.0957000 0.0000000), wk = 0.0024876 k( 227) = ( -0.1666667 0.1020800 0.0000000), wk = 0.0024876 k( 228) = ( -0.1770833 0.1084600 0.0000000), wk = 0.0024876 k( 229) = ( -0.1875000 0.1148400 0.0000000), wk = 0.0024876 k( 230) = ( -0.1979167 0.1212200 0.0000000), wk = 0.0024876 k( 231) = ( -0.2083333 0.1276000 0.0000000), wk = 0.0024876 k( 232) = ( -0.2187500 0.1339800 0.0000000), wk = 0.0024876 k( 233) = ( -0.2291667 0.1403600 0.0000000), wk = 0.0024876 k( 234) = ( -0.2395833 0.1467400 0.0000000), wk = 0.0024876 k( 235) = ( -0.2500000 0.1531200 0.0000000), wk = 0.0024876 k( 236) = ( -0.2604167 0.1595000 0.0000000), wk = 0.0024876 k( 237) = ( -0.2708333 0.1658800 0.0000000), wk = 0.0024876 k( 238) = ( -0.2812500 0.1722600 0.0000000), wk = 0.0024876 k( 239) = ( -0.2916667 0.1786400 0.0000000), wk = 0.0024876 k( 240) = ( -0.3020833 0.1850200 0.0000000), wk = 0.0024876 k( 241) = ( -0.3125000 0.1914000 0.0000000), wk = 0.0024876 k( 242) = ( -0.3229167 0.1977800 0.0000000), wk = 0.0024876 k( 243) = ( -0.3333333 0.2041600 0.0000000), wk = 0.0024876 k( 244) = ( -0.3437500 0.2105400 0.0000000), wk = 0.0024876 k( 245) = ( -0.3541667 0.2169200 0.0000000), wk = 0.0024876 k( 246) = ( -0.3645833 0.2233000 0.0000000), wk = 0.0024876 k( 247) = ( -0.3750000 0.2296800 0.0000000), wk = 0.0024876 k( 248) = ( -0.3854167 0.2360600 0.0000000), wk = 0.0024876 k( 249) = ( -0.3958333 0.2424400 0.0000000), wk = 0.0024876 k( 250) = ( -0.4062500 0.2488200 0.0000000), wk = 0.0024876 k( 251) = ( -0.4166667 0.2552001 0.0000000), wk = 0.0024876 k( 252) = ( -0.4270833 0.2615801 0.0000000), wk = 0.0024876 k( 253) = ( -0.4375000 0.2679601 0.0000000), wk = 0.0024876 k( 254) = ( -0.4479167 0.2743401 0.0000000), wk = 0.0024876 k( 255) = ( -0.4583333 0.2807201 0.0000000), wk = 0.0024876 k( 256) = ( -0.4687500 0.2871001 0.0000000), wk = 0.0024876 k( 257) = ( -0.4791667 0.2934801 0.0000000), wk = 0.0024876 k( 258) = ( -0.4895833 0.2998601 0.0000000), wk = 0.0024876 k( 259) = ( -0.5000000 0.3062401 0.0000000), wk = 0.0024876 k( 260) = ( -0.5000000 0.3062401 0.0000000), wk = 0.0024876 k( 261) = ( -0.4937513 0.3164423 -0.0000000), wk = 0.0024876 k( 262) = ( -0.4875026 0.3266446 -0.0000000), wk = 0.0024876 k( 263) = ( -0.4812540 0.3368468 -0.0000000), wk = 0.0024876 k( 264) = ( -0.4750053 0.3470491 -0.0000000), wk = 0.0024876 k( 265) = ( -0.4687566 0.3572513 -0.0000000), wk = 0.0024876 k( 266) = ( -0.4625079 0.3674536 -0.0000000), wk = 0.0024876 k( 267) = ( -0.4562592 0.3776559 -0.0000000), wk = 0.0024876 k( 268) = ( -0.4500106 0.3878581 -0.0000000), wk = 0.0024876 k( 269) = ( -0.4437619 0.3980604 -0.0000000), wk = 0.0024876 k( 270) = ( -0.4375132 0.4082627 -0.0000000), wk = 0.0024876 k( 271) = ( -0.4312645 0.4184649 -0.0000000), wk = 0.0024876 k( 272) = ( -0.4250158 0.4286672 -0.0000000), wk = 0.0024876 k( 273) = ( -0.4187671 0.4388694 -0.0000000), wk = 0.0024876 k( 274) = ( -0.4125185 0.4490717 -0.0000000), wk = 0.0024876 k( 275) = ( -0.4062698 0.4592739 -0.0000000), wk = 0.0024876 k( 276) = ( -0.4000211 0.4694762 -0.0000000), wk = 0.0024876 k( 277) = ( -0.3937724 0.4796785 -0.0000000), wk = 0.0024876 k( 278) = ( -0.3875237 0.4898807 -0.0000000), wk = 0.0024876 k( 279) = ( -0.3812751 0.5000830 -0.0000000), wk = 0.0024876 k( 280) = ( -0.3750264 0.5102852 -0.0000000), wk = 0.0024876 k( 281) = ( -0.3687777 0.5204875 -0.0000000), wk = 0.0024876 k( 282) = ( -0.3625290 0.5306898 -0.0000000), wk = 0.0024876 k( 283) = ( -0.3562803 0.5408920 -0.0000000), wk = 0.0024876 k( 284) = ( -0.3500317 0.5510943 -0.0000000), wk = 0.0024876 k( 285) = ( -0.3437830 0.5612965 -0.0000000), wk = 0.0024876 k( 286) = ( -0.3437830 0.5612965 -0.0000000), wk = 0.0024876 k( 287) = ( -0.3437830 0.5612965 0.0122116), wk = 0.0024876 k( 288) = ( -0.3437830 0.5612965 0.0244232), wk = 0.0024876 k( 289) = ( -0.3437830 0.5612965 0.0366349), wk = 0.0024876 k( 290) = ( -0.3437830 0.5612965 0.0488465), wk = 0.0024876 k( 291) = ( -0.3437830 0.5612965 0.0610581), wk = 0.0024876 k( 292) = ( -0.3437830 0.5612965 0.0732697), wk = 0.0024876 k( 293) = ( -0.3437830 0.5612965 0.0854813), wk = 0.0024876 k( 294) = ( -0.3437830 0.5612965 0.0976930), wk = 0.0024876 k( 295) = ( -0.3437830 0.5612965 0.1099046), wk = 0.0024876 k( 296) = ( -0.3437830 0.5612965 0.1221162), wk = 0.0024876 k( 297) = ( -0.3437830 0.5612965 0.1343278), wk = 0.0024876 k( 298) = ( -0.3437830 0.5612965 0.1465395), wk = 0.0024876 k( 299) = ( -0.3437830 0.5612965 0.1587511), wk = 0.0024876 k( 300) = ( -0.3437830 0.5612965 0.1709627), wk = 0.0024876 k( 301) = ( -0.3437830 0.5612965 0.1831743), wk = 0.0024876 k( 302) = ( -0.3437830 0.5612965 0.1953859), wk = 0.0024876 k( 303) = ( -0.3437830 0.5612965 0.2075976), wk = 0.0024876 k( 304) = ( -0.3437830 0.5612965 0.2198092), wk = 0.0024876 k( 305) = ( -0.3437830 0.5612965 0.2320208), wk = 0.0024876 k( 306) = ( -0.3437830 0.5612965 0.2442324), wk = 0.0024876 k( 307) = ( -0.3437830 0.5612965 0.2442324), wk = 0.0024876 k( 308) = ( -0.3500317 0.5510943 0.2442324), wk = 0.0024876 k( 309) = ( -0.3562803 0.5408920 0.2442324), wk = 0.0024876 k( 310) = ( -0.3625290 0.5306898 0.2442324), wk = 0.0024876 k( 311) = ( -0.3687777 0.5204875 0.2442324), wk = 0.0024876 k( 312) = ( -0.3750264 0.5102852 0.2442324), wk = 0.0024876 k( 313) = ( -0.3812751 0.5000830 0.2442324), wk = 0.0024876 k( 314) = ( -0.3875237 0.4898807 0.2442324), wk = 0.0024876 k( 315) = ( -0.3937724 0.4796785 0.2442324), wk = 0.0024876 k( 316) = ( -0.4000211 0.4694762 0.2442324), wk = 0.0024876 k( 317) = ( -0.4062698 0.4592739 0.2442324), wk = 0.0024876 k( 318) = ( -0.4125185 0.4490717 0.2442324), wk = 0.0024876 k( 319) = ( -0.4187671 0.4388694 0.2442324), wk = 0.0024876 k( 320) = ( -0.4250158 0.4286672 0.2442324), wk = 0.0024876 k( 321) = ( -0.4312645 0.4184649 0.2442324), wk = 0.0024876 k( 322) = ( -0.4375132 0.4082627 0.2442324), wk = 0.0024876 k( 323) = ( -0.4437619 0.3980604 0.2442324), wk = 0.0024876 k( 324) = ( -0.4500106 0.3878581 0.2442324), wk = 0.0024876 k( 325) = ( -0.4562592 0.3776559 0.2442324), wk = 0.0024876 k( 326) = ( -0.4625079 0.3674536 0.2442324), wk = 0.0024876 k( 327) = ( -0.4687566 0.3572513 0.2442324), wk = 0.0024876 k( 328) = ( -0.4750053 0.3470491 0.2442324), wk = 0.0024876 k( 329) = ( -0.4812540 0.3368468 0.2442324), wk = 0.0024876 k( 330) = ( -0.4875026 0.3266446 0.2442324), wk = 0.0024876 k( 331) = ( -0.4937513 0.3164423 0.2442324), wk = 0.0024876 k( 332) = ( -0.5000000 0.3062401 0.2442324), wk = 0.0024876 k( 333) = ( -0.5000000 0.3062401 0.2442324), wk = 0.0024876 k( 334) = ( -0.5000000 0.3062401 0.2320208), wk = 0.0024876 k( 335) = ( -0.5000000 0.3062401 0.2198092), wk = 0.0024876 k( 336) = ( -0.5000000 0.3062401 0.2075976), wk = 0.0024876 k( 337) = ( -0.5000000 0.3062401 0.1953859), wk = 0.0024876 k( 338) = ( -0.5000000 0.3062401 0.1831743), wk = 0.0024876 k( 339) = ( -0.5000000 0.3062401 0.1709627), wk = 0.0024876 k( 340) = ( -0.5000000 0.3062401 0.1587511), wk = 0.0024876 k( 341) = ( -0.5000000 0.3062401 0.1465395), wk = 0.0024876 k( 342) = ( -0.5000000 0.3062401 0.1343278), wk = 0.0024876 k( 343) = ( -0.5000000 0.3062401 0.1221162), wk = 0.0024876 k( 344) = ( -0.5000000 0.3062401 0.1099046), wk = 0.0024876 k( 345) = ( -0.5000000 0.3062401 0.0976930), wk = 0.0024876 k( 346) = ( -0.5000000 0.3062401 0.0854813), wk = 0.0024876 k( 347) = ( -0.5000000 0.3062401 0.0732697), wk = 0.0024876 k( 348) = ( -0.5000000 0.3062401 0.0610581), wk = 0.0024876 k( 349) = ( -0.5000000 0.3062401 0.0488465), wk = 0.0024876 k( 350) = ( -0.5000000 0.3062401 0.0366349), wk = 0.0024876 k( 351) = ( -0.5000000 0.3062401 0.0244232), wk = 0.0024876 k( 352) = ( -0.5000000 0.3062401 0.0122116), wk = 0.0024876 k( 353) = ( -0.5000000 0.3062401 0.0000000), wk = 0.0024876 k( 354) = ( 0.0000000 0.0000000 0.2442324), wk = 0.0024876 k( 355) = ( -0.0104167 0.0063800 0.2442324), wk = 0.0024876 k( 356) = ( -0.0208333 0.0127600 0.2442324), wk = 0.0024876 k( 357) = ( -0.0312500 0.0191400 0.2442324), wk = 0.0024876 k( 358) = ( -0.0416667 0.0255200 0.2442324), wk = 0.0024876 k( 359) = ( -0.0520833 0.0319000 0.2442324), wk = 0.0024876 k( 360) = ( -0.0625000 0.0382800 0.2442324), wk = 0.0024876 k( 361) = ( -0.0729167 0.0446600 0.2442324), wk = 0.0024876 k( 362) = ( -0.0833333 0.0510400 0.2442324), wk = 0.0024876 k( 363) = ( -0.0937500 0.0574200 0.2442324), wk = 0.0024876 k( 364) = ( -0.1041667 0.0638000 0.2442324), wk = 0.0024876 k( 365) = ( -0.1145833 0.0701800 0.2442324), wk = 0.0024876 k( 366) = ( -0.1250000 0.0765600 0.2442324), wk = 0.0024876 k( 367) = ( -0.1354167 0.0829400 0.2442324), wk = 0.0024876 k( 368) = ( -0.1458333 0.0893200 0.2442324), wk = 0.0024876 k( 369) = ( -0.1562500 0.0957000 0.2442324), wk = 0.0024876 k( 370) = ( -0.1666667 0.1020800 0.2442324), wk = 0.0024876 k( 371) = ( -0.1770833 0.1084600 0.2442324), wk = 0.0024876 k( 372) = ( -0.1875000 0.1148400 0.2442324), wk = 0.0024876 k( 373) = ( -0.1979167 0.1212200 0.2442324), wk = 0.0024876 k( 374) = ( -0.2083333 0.1276000 0.2442324), wk = 0.0024876 k( 375) = ( -0.2187500 0.1339800 0.2442324), wk = 0.0024876 k( 376) = ( -0.2291667 0.1403600 0.2442324), wk = 0.0024876 k( 377) = ( -0.2395833 0.1467400 0.2442324), wk = 0.0024876 k( 378) = ( -0.2500000 0.1531200 0.2442324), wk = 0.0024876 k( 379) = ( -0.2604167 0.1595000 0.2442324), wk = 0.0024876 k( 380) = ( -0.2708333 0.1658800 0.2442324), wk = 0.0024876 k( 381) = ( -0.2812500 0.1722600 0.2442324), wk = 0.0024876 k( 382) = ( -0.2916667 0.1786400 0.2442324), wk = 0.0024876 k( 383) = ( -0.3020833 0.1850200 0.2442324), wk = 0.0024876 k( 384) = ( -0.3125000 0.1914000 0.2442324), wk = 0.0024876 k( 385) = ( -0.3229167 0.1977800 0.2442324), wk = 0.0024876 k( 386) = ( -0.3333333 0.2041600 0.2442324), wk = 0.0024876 k( 387) = ( -0.3437500 0.2105400 0.2442324), wk = 0.0024876 k( 388) = ( -0.3541667 0.2169200 0.2442324), wk = 0.0024876 k( 389) = ( -0.3645833 0.2233000 0.2442324), wk = 0.0024876 k( 390) = ( -0.3750000 0.2296800 0.2442324), wk = 0.0024876 k( 391) = ( -0.3854167 0.2360600 0.2442324), wk = 0.0024876 k( 392) = ( -0.3958333 0.2424400 0.2442324), wk = 0.0024876 k( 393) = ( -0.4062500 0.2488200 0.2442324), wk = 0.0024876 k( 394) = ( -0.4166667 0.2552001 0.2442324), wk = 0.0024876 k( 395) = ( -0.4270833 0.2615801 0.2442324), wk = 0.0024876 k( 396) = ( -0.4375000 0.2679601 0.2442324), wk = 0.0024876 k( 397) = ( -0.4479167 0.2743401 0.2442324), wk = 0.0024876 k( 398) = ( -0.4583333 0.2807201 0.2442324), wk = 0.0024876 k( 399) = ( -0.4687500 0.2871001 0.2442324), wk = 0.0024876 k( 400) = ( -0.4791667 0.2934801 0.2442324), wk = 0.0024876 k( 401) = ( -0.4895833 0.2998601 0.2442324), wk = 0.0024876 k( 402) = ( -0.5000000 0.3062401 0.2442324), wk = 0.0024876 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024876 k( 2) = ( 0.0063663 0.0063663 0.0000000), wk = 0.0024876 k( 3) = ( 0.0127327 0.0127327 0.0000000), wk = 0.0024876 k( 4) = ( 0.0190990 0.0190990 0.0000000), wk = 0.0024876 k( 5) = ( 0.0254654 0.0254654 0.0000000), wk = 0.0024876 k( 6) = ( 0.0318318 0.0318318 0.0000000), wk = 0.0024876 k( 7) = ( 0.0381981 0.0381981 0.0000000), wk = 0.0024876 k( 8) = ( 0.0445645 0.0445645 0.0000000), wk = 0.0024876 k( 9) = ( 0.0509308 0.0509308 0.0000000), wk = 0.0024876 k( 10) = ( 0.0572972 0.0572972 0.0000000), wk = 0.0024876 k( 11) = ( 0.0636635 0.0636635 0.0000000), wk = 0.0024876 k( 12) = ( 0.0700299 0.0700299 0.0000000), wk = 0.0024876 k( 13) = ( 0.0763962 0.0763962 0.0000000), wk = 0.0024876 k( 14) = ( 0.0827626 0.0827626 0.0000000), wk = 0.0024876 k( 15) = ( 0.0891289 0.0891289 0.0000000), wk = 0.0024876 k( 16) = ( 0.0954953 0.0954953 0.0000000), wk = 0.0024876 k( 17) = ( 0.1018616 0.1018616 0.0000000), wk = 0.0024876 k( 18) = ( 0.1082280 0.1082280 -0.0000000), wk = 0.0024876 k( 19) = ( 0.1145943 0.1145943 -0.0000000), wk = 0.0024876 k( 20) = ( 0.1209607 0.1209607 0.0000000), wk = 0.0024876 k( 21) = ( 0.1273270 0.1273270 0.0000000), wk = 0.0024876 k( 22) = ( 0.1336934 0.1336934 -0.0000000), wk = 0.0024876 k( 23) = ( 0.1400597 0.1400597 0.0000000), wk = 0.0024876 k( 24) = ( 0.1464261 0.1464261 0.0000000), wk = 0.0024876 k( 25) = ( 0.1527924 0.1527924 0.0000000), wk = 0.0024876 k( 26) = ( 0.1591588 0.1591588 0.0000000), wk = 0.0024876 k( 27) = ( 0.1655251 0.1655251 0.0000000), wk = 0.0024876 k( 28) = ( 0.1718915 0.1718915 0.0000000), wk = 0.0024876 k( 29) = ( 0.1782578 0.1782578 0.0000000), wk = 0.0024876 k( 30) = ( 0.1846242 0.1846242 0.0000000), wk = 0.0024876 k( 31) = ( 0.1909905 0.1909905 0.0000000), wk = 0.0024876 k( 32) = ( 0.1973569 0.1973569 -0.0000000), wk = 0.0024876 k( 33) = ( 0.2037232 0.2037232 0.0000000), wk = 0.0024876 k( 34) = ( 0.2100896 0.2100896 0.0000000), wk = 0.0024876 k( 35) = ( 0.2164560 0.2164560 0.0000000), wk = 0.0024876 k( 36) = ( 0.2228223 0.2228223 0.0000000), wk = 0.0024876 k( 37) = ( 0.2291886 0.2291887 0.0000000), wk = 0.0024876 k( 38) = ( 0.2355550 0.2355550 0.0000000), wk = 0.0024876 k( 39) = ( 0.2419214 0.2419213 0.0000000), wk = 0.0024876 k( 40) = ( 0.2482877 0.2482877 0.0000000), wk = 0.0024876 k( 41) = ( 0.2546541 0.2546541 0.0000000), wk = 0.0024876 k( 42) = ( 0.2610204 0.2610204 0.0000000), wk = 0.0024876 k( 43) = ( 0.2673868 0.2673868 -0.0000000), wk = 0.0024876 k( 44) = ( 0.2737531 0.2737531 0.0000000), wk = 0.0024876 k( 45) = ( 0.2801195 0.2801195 0.0000000), wk = 0.0024876 k( 46) = ( 0.2864858 0.2864858 0.0000000), wk = 0.0024876 k( 47) = ( 0.2928522 0.2928522 0.0000000), wk = 0.0024876 k( 48) = ( 0.2992185 0.2992185 0.0000000), wk = 0.0024876 k( 49) = ( 0.3055849 0.3055849 0.0000000), wk = 0.0024876 k( 50) = ( 0.3119512 0.3119512 -0.0000000), wk = 0.0024876 k( 51) = ( 0.3183176 0.3183176 -0.0000000), wk = 0.0024876 k( 52) = ( 0.3246839 0.3246839 0.0000000), wk = 0.0024876 k( 53) = ( 0.3310503 0.3310503 0.0000000), wk = 0.0024876 k( 54) = ( 0.3374166 0.3374166 0.0000000), wk = 0.0024876 k( 55) = ( 0.3437830 0.3437830 0.0000000), wk = 0.0024876 k( 56) = ( 0.3437830 0.3437830 0.0000000), wk = 0.0024876 k( 57) = ( 0.3315050 0.3493621 0.0000000), wk = 0.0024876 k( 58) = ( 0.3192271 0.3549413 0.0000000), wk = 0.0024876 k( 59) = ( 0.3069491 0.3605205 0.0000000), wk = 0.0024876 k( 60) = ( 0.2946711 0.3660997 0.0000000), wk = 0.0024876 k( 61) = ( 0.2823932 0.3716789 0.0000000), wk = 0.0024876 k( 62) = ( 0.2701152 0.3772581 0.0000000), wk = 0.0024876 k( 63) = ( 0.2578372 0.3828372 0.0000000), wk = 0.0024876 k( 64) = ( 0.2455593 0.3884164 0.0000000), wk = 0.0024876 k( 65) = ( 0.2332813 0.3939956 0.0000000), wk = 0.0024876 k( 66) = ( 0.2210033 0.3995748 0.0000000), wk = 0.0024876 k( 67) = ( 0.2087254 0.4051539 0.0000000), wk = 0.0024876 k( 68) = ( 0.1964474 0.4107331 0.0000000), wk = 0.0024876 k( 69) = ( 0.1841695 0.4163123 0.0000000), wk = 0.0024876 k( 70) = ( 0.1718915 0.4218915 0.0000000), wk = 0.0024876 k( 71) = ( 0.1596135 0.4274707 0.0000000), wk = 0.0024876 k( 72) = ( 0.1473356 0.4330499 0.0000000), wk = 0.0024876 k( 73) = ( 0.1350576 0.4386290 0.0000000), wk = 0.0024876 k( 74) = ( 0.1227796 0.4442082 0.0000000), wk = 0.0024876 k( 75) = ( 0.1105017 0.4497874 0.0000000), wk = 0.0024876 k( 76) = ( 0.0982237 0.4553666 0.0000000), wk = 0.0024876 k( 77) = ( 0.0859457 0.4609457 0.0000000), wk = 0.0024876 k( 78) = ( 0.0736678 0.4665249 0.0000000), wk = 0.0024876 k( 79) = ( 0.0613898 0.4721041 0.0000000), wk = 0.0024876 k( 80) = ( 0.0491118 0.4776833 0.0000000), wk = 0.0024876 k( 81) = ( 0.0368339 0.4832625 0.0000000), wk = 0.0024876 k( 82) = ( 0.0245559 0.4888416 0.0000000), wk = 0.0024876 k( 83) = ( 0.0122780 0.4944208 0.0000000), wk = 0.0024876 k( 84) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0024876 k( 85) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0024876 k( 86) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0024876 k( 87) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0024876 k( 88) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0024876 k( 89) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0024876 k( 90) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0024876 k( 91) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0024876 k( 92) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0024876 k( 93) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0024876 k( 94) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0024876 k( 95) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0024876 k( 96) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0024876 k( 97) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0024876 k( 98) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0024876 k( 99) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0024876 k( 100) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0024876 k( 101) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0024876 k( 102) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0024876 k( 103) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0024876 k( 104) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0024876 k( 105) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0024876 k( 106) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0024876 k( 107) = ( 0.0122780 0.4944208 0.5000000), wk = 0.0024876 k( 108) = ( 0.0245559 0.4888416 0.5000000), wk = 0.0024876 k( 109) = ( 0.0368339 0.4832625 0.5000000), wk = 0.0024876 k( 110) = ( 0.0491118 0.4776833 0.5000000), wk = 0.0024876 k( 111) = ( 0.0613898 0.4721041 0.5000000), wk = 0.0024876 k( 112) = ( 0.0736678 0.4665249 0.5000000), wk = 0.0024876 k( 113) = ( 0.0859457 0.4609457 0.5000000), wk = 0.0024876 k( 114) = ( 0.0982237 0.4553666 0.5000000), wk = 0.0024876 k( 115) = ( 0.1105017 0.4497874 0.5000000), wk = 0.0024876 k( 116) = ( 0.1227796 0.4442082 0.5000000), wk = 0.0024876 k( 117) = ( 0.1350576 0.4386290 0.5000000), wk = 0.0024876 k( 118) = ( 0.1473356 0.4330499 0.5000000), wk = 0.0024876 k( 119) = ( 0.1596135 0.4274707 0.5000000), wk = 0.0024876 k( 120) = ( 0.1718915 0.4218915 0.5000000), wk = 0.0024876 k( 121) = ( 0.1841695 0.4163123 0.5000000), wk = 0.0024876 k( 122) = ( 0.1964474 0.4107331 0.5000000), wk = 0.0024876 k( 123) = ( 0.2087254 0.4051539 0.5000000), wk = 0.0024876 k( 124) = ( 0.2210033 0.3995748 0.5000000), wk = 0.0024876 k( 125) = ( 0.2332813 0.3939956 0.5000000), wk = 0.0024876 k( 126) = ( 0.2455593 0.3884164 0.5000000), wk = 0.0024876 k( 127) = ( 0.2578372 0.3828372 0.5000000), wk = 0.0024876 k( 128) = ( 0.2701152 0.3772581 0.5000000), wk = 0.0024876 k( 129) = ( 0.2823932 0.3716789 0.5000000), wk = 0.0024876 k( 130) = ( 0.2946711 0.3660997 0.5000000), wk = 0.0024876 k( 131) = ( 0.3069491 0.3605205 0.5000000), wk = 0.0024876 k( 132) = ( 0.3192271 0.3549413 0.5000000), wk = 0.0024876 k( 133) = ( 0.3315050 0.3493621 0.5000000), wk = 0.0024876 k( 134) = ( 0.3437830 0.3437830 0.5000000), wk = 0.0024876 k( 135) = ( 0.3437830 0.3437830 0.5000000), wk = 0.0024876 k( 136) = ( 0.3374166 0.3374166 0.5000000), wk = 0.0024876 k( 137) = ( 0.3310503 0.3310503 0.5000000), wk = 0.0024876 k( 138) = ( 0.3246839 0.3246839 0.5000000), wk = 0.0024876 k( 139) = ( 0.3183176 0.3183176 0.5000000), wk = 0.0024876 k( 140) = ( 0.3119512 0.3119512 0.5000000), wk = 0.0024876 k( 141) = ( 0.3055849 0.3055849 0.5000000), wk = 0.0024876 k( 142) = ( 0.2992185 0.2992185 0.5000000), wk = 0.0024876 k( 143) = ( 0.2928522 0.2928522 0.5000000), wk = 0.0024876 k( 144) = ( 0.2864858 0.2864858 0.5000000), wk = 0.0024876 k( 145) = ( 0.2801195 0.2801195 0.5000000), wk = 0.0024876 k( 146) = ( 0.2737531 0.2737531 0.5000000), wk = 0.0024876 k( 147) = ( 0.2673868 0.2673868 0.5000000), wk = 0.0024876 k( 148) = ( 0.2610204 0.2610204 0.5000000), wk = 0.0024876 k( 149) = ( 0.2546541 0.2546541 0.5000000), wk = 0.0024876 k( 150) = ( 0.2482877 0.2482877 0.5000000), wk = 0.0024876 k( 151) = ( 0.2419214 0.2419213 0.5000000), wk = 0.0024876 k( 152) = ( 0.2355550 0.2355550 0.5000000), wk = 0.0024876 k( 153) = ( 0.2291886 0.2291887 0.5000000), wk = 0.0024876 k( 154) = ( 0.2228223 0.2228223 0.5000000), wk = 0.0024876 k( 155) = ( 0.2164560 0.2164560 0.5000000), wk = 0.0024876 k( 156) = ( 0.2100896 0.2100896 0.5000000), wk = 0.0024876 k( 157) = ( 0.2037232 0.2037232 0.5000000), wk = 0.0024876 k( 158) = ( 0.1973569 0.1973569 0.5000000), wk = 0.0024876 k( 159) = ( 0.1909905 0.1909905 0.5000000), wk = 0.0024876 k( 160) = ( 0.1846242 0.1846242 0.5000000), wk = 0.0024876 k( 161) = ( 0.1782578 0.1782578 0.5000000), wk = 0.0024876 k( 162) = ( 0.1718915 0.1718915 0.5000000), wk = 0.0024876 k( 163) = ( 0.1655251 0.1655251 0.5000000), wk = 0.0024876 k( 164) = ( 0.1591588 0.1591588 0.5000000), wk = 0.0024876 k( 165) = ( 0.1527924 0.1527924 0.5000000), wk = 0.0024876 k( 166) = ( 0.1464261 0.1464261 0.5000000), wk = 0.0024876 k( 167) = ( 0.1400597 0.1400597 0.5000000), wk = 0.0024876 k( 168) = ( 0.1336934 0.1336934 0.5000000), wk = 0.0024876 k( 169) = ( 0.1273270 0.1273270 0.5000000), wk = 0.0024876 k( 170) = ( 0.1209607 0.1209607 0.5000000), wk = 0.0024876 k( 171) = ( 0.1145943 0.1145943 0.5000000), wk = 0.0024876 k( 172) = ( 0.1082280 0.1082280 0.5000000), wk = 0.0024876 k( 173) = ( 0.1018616 0.1018616 0.5000000), wk = 0.0024876 k( 174) = ( 0.0954953 0.0954953 0.5000000), wk = 0.0024876 k( 175) = ( 0.0891289 0.0891289 0.5000000), wk = 0.0024876 k( 176) = ( 0.0827626 0.0827626 0.5000000), wk = 0.0024876 k( 177) = ( 0.0763962 0.0763962 0.5000000), wk = 0.0024876 k( 178) = ( 0.0700299 0.0700299 0.5000000), wk = 0.0024876 k( 179) = ( 0.0636635 0.0636635 0.5000000), wk = 0.0024876 k( 180) = ( 0.0572972 0.0572972 0.5000000), wk = 0.0024876 k( 181) = ( 0.0509308 0.0509308 0.5000000), wk = 0.0024876 k( 182) = ( 0.0445645 0.0445645 0.5000000), wk = 0.0024876 k( 183) = ( 0.0381981 0.0381981 0.5000000), wk = 0.0024876 k( 184) = ( 0.0318318 0.0318318 0.5000000), wk = 0.0024876 k( 185) = ( 0.0254654 0.0254654 0.5000000), wk = 0.0024876 k( 186) = ( 0.0190990 0.0190990 0.5000000), wk = 0.0024876 k( 187) = ( 0.0127327 0.0127327 0.5000000), wk = 0.0024876 k( 188) = ( 0.0063663 0.0063663 0.5000000), wk = 0.0024876 k( 189) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024876 k( 190) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024876 k( 191) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0024876 k( 192) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0024876 k( 193) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0024876 k( 194) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0024876 k( 195) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0024876 k( 196) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0024876 k( 197) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0024876 k( 198) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0024876 k( 199) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0024876 k( 200) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0024876 k( 201) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0024876 k( 202) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0024876 k( 203) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0024876 k( 204) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0024876 k( 205) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0024876 k( 206) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0024876 k( 207) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0024876 k( 208) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0024876 k( 209) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0024876 k( 210) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024876 k( 211) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024876 k( 212) = ( -0.0104167 0.0104167 0.0000000), wk = 0.0024876 k( 213) = ( -0.0208333 0.0208333 0.0000000), wk = 0.0024876 k( 214) = ( -0.0312500 0.0312500 0.0000000), wk = 0.0024876 k( 215) = ( -0.0416667 0.0416667 0.0000000), wk = 0.0024876 k( 216) = ( -0.0520833 0.0520833 -0.0000000), wk = 0.0024876 k( 217) = ( -0.0625000 0.0625000 0.0000000), wk = 0.0024876 k( 218) = ( -0.0729167 0.0729167 -0.0000000), wk = 0.0024876 k( 219) = ( -0.0833333 0.0833333 -0.0000000), wk = 0.0024876 k( 220) = ( -0.0937500 0.0937500 0.0000000), wk = 0.0024876 k( 221) = ( -0.1041667 0.1041667 0.0000000), wk = 0.0024876 k( 222) = ( -0.1145833 0.1145833 -0.0000000), wk = 0.0024876 k( 223) = ( -0.1250000 0.1250000 0.0000000), wk = 0.0024876 k( 224) = ( -0.1354167 0.1354167 -0.0000000), wk = 0.0024876 k( 225) = ( -0.1458333 0.1458333 0.0000000), wk = 0.0024876 k( 226) = ( -0.1562500 0.1562500 0.0000000), wk = 0.0024876 k( 227) = ( -0.1666667 0.1666667 -0.0000000), wk = 0.0024876 k( 228) = ( -0.1770833 0.1770833 -0.0000000), wk = 0.0024876 k( 229) = ( -0.1875000 0.1875000 0.0000000), wk = 0.0024876 k( 230) = ( -0.1979167 0.1979167 0.0000000), wk = 0.0024876 k( 231) = ( -0.2083333 0.2083333 0.0000000), wk = 0.0024876 k( 232) = ( -0.2187500 0.2187500 -0.0000000), wk = 0.0024876 k( 233) = ( -0.2291667 0.2291667 -0.0000000), wk = 0.0024876 k( 234) = ( -0.2395833 0.2395833 -0.0000000), wk = 0.0024876 k( 235) = ( -0.2500000 0.2500000 0.0000000), wk = 0.0024876 k( 236) = ( -0.2604167 0.2604167 0.0000000), wk = 0.0024876 k( 237) = ( -0.2708333 0.2708333 -0.0000000), wk = 0.0024876 k( 238) = ( -0.2812500 0.2812500 0.0000000), wk = 0.0024876 k( 239) = ( -0.2916667 0.2916667 0.0000000), wk = 0.0024876 k( 240) = ( -0.3020833 0.3020833 0.0000000), wk = 0.0024876 k( 241) = ( -0.3125000 0.3125000 0.0000000), wk = 0.0024876 k( 242) = ( -0.3229167 0.3229167 0.0000000), wk = 0.0024876 k( 243) = ( -0.3333333 0.3333333 0.0000000), wk = 0.0024876 k( 244) = ( -0.3437500 0.3437500 -0.0000000), wk = 0.0024876 k( 245) = ( -0.3541667 0.3541667 0.0000000), wk = 0.0024876 k( 246) = ( -0.3645833 0.3645833 0.0000000), wk = 0.0024876 k( 247) = ( -0.3750000 0.3750000 0.0000000), wk = 0.0024876 k( 248) = ( -0.3854167 0.3854167 -0.0000000), wk = 0.0024876 k( 249) = ( -0.3958333 0.3958333 -0.0000000), wk = 0.0024876 k( 250) = ( -0.4062500 0.4062500 0.0000000), wk = 0.0024876 k( 251) = ( -0.4166667 0.4166667 0.0000000), wk = 0.0024876 k( 252) = ( -0.4270833 0.4270833 -0.0000000), wk = 0.0024876 k( 253) = ( -0.4375000 0.4375000 -0.0000000), wk = 0.0024876 k( 254) = ( -0.4479167 0.4479167 0.0000000), wk = 0.0024876 k( 255) = ( -0.4583333 0.4583333 -0.0000000), wk = 0.0024876 k( 256) = ( -0.4687500 0.4687500 -0.0000000), wk = 0.0024876 k( 257) = ( -0.4791667 0.4791667 -0.0000000), wk = 0.0024876 k( 258) = ( -0.4895833 0.4895833 -0.0000000), wk = 0.0024876 k( 259) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0024876 k( 260) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0024876 k( 261) = ( -0.4937513 0.5062487 0.0000000), wk = 0.0024876 k( 262) = ( -0.4875026 0.5124974 -0.0000000), wk = 0.0024876 k( 263) = ( -0.4812540 0.5187460 0.0000000), wk = 0.0024876 k( 264) = ( -0.4750053 0.5249947 0.0000000), wk = 0.0024876 k( 265) = ( -0.4687566 0.5312434 0.0000000), wk = 0.0024876 k( 266) = ( -0.4625079 0.5374921 0.0000000), wk = 0.0024876 k( 267) = ( -0.4562592 0.5437408 0.0000000), wk = 0.0024876 k( 268) = ( -0.4500106 0.5499894 -0.0000000), wk = 0.0024876 k( 269) = ( -0.4437619 0.5562381 -0.0000000), wk = 0.0024876 k( 270) = ( -0.4375132 0.5624868 0.0000000), wk = 0.0024876 k( 271) = ( -0.4312645 0.5687355 0.0000000), wk = 0.0024876 k( 272) = ( -0.4250158 0.5749842 0.0000000), wk = 0.0024876 k( 273) = ( -0.4187671 0.5812329 0.0000000), wk = 0.0024876 k( 274) = ( -0.4125185 0.5874815 0.0000000), wk = 0.0024876 k( 275) = ( -0.4062698 0.5937302 0.0000000), wk = 0.0024876 k( 276) = ( -0.4000211 0.5999789 -0.0000000), wk = 0.0024876 k( 277) = ( -0.3937724 0.6062276 0.0000000), wk = 0.0024876 k( 278) = ( -0.3875237 0.6124763 -0.0000000), wk = 0.0024876 k( 279) = ( -0.3812751 0.6187249 0.0000000), wk = 0.0024876 k( 280) = ( -0.3750264 0.6249736 0.0000000), wk = 0.0024876 k( 281) = ( -0.3687777 0.6312223 0.0000000), wk = 0.0024876 k( 282) = ( -0.3625290 0.6374710 0.0000000), wk = 0.0024876 k( 283) = ( -0.3562803 0.6437197 0.0000000), wk = 0.0024876 k( 284) = ( -0.3500317 0.6499683 0.0000000), wk = 0.0024876 k( 285) = ( -0.3437830 0.6562170 0.0000000), wk = 0.0024876 k( 286) = ( -0.3437830 0.6562170 0.0000000), wk = 0.0024876 k( 287) = ( -0.3437830 0.6562170 0.0250000), wk = 0.0024876 k( 288) = ( -0.3437830 0.6562170 0.0500000), wk = 0.0024876 k( 289) = ( -0.3437830 0.6562170 0.0750000), wk = 0.0024876 k( 290) = ( -0.3437830 0.6562170 0.1000000), wk = 0.0024876 k( 291) = ( -0.3437830 0.6562170 0.1250000), wk = 0.0024876 k( 292) = ( -0.3437830 0.6562170 0.1500000), wk = 0.0024876 k( 293) = ( -0.3437830 0.6562170 0.1750000), wk = 0.0024876 k( 294) = ( -0.3437830 0.6562170 0.2000000), wk = 0.0024876 k( 295) = ( -0.3437830 0.6562170 0.2250000), wk = 0.0024876 k( 296) = ( -0.3437830 0.6562170 0.2500000), wk = 0.0024876 k( 297) = ( -0.3437830 0.6562170 0.2750000), wk = 0.0024876 k( 298) = ( -0.3437830 0.6562170 0.3000000), wk = 0.0024876 k( 299) = ( -0.3437830 0.6562170 0.3250000), wk = 0.0024876 k( 300) = ( -0.3437830 0.6562170 0.3500000), wk = 0.0024876 k( 301) = ( -0.3437830 0.6562170 0.3750000), wk = 0.0024876 k( 302) = ( -0.3437830 0.6562170 0.4000000), wk = 0.0024876 k( 303) = ( -0.3437830 0.6562170 0.4250000), wk = 0.0024876 k( 304) = ( -0.3437830 0.6562170 0.4500000), wk = 0.0024876 k( 305) = ( -0.3437830 0.6562170 0.4750000), wk = 0.0024876 k( 306) = ( -0.3437830 0.6562170 0.5000000), wk = 0.0024876 k( 307) = ( -0.3437830 0.6562170 0.5000000), wk = 0.0024876 k( 308) = ( -0.3500317 0.6499683 0.5000000), wk = 0.0024876 k( 309) = ( -0.3562803 0.6437197 0.5000000), wk = 0.0024876 k( 310) = ( -0.3625290 0.6374710 0.5000000), wk = 0.0024876 k( 311) = ( -0.3687777 0.6312223 0.5000000), wk = 0.0024876 k( 312) = ( -0.3750264 0.6249736 0.5000000), wk = 0.0024876 k( 313) = ( -0.3812751 0.6187249 0.5000000), wk = 0.0024876 k( 314) = ( -0.3875237 0.6124763 0.5000000), wk = 0.0024876 k( 315) = ( -0.3937724 0.6062276 0.5000000), wk = 0.0024876 k( 316) = ( -0.4000211 0.5999789 0.5000000), wk = 0.0024876 k( 317) = ( -0.4062698 0.5937302 0.5000000), wk = 0.0024876 k( 318) = ( -0.4125185 0.5874815 0.5000000), wk = 0.0024876 k( 319) = ( -0.4187671 0.5812329 0.5000000), wk = 0.0024876 k( 320) = ( -0.4250158 0.5749842 0.5000000), wk = 0.0024876 k( 321) = ( -0.4312645 0.5687355 0.5000000), wk = 0.0024876 k( 322) = ( -0.4375132 0.5624868 0.5000000), wk = 0.0024876 k( 323) = ( -0.4437619 0.5562381 0.5000000), wk = 0.0024876 k( 324) = ( -0.4500106 0.5499894 0.5000000), wk = 0.0024876 k( 325) = ( -0.4562592 0.5437408 0.5000000), wk = 0.0024876 k( 326) = ( -0.4625079 0.5374921 0.5000000), wk = 0.0024876 k( 327) = ( -0.4687566 0.5312434 0.5000000), wk = 0.0024876 k( 328) = ( -0.4750053 0.5249947 0.5000000), wk = 0.0024876 k( 329) = ( -0.4812540 0.5187460 0.5000000), wk = 0.0024876 k( 330) = ( -0.4875026 0.5124974 0.5000000), wk = 0.0024876 k( 331) = ( -0.4937513 0.5062487 0.5000000), wk = 0.0024876 k( 332) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0024876 k( 333) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0024876 k( 334) = ( -0.5000000 0.5000000 0.4750000), wk = 0.0024876 k( 335) = ( -0.5000000 0.5000000 0.4500000), wk = 0.0024876 k( 336) = ( -0.5000000 0.5000000 0.4250000), wk = 0.0024876 k( 337) = ( -0.5000000 0.5000000 0.4000000), wk = 0.0024876 k( 338) = ( -0.5000000 0.5000000 0.3750000), wk = 0.0024876 k( 339) = ( -0.5000000 0.5000000 0.3500000), wk = 0.0024876 k( 340) = ( -0.5000000 0.5000000 0.3250000), wk = 0.0024876 k( 341) = ( -0.5000000 0.5000000 0.3000000), wk = 0.0024876 k( 342) = ( -0.5000000 0.5000000 0.2750000), wk = 0.0024876 k( 343) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0024876 k( 344) = ( -0.5000000 0.5000000 0.2250000), wk = 0.0024876 k( 345) = ( -0.5000000 0.5000000 0.2000000), wk = 0.0024876 k( 346) = ( -0.5000000 0.5000000 0.1750000), wk = 0.0024876 k( 347) = ( -0.5000000 0.5000000 0.1500000), wk = 0.0024876 k( 348) = ( -0.5000000 0.5000000 0.1250000), wk = 0.0024876 k( 349) = ( -0.5000000 0.5000000 0.1000000), wk = 0.0024876 k( 350) = ( -0.5000000 0.5000000 0.0750000), wk = 0.0024876 k( 351) = ( -0.5000000 0.5000000 0.0500000), wk = 0.0024876 k( 352) = ( -0.5000000 0.5000000 0.0250000), wk = 0.0024876 k( 353) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0024876 k( 354) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024876 k( 355) = ( -0.0104167 0.0104167 0.5000000), wk = 0.0024876 k( 356) = ( -0.0208333 0.0208333 0.5000000), wk = 0.0024876 k( 357) = ( -0.0312500 0.0312500 0.5000000), wk = 0.0024876 k( 358) = ( -0.0416667 0.0416667 0.5000000), wk = 0.0024876 k( 359) = ( -0.0520833 0.0520833 0.5000000), wk = 0.0024876 k( 360) = ( -0.0625000 0.0625000 0.5000000), wk = 0.0024876 k( 361) = ( -0.0729167 0.0729167 0.5000000), wk = 0.0024876 k( 362) = ( -0.0833333 0.0833333 0.5000000), wk = 0.0024876 k( 363) = ( -0.0937500 0.0937500 0.5000000), wk = 0.0024876 k( 364) = ( -0.1041667 0.1041667 0.5000000), wk = 0.0024876 k( 365) = ( -0.1145833 0.1145833 0.5000000), wk = 0.0024876 k( 366) = ( -0.1250000 0.1250000 0.5000000), wk = 0.0024876 k( 367) = ( -0.1354167 0.1354167 0.5000000), wk = 0.0024876 k( 368) = ( -0.1458333 0.1458333 0.5000000), wk = 0.0024876 k( 369) = ( -0.1562500 0.1562500 0.5000000), wk = 0.0024876 k( 370) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0024876 k( 371) = ( -0.1770833 0.1770833 0.5000000), wk = 0.0024876 k( 372) = ( -0.1875000 0.1875000 0.5000000), wk = 0.0024876 k( 373) = ( -0.1979167 0.1979167 0.5000000), wk = 0.0024876 k( 374) = ( -0.2083333 0.2083333 0.5000000), wk = 0.0024876 k( 375) = ( -0.2187500 0.2187500 0.5000000), wk = 0.0024876 k( 376) = ( -0.2291667 0.2291667 0.5000000), wk = 0.0024876 k( 377) = ( -0.2395833 0.2395833 0.5000000), wk = 0.0024876 k( 378) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0024876 k( 379) = ( -0.2604167 0.2604167 0.5000000), wk = 0.0024876 k( 380) = ( -0.2708333 0.2708333 0.5000000), wk = 0.0024876 k( 381) = ( -0.2812500 0.2812500 0.5000000), wk = 0.0024876 k( 382) = ( -0.2916667 0.2916667 0.5000000), wk = 0.0024876 k( 383) = ( -0.3020833 0.3020833 0.5000000), wk = 0.0024876 k( 384) = ( -0.3125000 0.3125000 0.5000000), wk = 0.0024876 k( 385) = ( -0.3229167 0.3229167 0.5000000), wk = 0.0024876 k( 386) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0024876 k( 387) = ( -0.3437500 0.3437500 0.5000000), wk = 0.0024876 k( 388) = ( -0.3541667 0.3541667 0.5000000), wk = 0.0024876 k( 389) = ( -0.3645833 0.3645833 0.5000000), wk = 0.0024876 k( 390) = ( -0.3750000 0.3750000 0.5000000), wk = 0.0024876 k( 391) = ( -0.3854167 0.3854167 0.5000000), wk = 0.0024876 k( 392) = ( -0.3958333 0.3958333 0.5000000), wk = 0.0024876 k( 393) = ( -0.4062500 0.4062500 0.5000000), wk = 0.0024876 k( 394) = ( -0.4166667 0.4166667 0.5000000), wk = 0.0024876 k( 395) = ( -0.4270833 0.4270833 0.5000000), wk = 0.0024876 k( 396) = ( -0.4375000 0.4375000 0.5000000), wk = 0.0024876 k( 397) = ( -0.4479167 0.4479167 0.5000000), wk = 0.0024876 k( 398) = ( -0.4583333 0.4583333 0.5000000), wk = 0.0024876 k( 399) = ( -0.4687500 0.4687500 0.5000000), wk = 0.0024876 k( 400) = ( -0.4791667 0.4791667 0.5000000), wk = 0.0024876 k( 401) = ( -0.4895833 0.4895833 0.5000000), wk = 0.0024876 k( 402) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0024876 Dense grid: 44649 G-vectors FFT dimensions: ( 40, 40, 75) Smooth grid: 30639 G-vectors FFT dimensions: ( 32, 32, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 176, 68) NL pseudopotentials 0.27 Mb ( 88, 204) Each V/rho on FFT grid 0.05 Mb ( 3200) Each G-vector array 0.01 Mb ( 929) G-vector shells 0.00 Mb ( 474) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.73 Mb ( 176, 272) Each subspace H/S matrix 1.13 Mb ( 272, 272) Each matrix 0.42 Mb ( 204, 2, 68) The potential is recalculated from file : ./CuAgS.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 45.6 secs Computing kpt #: 2 total cpu time spent up to now is 48.4 secs Computing kpt #: 3 total cpu time spent up to now is 50.9 secs Computing kpt #: 4 total cpu time spent up to now is 53.5 secs Computing kpt #: 5 total cpu time spent up to now is 56.1 secs Computing kpt #: 6 total cpu time spent up to now is 58.6 secs Computing kpt #: 7 total cpu time spent up to now is 61.3 secs Computing kpt #: 8 total cpu time spent up to now is 64.0 secs Computing kpt #: 9 total cpu time spent up to now is 66.9 secs Computing kpt #: 10 total cpu time spent up to now is 69.9 secs Computing kpt #: 11 total cpu time spent up to now is 72.7 secs Computing kpt #: 12 total cpu time spent up to now is 75.5 secs Computing kpt #: 13 total cpu time spent up to now is 78.1 secs Computing kpt #: 14 total cpu time spent up to now is 81.1 secs Computing kpt #: 15 total cpu time spent up to now is 84.4 secs Computing kpt #: 16 total cpu time spent up to now is 87.3 secs Computing kpt #: 17 total cpu time spent up to now is 90.6 secs Computing kpt #: 18 total cpu time spent up to now is 93.3 secs Computing kpt #: 19 total cpu time spent up to now is 96.2 secs Computing kpt #: 20 total cpu time spent up to now is 99.0 secs Computing kpt #: 21 total cpu time spent up to now is 102.0 secs Computing kpt #: 22 total cpu time spent up to now is 105.1 secs Computing kpt #: 23 total cpu time spent up to now is 108.1 secs Computing kpt #: 24 total cpu time spent up to now is 111.0 secs Computing kpt #: 25 total cpu time spent up to now is 114.1 secs Computing kpt #: 26 total cpu time spent up to now is 116.9 secs Computing kpt #: 27 total cpu time spent up to now is 119.6 secs Computing kpt #: 28 total cpu time spent up to now is 122.3 secs Computing kpt #: 29 total cpu time spent up to now is 124.9 secs Computing kpt #: 30 total cpu time spent up to now is 127.6 secs Computing kpt #: 31 total cpu time spent up to now is 130.2 secs Computing kpt #: 32 total cpu time spent up to now is 132.7 secs Computing kpt #: 33 total cpu time spent up to now is 135.2 secs Computing kpt #: 34 total cpu time spent up to now is 137.8 secs Computing kpt #: 35 total cpu time spent up to now is 140.3 secs Computing kpt #: 36 total cpu time spent up to now is 142.9 secs Computing kpt #: 37 total cpu time spent up to now is 145.5 secs Computing kpt #: 38 total cpu time spent up to now is 148.0 secs Computing kpt #: 39 total cpu time spent up to now is 150.6 secs Computing kpt #: 40 total cpu time spent up to now is 153.1 secs Computing kpt #: 41 total cpu time spent up to now is 155.6 secs Computing kpt #: 42 total cpu time spent up to now is 158.1 secs Computing kpt #: 43 total cpu time spent up to now is 160.7 secs Computing kpt #: 44 total cpu time spent up to now is 163.2 secs Computing kpt #: 45 total cpu time spent up to now is 165.7 secs Computing kpt #: 46 total cpu time spent up to now is 168.4 secs Computing kpt #: 47 total cpu time spent up to now is 170.5 secs Computing kpt #: 48 total cpu time spent up to now is 173.0 secs Computing kpt #: 49 total cpu time spent up to now is 175.0 secs Computing kpt #: 50 total cpu time spent up to now is 177.5 secs Computing kpt #: 51 total cpu time spent up to now is 179.6 secs Computing kpt #: 52 total cpu time spent up to now is 182.0 secs Computing kpt #: 53 total cpu time spent up to now is 184.3 secs Computing kpt #: 54 total cpu time spent up to now is 186.7 secs Computing kpt #: 55 total cpu time spent up to now is 189.2 secs Computing kpt #: 56 total cpu time spent up to now is 191.7 secs Computing kpt #: 57 total cpu time spent up to now is 194.1 secs Computing kpt #: 58 total cpu time spent up to now is 196.4 secs Computing kpt #: 59 total cpu time spent up to now is 198.7 secs Computing kpt #: 60 total cpu time spent up to now is 201.2 secs Computing kpt #: 61 total cpu time spent up to now is 203.4 secs Computing kpt #: 62 total cpu time spent up to now is 205.8 secs Computing kpt #: 63 total cpu time spent up to now is 208.2 secs Computing kpt #: 64 total cpu time spent up to now is 210.8 secs Computing kpt #: 65 total cpu time spent up to now is 213.5 secs Computing kpt #: 66 total cpu time spent up to now is 216.3 secs Computing kpt #: 67 total cpu time spent up to now is 218.8 secs Computing kpt #: 68 total cpu time spent up to now is 221.5 secs Computing kpt #: 69 total cpu time spent up to now is 224.2 secs Computing kpt #: 70 total cpu time spent up to now is 226.9 secs Computing kpt #: 71 total cpu time spent up to now is 229.7 secs Computing kpt #: 72 total cpu time spent up to now is 232.5 secs Computing kpt #: 73 total cpu time spent up to now is 235.4 secs Computing kpt #: 74 total cpu time spent up to now is 237.8 secs Computing kpt #: 75 total cpu time spent up to now is 240.3 secs Computing kpt #: 76 total cpu time spent up to now is 242.7 secs Computing kpt #: 77 total cpu time spent up to now is 245.0 secs Computing kpt #: 78 total cpu time spent up to now is 247.3 secs Computing kpt #: 79 total cpu time spent up to now is 249.5 secs Computing kpt #: 80 total cpu time spent up to now is 251.8 secs Computing kpt #: 81 total cpu time spent up to now is 254.0 secs Computing kpt #: 82 total cpu time spent up to now is 256.2 secs Computing kpt #: 83 total cpu time spent up to now is 258.5 secs Computing kpt #: 84 total cpu time spent up to now is 261.4 secs Computing kpt #: 85 total cpu time spent up to now is 263.5 secs Computing kpt #: 86 total cpu time spent up to now is 265.9 secs Computing kpt #: 87 total cpu time spent up to now is 268.3 secs Computing kpt #: 88 total cpu time spent up to now is 270.9 secs Computing kpt #: 89 total cpu time spent up to now is 273.2 secs Computing kpt #: 90 total cpu time spent up to now is 275.6 secs Computing kpt #: 91 total cpu time spent up to now is 278.6 secs Computing kpt #: 92 total cpu time spent up to now is 281.3 secs Computing kpt #: 93 total cpu time spent up to now is 283.5 secs Computing kpt #: 94 total cpu time spent up to now is 285.8 secs Computing kpt #: 95 total cpu time spent up to now is 289.0 secs Computing kpt #: 96 total cpu time spent up to now is 291.1 secs Computing kpt #: 97 total cpu time spent up to now is 293.2 secs Computing kpt #: 98 total cpu time spent up to now is 295.4 secs Computing kpt #: 99 total cpu time spent up to now is 297.6 secs Computing kpt #: 100 total cpu time spent up to now is 300.1 secs Computing kpt #: 101 total cpu time spent up to now is 302.2 secs Computing kpt #: 102 total cpu time spent up to now is 304.4 secs Computing kpt #: 103 total cpu time spent up to now is 306.5 secs Computing kpt #: 104 total cpu time spent up to now is 308.6 secs Computing kpt #: 105 total cpu time spent up to now is 311.0 secs Computing kpt #: 106 total cpu time spent up to now is 313.1 secs Computing kpt #: 107 total cpu time spent up to now is 315.2 secs Computing kpt #: 108 total cpu time spent up to now is 317.3 secs Computing kpt #: 109 total cpu time spent up to now is 319.9 secs Computing kpt #: 110 total cpu time spent up to now is 322.7 secs Computing kpt #: 111 total cpu time spent up to now is 324.9 secs Computing kpt #: 112 total cpu time spent up to now is 327.1 secs Computing kpt #: 113 total cpu time spent up to now is 329.4 secs Computing kpt #: 114 total cpu time spent up to now is 331.9 secs Computing kpt #: 115 total cpu time spent up to now is 334.7 secs Computing kpt #: 116 total cpu time spent up to now is 337.2 secs Computing kpt #: 117 total cpu time spent up to now is 339.5 secs Computing kpt #: 118 total cpu time spent up to now is 342.2 secs Computing kpt #: 119 total cpu time spent up to now is 344.6 secs Computing kpt #: 120 total cpu time spent up to now is 347.1 secs Computing kpt #: 121 total cpu time spent up to now is 349.6 secs Computing kpt #: 122 total cpu time spent up to now is 352.2 secs Computing kpt #: 123 total cpu time spent up to now is 354.7 secs Computing kpt #: 124 total cpu time spent up to now is 357.4 secs Computing kpt #: 125 total cpu time spent up to now is 359.9 secs Computing kpt #: 126 total cpu time spent up to now is 362.8 secs Computing kpt #: 127 total cpu time spent up to now is 365.8 secs Computing kpt #: 128 total cpu time spent up to now is 368.2 secs Computing kpt #: 129 total cpu time spent up to now is 370.8 secs Computing kpt #: 130 total cpu time spent up to now is 373.3 secs Computing kpt #: 131 total cpu time spent up to now is 375.9 secs Computing kpt #: 132 total cpu time spent up to now is 378.4 secs Computing kpt #: 133 total cpu time spent up to now is 380.9 secs Computing kpt #: 134 total cpu time spent up to now is 383.3 secs Computing kpt #: 135 total cpu time spent up to now is 385.9 secs Computing kpt #: 136 total cpu time spent up to now is 388.3 secs Computing kpt #: 137 total cpu time spent up to now is 390.8 secs Computing kpt #: 138 total cpu time spent up to now is 393.4 secs Computing kpt #: 139 total cpu time spent up to now is 396.0 secs Computing kpt #: 140 total cpu time spent up to now is 398.5 secs Computing kpt #: 141 total cpu time spent up to now is 400.9 secs Computing kpt #: 142 total cpu time spent up to now is 403.9 secs Computing kpt #: 143 total cpu time spent up to now is 406.5 secs Computing kpt #: 144 total cpu time spent up to now is 408.9 secs Computing kpt #: 145 total cpu time spent up to now is 411.4 secs Computing kpt #: 146 total cpu time spent up to now is 413.9 secs Computing kpt #: 147 total cpu time spent up to now is 416.5 secs Computing kpt #: 148 total cpu time spent up to now is 418.9 secs Computing kpt #: 149 total cpu time spent up to now is 421.5 secs Computing kpt #: 150 total cpu time spent up to now is 424.0 secs Computing kpt #: 151 total cpu time spent up to now is 426.4 secs Computing kpt #: 152 total cpu time spent up to now is 428.7 secs Computing kpt #: 153 total cpu time spent up to now is 431.1 secs Computing kpt #: 154 total cpu time spent up to now is 433.6 secs Computing kpt #: 155 total cpu time spent up to now is 436.1 secs Computing kpt #: 156 total cpu time spent up to now is 438.2 secs Computing kpt #: 157 total cpu time spent up to now is 440.4 secs Computing kpt #: 158 total cpu time spent up to now is 442.6 secs Computing kpt #: 159 total cpu time spent up to now is 444.8 secs Computing kpt #: 160 total cpu time spent up to now is 446.9 secs Computing kpt #: 161 total cpu time spent up to now is 449.3 secs Computing kpt #: 162 total cpu time spent up to now is 451.3 secs Computing kpt #: 163 total cpu time spent up to now is 453.4 secs Computing kpt #: 164 total cpu time spent up to now is 455.5 secs Computing kpt #: 165 total cpu time spent up to now is 457.8 secs Computing kpt #: 166 total cpu time spent up to now is 459.9 secs Computing kpt #: 167 total cpu time spent up to now is 461.9 secs Computing kpt #: 168 total cpu time spent up to now is 464.1 secs Computing kpt #: 169 total cpu time spent up to now is 466.1 secs Computing kpt #: 170 total cpu time spent up to now is 468.1 secs Computing kpt #: 171 total cpu time spent up to now is 470.3 secs Computing kpt #: 172 total cpu time spent up to now is 472.4 secs Computing kpt #: 173 total cpu time spent up to now is 474.6 secs Computing kpt #: 174 total cpu time spent up to now is 476.8 secs Computing kpt #: 175 total cpu time spent up to now is 479.3 secs Computing kpt #: 176 total cpu time spent up to now is 482.0 secs Computing kpt #: 177 total cpu time spent up to now is 484.3 secs Computing kpt #: 178 total cpu time spent up to now is 486.6 secs Computing kpt #: 179 total cpu time spent up to now is 489.0 secs Computing kpt #: 180 total cpu time spent up to now is 491.4 secs Computing kpt #: 181 total cpu time spent up to now is 493.8 secs Computing kpt #: 182 total cpu time spent up to now is 496.3 secs Computing kpt #: 183 total cpu time spent up to now is 498.7 secs Computing kpt #: 184 total cpu time spent up to now is 501.2 secs Computing kpt #: 185 total cpu time spent up to now is 503.9 secs Computing kpt #: 186 total cpu time spent up to now is 506.4 secs Computing kpt #: 187 total cpu time spent up to now is 509.1 secs Computing kpt #: 188 total cpu time spent up to now is 511.7 secs Computing kpt #: 189 total cpu time spent up to now is 514.3 secs Computing kpt #: 190 total cpu time spent up to now is 516.8 secs Computing kpt #: 191 total cpu time spent up to now is 519.4 secs Computing kpt #: 192 total cpu time spent up to now is 522.1 secs Computing kpt #: 193 total cpu time spent up to now is 524.9 secs Computing kpt #: 194 total cpu time spent up to now is 527.6 secs Computing kpt #: 195 total cpu time spent up to now is 530.4 secs Computing kpt #: 196 total cpu time spent up to now is 533.1 secs Computing kpt #: 197 total cpu time spent up to now is 535.8 secs Computing kpt #: 198 total cpu time spent up to now is 538.5 secs Computing kpt #: 199 total cpu time spent up to now is 541.1 secs Computing kpt #: 200 total cpu time spent up to now is 543.5 secs Computing kpt #: 201 total cpu time spent up to now is 546.0 secs Computing kpt #: 202 total cpu time spent up to now is 548.5 secs Computing kpt #: 203 total cpu time spent up to now is 551.0 secs Computing kpt #: 204 total cpu time spent up to now is 553.4 secs Computing kpt #: 205 total cpu time spent up to now is 555.9 secs Computing kpt #: 206 total cpu time spent up to now is 558.4 secs Computing kpt #: 207 total cpu time spent up to now is 561.1 secs Computing kpt #: 208 total cpu time spent up to now is 563.8 secs Computing kpt #: 209 total cpu time spent up to now is 566.2 secs Computing kpt #: 210 total cpu time spent up to now is 568.7 secs Computing kpt #: 211 total cpu time spent up to now is 571.2 secs Computing kpt #: 212 total cpu time spent up to now is 573.7 secs Computing kpt #: 213 total cpu time spent up to now is 576.6 secs Computing kpt #: 214 total cpu time spent up to now is 579.6 secs Computing kpt #: 215 total cpu time spent up to now is 582.5 secs Computing kpt #: 216 total cpu time spent up to now is 585.1 secs Computing kpt #: 217 total cpu time spent up to now is 587.7 secs Computing kpt #: 218 total cpu time spent up to now is 590.3 secs Computing kpt #: 219 total cpu time spent up to now is 592.9 secs Computing kpt #: 220 total cpu time spent up to now is 595.7 secs Computing kpt #: 221 total cpu time spent up to now is 598.3 secs Computing kpt #: 222 total cpu time spent up to now is 600.8 secs Computing kpt #: 223 total cpu time spent up to now is 603.5 secs Computing kpt #: 224 total cpu time spent up to now is 606.2 secs Computing kpt #: 225 total cpu time spent up to now is 609.0 secs Computing kpt #: 226 total cpu time spent up to now is 611.8 secs Computing kpt #: 227 total cpu time spent up to now is 614.7 secs Computing kpt #: 228 total cpu time spent up to now is 617.9 secs Computing kpt #: 229 total cpu time spent up to now is 620.6 secs Computing kpt #: 230 total cpu time spent up to now is 623.4 secs Computing kpt #: 231 total cpu time spent up to now is 625.8 secs Computing kpt #: 232 total cpu time spent up to now is 628.3 secs Computing kpt #: 233 total cpu time spent up to now is 630.6 secs Computing kpt #: 234 total cpu time spent up to now is 633.0 secs Computing kpt #: 235 total cpu time spent up to now is 635.3 secs Computing kpt #: 236 total cpu time spent up to now is 637.8 secs Computing kpt #: 237 total cpu time spent up to now is 640.1 secs Computing kpt #: 238 total cpu time spent up to now is 642.4 secs Computing kpt #: 239 total cpu time spent up to now is 644.6 secs Computing kpt #: 240 total cpu time spent up to now is 646.9 secs Computing kpt #: 241 total cpu time spent up to now is 649.3 secs Computing kpt #: 242 total cpu time spent up to now is 651.6 secs Computing kpt #: 243 total cpu time spent up to now is 654.3 secs Computing kpt #: 244 total cpu time spent up to now is 656.8 secs Computing kpt #: 245 total cpu time spent up to now is 659.5 secs Computing kpt #: 246 total cpu time spent up to now is 662.0 secs Computing kpt #: 247 total cpu time spent up to now is 664.8 secs Computing kpt #: 248 total cpu time spent up to now is 667.6 secs Computing kpt #: 249 total cpu time spent up to now is 670.2 secs Computing kpt #: 250 total cpu time spent up to now is 672.8 secs Computing kpt #: 251 total cpu time spent up to now is 675.4 secs Computing kpt #: 252 total cpu time spent up to now is 678.0 secs Computing kpt #: 253 total cpu time spent up to now is 680.7 secs Computing kpt #: 254 total cpu time spent up to now is 683.3 secs Computing kpt #: 255 total cpu time spent up to now is 685.7 secs Computing kpt #: 256 total cpu time spent up to now is 688.0 secs Computing kpt #: 257 total cpu time spent up to now is 690.5 secs Computing kpt #: 258 total cpu time spent up to now is 693.1 secs Computing kpt #: 259 total cpu time spent up to now is 695.3 secs Computing kpt #: 260 total cpu time spent up to now is 697.7 secs Computing kpt #: 261 total cpu time spent up to now is 700.0 secs Computing kpt #: 262 total cpu time spent up to now is 702.4 secs Computing kpt #: 263 total cpu time spent up to now is 705.0 secs Computing kpt #: 264 total cpu time spent up to now is 707.4 secs Computing kpt #: 265 total cpu time spent up to now is 710.1 secs Computing kpt #: 266 total cpu time spent up to now is 712.8 secs Computing kpt #: 267 total cpu time spent up to now is 715.5 secs Computing kpt #: 268 total cpu time spent up to now is 718.2 secs Computing kpt #: 269 total cpu time spent up to now is 721.0 secs Computing kpt #: 270 total cpu time spent up to now is 723.7 secs Computing kpt #: 271 total cpu time spent up to now is 726.4 secs Computing kpt #: 272 total cpu time spent up to now is 729.1 secs Computing kpt #: 273 total cpu time spent up to now is 731.8 secs Computing kpt #: 274 total cpu time spent up to now is 734.4 secs Computing kpt #: 275 total cpu time spent up to now is 737.3 secs Computing kpt #: 276 total cpu time spent up to now is 739.9 secs Computing kpt #: 277 total cpu time spent up to now is 742.4 secs Computing kpt #: 278 total cpu time spent up to now is 744.8 secs Computing kpt #: 279 total cpu time spent up to now is 747.4 secs Computing kpt #: 280 total cpu time spent up to now is 749.8 secs Computing kpt #: 281 total cpu time spent up to now is 752.3 secs Computing kpt #: 282 total cpu time spent up to now is 754.7 secs Computing kpt #: 283 total cpu time spent up to now is 757.2 secs Computing kpt #: 284 total cpu time spent up to now is 759.5 secs Computing kpt #: 285 total cpu time spent up to now is 761.9 secs Computing kpt #: 286 total cpu time spent up to now is 764.2 secs Computing kpt #: 287 total cpu time spent up to now is 766.6 secs Computing kpt #: 288 total cpu time spent up to now is 769.1 secs Computing kpt #: 289 total cpu time spent up to now is 771.5 secs Computing kpt #: 290 total cpu time spent up to now is 773.9 secs Computing kpt #: 291 total cpu time spent up to now is 776.3 secs Computing kpt #: 292 total cpu time spent up to now is 779.1 secs Computing kpt #: 293 total cpu time spent up to now is 781.4 secs Computing kpt #: 294 total cpu time spent up to now is 783.6 secs Computing kpt #: 295 total cpu time spent up to now is 785.8 secs Computing kpt #: 296 total cpu time spent up to now is 788.0 secs Computing kpt #: 297 total cpu time spent up to now is 790.6 secs Computing kpt #: 298 total cpu time spent up to now is 793.0 secs Computing kpt #: 299 total cpu time spent up to now is 795.6 secs Computing kpt #: 300 total cpu time spent up to now is 798.0 secs Computing kpt #: 301 total cpu time spent up to now is 800.5 secs Computing kpt #: 302 total cpu time spent up to now is 802.9 secs Computing kpt #: 303 total cpu time spent up to now is 805.3 secs Computing kpt #: 304 total cpu time spent up to now is 807.8 secs Computing kpt #: 305 total cpu time spent up to now is 810.2 secs Computing kpt #: 306 total cpu time spent up to now is 812.7 secs Computing kpt #: 307 total cpu time spent up to now is 815.4 secs Computing kpt #: 308 total cpu time spent up to now is 818.2 secs Computing kpt #: 309 total cpu time spent up to now is 821.0 secs Computing kpt #: 310 total cpu time spent up to now is 823.8 secs Computing kpt #: 311 total cpu time spent up to now is 826.1 secs Computing kpt #: 312 total cpu time spent up to now is 828.3 secs Computing kpt #: 313 total cpu time spent up to now is 830.5 secs Computing kpt #: 314 total cpu time spent up to now is 833.0 secs Computing kpt #: 315 total cpu time spent up to now is 835.2 secs Computing kpt #: 316 total cpu time spent up to now is 837.3 secs Computing kpt #: 317 total cpu time spent up to now is 839.4 secs Computing kpt #: 318 total cpu time spent up to now is 841.5 secs Computing kpt #: 319 total cpu time spent up to now is 843.9 secs Computing kpt #: 320 total cpu time spent up to now is 846.1 secs Computing kpt #: 321 total cpu time spent up to now is 848.5 secs Computing kpt #: 322 total cpu time spent up to now is 851.1 secs Computing kpt #: 323 total cpu time spent up to now is 853.3 secs Computing kpt #: 324 total cpu time spent up to now is 855.7 secs Computing kpt #: 325 total cpu time spent up to now is 858.1 secs Computing kpt #: 326 total cpu time spent up to now is 860.4 secs Computing kpt #: 327 total cpu time spent up to now is 862.8 secs Computing kpt #: 328 total cpu time spent up to now is 865.1 secs Computing kpt #: 329 total cpu time spent up to now is 867.5 secs Computing kpt #: 330 total cpu time spent up to now is 869.9 secs Computing kpt #: 331 total cpu time spent up to now is 872.3 secs Computing kpt #: 332 total cpu time spent up to now is 874.5 secs Computing kpt #: 333 total cpu time spent up to now is 876.8 secs Computing kpt #: 334 total cpu time spent up to now is 879.9 secs Computing kpt #: 335 total cpu time spent up to now is 883.4 secs Computing kpt #: 336 total cpu time spent up to now is 886.0 secs Computing kpt #: 337 total cpu time spent up to now is 888.4 secs Computing kpt #: 338 total cpu time spent up to now is 890.7 secs Computing kpt #: 339 total cpu time spent up to now is 893.1 secs Computing kpt #: 340 total cpu time spent up to now is 895.5 secs Computing kpt #: 341 total cpu time spent up to now is 897.9 secs Computing kpt #: 342 total cpu time spent up to now is 900.4 secs Computing kpt #: 343 total cpu time spent up to now is 903.0 secs Computing kpt #: 344 total cpu time spent up to now is 905.7 secs Computing kpt #: 345 total cpu time spent up to now is 908.3 secs Computing kpt #: 346 total cpu time spent up to now is 911.1 secs Computing kpt #: 347 total cpu time spent up to now is 913.7 secs Computing kpt #: 348 total cpu time spent up to now is 916.3 secs Computing kpt #: 349 total cpu time spent up to now is 918.9 secs Computing kpt #: 350 total cpu time spent up to now is 921.3 secs Computing kpt #: 351 total cpu time spent up to now is 923.7 secs Computing kpt #: 352 total cpu time spent up to now is 926.0 secs Computing kpt #: 353 total cpu time spent up to now is 928.3 secs Computing kpt #: 354 total cpu time spent up to now is 930.9 secs Computing kpt #: 355 total cpu time spent up to now is 933.4 secs Computing kpt #: 356 total cpu time spent up to now is 936.1 secs Computing kpt #: 357 total cpu time spent up to now is 938.8 secs Computing kpt #: 358 total cpu time spent up to now is 941.5 secs Computing kpt #: 359 total cpu time spent up to now is 944.6 secs Computing kpt #: 360 total cpu time spent up to now is 947.3 secs Computing kpt #: 361 total cpu time spent up to now is 949.9 secs Computing kpt #: 362 total cpu time spent up to now is 952.6 secs Computing kpt #: 363 total cpu time spent up to now is 955.2 secs Computing kpt #: 364 total cpu time spent up to now is 957.8 secs Computing kpt #: 365 total cpu time spent up to now is 960.3 secs Computing kpt #: 366 total cpu time spent up to now is 962.7 secs Computing kpt #: 367 total cpu time spent up to now is 965.1 secs Computing kpt #: 368 total cpu time spent up to now is 967.5 secs Computing kpt #: 369 total cpu time spent up to now is 969.8 secs Computing kpt #: 370 total cpu time spent up to now is 972.3 secs Computing kpt #: 371 total cpu time spent up to now is 974.7 secs Computing kpt #: 372 total cpu time spent up to now is 977.0 secs Computing kpt #: 373 total cpu time spent up to now is 979.4 secs Computing kpt #: 374 total cpu time spent up to now is 981.7 secs Computing kpt #: 375 total cpu time spent up to now is 984.0 secs Computing kpt #: 376 total cpu time spent up to now is 986.4 secs Computing kpt #: 377 total cpu time spent up to now is 988.9 secs Computing kpt #: 378 total cpu time spent up to now is 991.2 secs Computing kpt #: 379 total cpu time spent up to now is 993.5 secs Computing kpt #: 380 total cpu time spent up to now is 995.8 secs Computing kpt #: 381 total cpu time spent up to now is 998.2 secs Computing kpt #: 382 total cpu time spent up to now is 1000.8 secs Computing kpt #: 383 total cpu time spent up to now is 1003.2 secs Computing kpt #: 384 total cpu time spent up to now is 1005.7 secs Computing kpt #: 385 total cpu time spent up to now is 1008.3 secs Computing kpt #: 386 total cpu time spent up to now is 1010.9 secs Computing kpt #: 387 total cpu time spent up to now is 1013.5 secs Computing kpt #: 388 total cpu time spent up to now is 1016.3 secs Computing kpt #: 389 total cpu time spent up to now is 1018.9 secs Computing kpt #: 390 total cpu time spent up to now is 1021.5 secs Computing kpt #: 391 total cpu time spent up to now is 1024.2 secs Computing kpt #: 392 total cpu time spent up to now is 1026.7 secs Computing kpt #: 393 total cpu time spent up to now is 1029.3 secs Computing kpt #: 394 total cpu time spent up to now is 1031.7 secs Computing kpt #: 395 total cpu time spent up to now is 1034.1 secs Computing kpt #: 396 total cpu time spent up to now is 1036.9 secs Computing kpt #: 397 total cpu time spent up to now is 1039.2 secs Computing kpt #: 398 total cpu time spent up to now is 1041.6 secs Computing kpt #: 399 total cpu time spent up to now is 1043.8 secs Computing kpt #: 400 total cpu time spent up to now is 1046.6 secs Computing kpt #: 401 total cpu time spent up to now is 1049.0 secs Computing kpt #: 402 total cpu time spent up to now is 1051.2 secs ethr = 1.79E-11, avg # of iterations = 24.3 total cpu time spent up to now is 1051.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3809 PWs) bands (ev): -5.4119 -5.4119 -4.9657 -4.9657 2.2386 2.2386 3.0480 3.0480 3.4733 3.4733 4.1616 4.1616 4.2514 4.2514 4.2897 4.2897 4.3914 4.3914 4.4633 4.4633 4.5521 4.5521 4.6782 4.6782 4.8257 4.8257 5.0532 5.0532 5.2908 5.2908 5.3486 5.3486 5.5312 5.5312 5.7803 5.7803 6.3275 6.3275 6.4173 6.4173 6.6278 6.6278 6.7584 6.7584 6.7914 6.7914 6.9871 6.9871 8.3468 8.3468 8.4252 8.4252 8.9428 8.9428 8.9987 8.9987 10.0516 10.0516 10.2360 10.2360 13.4098 13.4098 13.8842 13.8842 14.0537 14.0537 14.5210 14.5210 k = 0.0064 0.0104-0.0000 ( 3809 PWs) bands (ev): -5.4113 -5.4112 -4.9651 -4.9651 2.2389 2.2389 3.0482 3.0484 3.4716 3.4717 4.1604 4.1620 4.2386 4.2504 4.2862 4.3018 4.3860 4.3942 4.4556 4.4752 4.5503 4.5555 4.6779 4.6799 4.8255 4.8265 5.0512 5.0524 5.2912 5.2921 5.3460 5.3513 5.5295 5.5320 5.7808 5.7815 6.3265 6.3298 6.4166 6.4169 6.6273 6.6286 6.7576 6.7590 6.7903 6.7925 6.9876 6.9890 8.3375 8.3395 8.4292 8.4301 8.9369 8.9383 8.9935 8.9949 10.0511 10.0518 10.2456 10.2456 13.4078 13.4080 13.8798 13.8799 14.0591 14.0611 14.5249 14.5251 k = 0.0127 0.0208-0.0000 ( 3821 PWs) bands (ev): -5.4094 -5.4093 -4.9635 -4.9634 2.2399 2.2399 3.0489 3.0494 3.4666 3.4668 4.1575 4.1622 4.2196 4.2355 4.2930 4.3141 4.3799 4.3925 4.4544 4.4883 4.5505 4.5599 4.6791 4.6829 4.8259 4.8278 5.0465 5.0489 5.2931 5.2949 5.3435 5.3542 5.5270 5.5319 5.7830 5.7843 6.3267 6.3334 6.4149 6.4154 6.6270 6.6296 6.7565 6.7592 6.7893 6.7936 6.9903 6.9932 8.3157 8.3191 8.4384 8.4397 8.9197 8.9221 8.9813 8.9837 10.0504 10.0517 10.2737 10.2737 13.4019 13.4023 13.8677 13.8680 14.0764 14.0801 14.5367 14.5372 k = 0.0191 0.0312-0.0000 ( 3813 PWs) bands (ev): -5.4062 -5.4061 -4.9607 -4.9606 2.2416 2.2416 3.0503 3.0509 3.4584 3.4586 4.1504 4.1624 4.1960 4.2178 4.3018 4.3245 4.3742 4.3874 4.4596 4.5006 4.5533 4.5651 4.6819 4.6872 4.8271 4.8296 5.0396 5.0429 5.2964 5.2990 5.3411 5.3573 5.5237 5.5310 5.7867 5.7888 6.3284 6.3383 6.4123 6.4129 6.6270 6.6309 6.7552 6.7593 6.7885 6.7949 6.9955 6.9998 8.2862 8.2905 8.4482 8.4493 8.8899 8.8926 8.9657 8.9683 10.0494 10.0514 10.3185 10.3185 13.3922 13.3929 13.8497 13.8506 14.1041 14.1091 14.5565 14.5573 k = 0.0255 0.0416-0.0000 ( 3815 PWs) bands (ev): -5.4018 -5.4017 -4.9569 -4.9567 2.2439 2.2439 3.0521 3.0530 3.4469 3.4473 4.1353 4.1624 4.1686 4.2040 4.3099 4.3325 4.3696 4.3817 4.4686 4.5107 4.5594 4.5708 4.6863 4.6927 4.8291 4.8319 5.0306 5.0347 5.3008 5.3039 5.3389 5.3606 5.5196 5.5294 5.7920 5.7948 6.3315 6.3442 6.4089 6.4094 6.6274 6.6325 6.7538 6.7589 6.7878 6.7962 7.0029 7.0085 8.2511 8.2563 8.4562 8.4571 8.8482 8.8507 8.9481 8.9504 10.0483 10.0510 10.3775 10.3775 13.3787 13.3796 13.8274 13.8292 14.1407 14.1468 14.5838 14.5849 k = 0.0318 0.0520-0.0000 ( 3819 PWs) bands (ev): -5.3961 -5.3960 -4.9520 -4.9518 2.2468 2.2468 3.0544 3.0555 3.4322 3.4327 4.1106 4.1362 4.1636 4.1967 4.3165 4.3380 4.3667 4.3773 4.4797 4.5183 4.5683 4.5766 4.6923 4.6993 4.8321 4.8346 5.0199 5.0248 5.3058 5.3095 5.3368 5.3641 5.5148 5.5270 5.7989 5.8024 6.3359 6.3510 6.4048 6.4049 6.6280 6.6343 6.7521 6.7582 6.7873 6.7976 7.0122 7.0193 8.2113 8.2173 8.4616 8.4622 8.7972 8.7993 8.9281 8.9299 10.0471 10.0505 10.4483 10.4484 13.3613 13.3625 13.8020 13.8049 14.1855 14.1926 14.6185 14.6200 k = 0.0382 0.0624-0.0000 ( 3817 PWs) bands (ev): -5.3892 -5.3892 -4.9460 -4.9458 2.2503 2.2503 3.0572 3.0585 3.4145 3.4153 4.0786 4.1010 4.1643 4.1938 4.3207 4.3409 4.3663 4.3752 4.4918 4.5242 4.5792 4.5826 4.6999 4.7068 4.8360 4.8378 5.0081 5.0135 5.3111 5.3152 5.3348 5.3679 5.5094 5.5242 5.8071 5.8115 6.3418 6.3582 6.3993 6.4006 6.6291 6.6363 6.7502 6.7572 6.7870 6.7991 7.0236 7.0320 8.1675 8.1744 8.4640 8.4642 8.7396 8.7414 8.9052 8.9064 10.0461 10.0501 10.5286 10.5288 13.3402 13.3415 13.7744 13.7784 14.2379 14.2460 14.6599 14.6617 k = 0.0446 0.0728-0.0000 ( 3809 PWs) bands (ev): -5.3811 -5.3811 -4.9390 -4.9387 2.2544 2.2545 3.0603 3.0619 3.3940 3.3950 4.0420 4.0627 4.1653 4.1931 4.3224 4.3416 4.3688 4.3753 4.5044 4.5292 4.5886 4.5910 4.7089 4.7151 4.8410 4.8413 4.9954 5.0014 5.3163 5.3209 5.3331 5.3719 5.5034 5.5207 5.8167 5.8219 6.3491 6.3643 6.3926 6.3977 6.6304 6.6386 6.7482 6.7557 6.7870 6.8007 7.0368 7.0465 8.1202 8.1280 8.4629 8.4630 8.6776 8.6794 8.8791 8.8799 10.0454 10.0501 10.6167 10.6169 13.3152 13.3168 13.7452 13.7503 14.2975 14.3068 14.7071 14.7094 k = 0.0509 0.0832-0.0000 ( 3817 PWs) bands (ev): -5.3719 -5.3718 -4.9310 -4.9307 2.2591 2.2591 3.0638 3.0657 3.3707 3.3720 4.0021 4.0218 4.1664 4.1933 4.3217 4.3409 4.3737 4.3767 4.5172 4.5338 4.5948 4.6032 4.7190 4.7241 4.8452 4.8471 4.9822 4.9887 5.3212 5.3257 5.3319 5.3762 5.4970 5.5169 5.8275 5.8335 6.3575 6.3662 6.3848 6.3990 6.6320 6.6412 6.7459 6.7540 6.7871 6.8023 7.0515 7.0626 8.0697 8.0784 8.4578 8.4584 8.6132 8.6149 8.8497 8.8501 10.0453 10.0506 10.7111 10.7114 13.2864 13.2882 13.7150 13.7211 14.3636 14.3743 14.7586 14.7614 k = 0.0573 0.0935-0.0000 ( 3815 PWs) bands (ev): -5.3615 -5.3614 -4.9219 -4.9216 2.2643 2.2644 3.0675 3.0697 3.3448 3.3465 3.9599 3.9788 4.1676 4.1938 4.3197 4.3398 4.3787 4.3803 4.5299 4.5385 4.6012 4.6153 4.7301 4.7335 4.8496 4.8545 4.9690 4.9761 5.3256 5.3274 5.3335 5.3809 5.4902 5.5128 5.8394 5.8462 6.3624 6.3673 6.3762 6.4062 6.6340 6.6439 6.7435 6.7519 6.7873 6.8041 7.0677 7.0800 8.0165 8.0263 8.4479 8.4491 8.5482 8.5501 8.8171 8.8172 10.0463 10.0521 10.8106 10.8110 13.2539 13.2558 13.6841 13.6913 14.4354 14.4481 14.8111 14.8141 k = 0.0637 0.1039-0.0000 ( 3815 PWs) bands (ev): -5.3499 -5.3498 -4.9120 -4.9116 2.2700 2.2701 3.0714 3.0739 3.3166 3.3186 3.9159 3.9340 4.1687 4.1943 4.3168 4.3386 4.3809 4.3879 4.5421 4.5432 4.6080 4.6274 4.7418 4.7433 4.8545 4.8629 4.9561 4.9639 5.3264 5.3294 5.3375 5.3858 5.4833 5.5086 5.8523 5.8600 6.3548 6.3665 6.3782 6.4172 6.6362 6.6469 6.7410 6.7498 6.7876 6.8058 7.0850 7.0987 7.9612 7.9720 8.4294 8.4316 8.4870 8.4895 8.7812 8.7814 10.0486 10.0549 10.9144 10.9149 13.2175 13.2196 13.6530 13.6613 14.5115 14.5273 14.8525 14.8533 k = 0.0700 0.1143-0.0000 ( 3819 PWs) bands (ev): -5.3373 -5.3372 -4.9011 -4.9007 2.2762 2.2763 3.0752 3.0781 3.2861 3.2886 3.8704 3.8879 4.1698 4.1945 4.3136 4.3374 4.3830 4.3959 4.5478 4.5535 4.6153 4.6393 4.7534 4.7539 4.8601 4.8720 4.9444 4.9526 5.3249 5.3326 5.3413 5.3909 5.4762 5.5043 5.8659 5.8744 6.3451 6.3559 6.3902 6.4303 6.6386 6.6500 6.7385 6.7477 6.7879 6.8076 7.1033 7.1184 7.9040 7.9160 8.3898 8.3916 8.4444 8.4462 8.7423 8.7428 10.0528 10.0595 11.0217 11.0224 13.1772 13.1796 13.6221 13.6314 14.5890 14.6109 14.8188 14.8383 k = 0.0764 0.1247-0.0000 ( 3817 PWs) bands (ev): -5.3237 -5.3236 -4.8893 -4.8889 2.2827 2.2830 3.0788 3.0822 3.2537 3.2567 3.8239 3.8408 4.1707 4.1942 4.3105 4.3362 4.3852 4.4041 4.5523 4.5636 4.6235 4.6512 4.7638 4.7662 4.8665 4.8811 4.9349 4.9427 5.3234 5.3352 5.3446 5.3961 5.4693 5.5002 5.8801 5.8895 6.3342 6.3445 6.4032 6.4447 6.6412 6.6531 6.7361 6.7457 6.7882 6.8094 7.1225 7.1389 7.8456 7.8588 8.3304 8.3312 8.4187 8.4192 8.7007 8.7014 10.0593 10.0664 11.1320 11.1329 13.1332 13.1357 13.5915 13.6018 14.6537 14.6942 14.7460 14.7871 k = 0.0828 0.1351-0.0000 ( 3817 PWs) bands (ev): -5.3091 -5.3089 -4.8767 -4.8763 2.2897 2.2900 3.0819 3.0860 3.2197 3.2233 3.7768 3.7931 4.1713 4.1933 4.3075 4.3351 4.3874 4.4122 4.5566 4.5720 4.6323 4.6629 4.7744 4.7783 4.8740 4.8877 4.9305 4.9348 5.3219 5.3372 5.3473 5.4012 5.4628 5.4963 5.8948 5.9049 6.3222 6.3323 6.4170 6.4598 6.6438 6.6561 6.7339 6.7441 6.7882 6.8112 7.1421 7.1600 7.7862 7.8009 8.2662 8.2666 8.3938 8.3941 8.6566 8.6575 10.0685 10.0760 11.2449 11.2459 13.0852 13.0880 13.5614 13.5727 14.6411 14.6532 14.7928 14.8056 k = 0.0891 0.1455-0.0000 ( 3825 PWs) bands (ev): -5.2935 -5.2934 -4.8634 -4.8628 2.2970 2.2974 3.0840 3.0888 3.1845 3.1890 3.7294 3.7451 4.1714 4.1917 4.3047 4.3339 4.3898 4.4201 4.5603 4.5783 4.6419 4.6747 4.7853 4.7902 4.8825 4.8889 4.9293 4.9343 5.3205 5.3387 5.3492 5.4061 5.4570 5.4928 5.9097 5.9206 6.3094 6.3194 6.4314 6.4754 6.6462 6.6587 6.7321 6.7431 6.7882 6.8130 7.1620 7.1815 7.7264 7.7427 8.2016 8.2018 8.3657 8.3666 8.6101 8.6113 10.0809 10.0886 11.3599 11.3611 13.0334 13.0364 13.5321 13.5444 14.5678 14.5695 14.8811 14.8830 k = 0.0955 0.1559-0.0000 ( 3825 PWs) bands (ev): -5.2770 -5.2769 -4.8492 -4.8487 2.3046 2.3052 3.0835 3.0896 3.1493 3.1552 3.6820 3.6972 4.1712 4.1894 4.3022 4.3326 4.3924 4.4276 4.5634 4.5822 4.6520 4.6865 4.7962 4.8017 4.8862 4.8916 4.9273 4.9453 5.3193 5.3400 5.3506 5.4103 5.4522 5.4897 5.9248 5.9364 6.2960 6.3058 6.4462 6.4910 6.6482 6.6607 6.7310 6.7431 6.7881 6.8150 7.1819 7.2031 7.6667 7.6848 8.1381 8.1382 8.3342 8.3356 8.5616 8.5630 10.0968 10.1047 11.4766 11.4780 12.9776 12.9808 13.5036 13.5169 14.4815 14.4881 14.9501 14.9570 k = 0.1019 0.1663-0.0000 ( 3829 PWs) bands (ev): -5.2597 -5.2596 -4.8345 -4.8339 2.3125 2.3132 3.0760 3.0826 3.1200 3.1265 3.6351 3.6499 4.1704 4.1862 4.3000 4.3312 4.3953 4.4347 4.5657 4.5835 4.6625 4.6983 4.8070 4.8129 4.8833 4.9003 4.9300 4.9601 5.3182 5.3409 5.3514 5.4131 5.4494 5.4873 5.9398 5.9522 6.2819 6.2916 6.4611 6.5062 6.6496 6.6618 6.7307 6.7444 6.7880 6.8174 7.2013 7.2245 7.6075 7.6277 8.0761 8.0761 8.2988 8.3008 8.5112 8.5129 10.1165 10.1246 11.5948 11.5965 12.9179 12.9212 13.4759 13.4904 14.3957 14.4051 14.9430 14.9433 k = 0.1082 0.1767-0.0000 ( 3827 PWs) bands (ev): -5.2416 -5.2415 -4.8190 -4.8184 2.3206 2.3214 3.0530 3.0560 3.1082 3.1111 3.5891 3.6035 4.1689 4.1823 4.2981 4.3296 4.3986 4.4410 4.5673 4.5824 4.6732 4.7101 4.8171 4.8242 4.8827 4.9069 4.9389 4.9772 5.3175 5.3418 5.3518 5.4141 5.4493 5.4856 5.9547 5.9678 6.2676 6.2771 6.4758 6.5206 6.6500 6.6618 6.7314 6.7469 6.7887 6.8205 7.2194 7.2450 7.5495 7.5722 8.0159 8.0160 8.2598 8.2622 8.4592 8.4611 10.1403 10.1485 11.7140 11.7161 12.8544 12.8578 13.4493 13.4648 14.3111 14.3226 14.9071 14.9099 k = 0.1146 0.1871-0.0000 ( 3821 PWs) bands (ev): -5.2228 -5.2227 -4.8031 -4.8024 2.3289 2.3299 3.0186 3.0188 3.1048 3.1050 3.5445 3.5585 4.1669 4.1776 4.2963 4.3278 4.4021 4.4465 4.5681 4.5789 4.6840 4.7217 4.8260 4.8358 4.8856 4.9118 4.9531 4.9955 5.3170 5.3426 5.3517 5.4131 5.4520 5.4847 5.9693 5.9830 6.2530 6.2624 6.4898 6.5337 6.6492 6.6603 6.7329 6.7503 6.7911 6.8248 7.2354 7.2638 7.4939 7.5196 7.9580 7.9581 8.2172 8.2202 8.4059 8.4080 10.1682 10.1765 11.8338 11.8364 12.7871 12.7905 13.4236 13.4403 14.2284 14.2415 14.8623 14.8668 k = 0.1210 0.1975-0.0000 ( 3819 PWs) bands (ev): -5.2034 -5.2033 -4.7866 -4.7860 2.3373 2.3385 2.9787 2.9799 3.1007 3.1019 3.5017 3.5154 4.1641 4.1724 4.2945 4.3256 4.4059 4.4511 4.5684 4.5736 4.6948 4.7329 4.8338 4.8476 4.8926 4.9166 4.9709 5.0149 5.3168 5.3435 5.3513 5.4107 5.4569 5.4846 5.9834 5.9977 6.2385 6.2477 6.5029 6.5449 6.6471 6.6574 6.7346 6.7530 6.7970 6.8309 7.2468 7.2780 7.4432 7.4720 7.9026 7.9027 8.1715 8.1750 8.3514 8.3538 10.2004 10.2087 11.9536 11.9568 12.7166 12.7197 13.3990 13.4169 14.1478 14.1625 14.7990 14.8029 k = 0.1273 0.2079-0.0000 ( 3819 PWs) bands (ev): -5.1834 -5.1833 -4.7697 -4.7690 2.3458 2.3472 2.9375 2.9397 3.0953 3.0972 3.4614 3.4750 4.1608 4.1665 4.2925 4.3231 4.4099 4.4545 4.5668 4.5684 4.7055 4.7433 4.8413 4.8596 4.9029 4.9218 4.9911 5.0349 5.3170 5.3446 5.3507 5.4080 5.4632 5.4855 5.9968 6.0116 6.2243 6.2332 6.5144 6.5538 6.6437 6.6532 6.7361 6.7537 6.8080 6.8398 7.2496 7.2809 7.4044 7.4336 7.8498 7.8499 8.1228 8.1269 8.2960 8.2985 10.2368 10.2451 12.0718 12.0762 12.6439 12.6462 13.3754 13.3946 14.0698 14.0860 14.6972 14.6982 k = 0.1337 0.2183-0.0000 ( 3819 PWs) bands (ev): -5.1629 -5.1628 -4.7525 -4.7518 2.3543 2.3561 2.8961 2.8988 3.0874 3.0898 3.4243 3.4378 4.1569 4.1603 4.2902 4.3199 4.4140 4.4567 4.5591 4.5683 4.7161 4.7528 4.8496 4.8716 4.9158 4.9277 5.0131 5.0553 5.3177 5.3458 5.3500 5.4053 5.4707 5.4873 6.0093 6.0246 6.2107 6.2193 6.5241 6.5599 6.6391 6.6478 6.7366 6.7523 6.8244 6.8520 7.2382 7.2615 7.3885 7.4102 7.8000 7.8000 8.0717 8.0764 8.2398 8.2425 10.2775 10.2858 12.1846 12.1915 12.5728 12.5730 13.3530 13.3734 13.9947 14.0123 14.5687 14.5729 k = 0.1401 0.2287-0.0000 ( 3811 PWs) bands (ev): -5.1420 -5.1418 -4.7349 -4.7342 2.3628 2.3649 2.8545 2.8579 3.0764 3.0791 3.3910 3.4044 4.1524 4.1537 4.2875 4.3161 4.4181 4.4578 4.5513 4.5687 4.7266 4.7610 4.8594 4.8832 4.9300 4.9343 5.0367 5.0760 5.3189 5.3473 5.3493 5.4030 5.4790 5.4901 6.0208 6.0366 6.1982 6.2064 6.5313 6.5630 6.6338 6.6414 6.7358 6.7493 6.8454 6.8679 7.2109 7.2226 7.3929 7.4032 7.7532 7.7533 8.0187 8.0240 8.1830 8.1860 10.3224 10.3306 12.2766 12.2892 12.5133 12.5185 13.3316 13.3534 13.9227 13.9418 14.4383 14.4436 k = 0.1464 0.2391-0.0000 ( 3807 PWs) bands (ev): -5.1207 -5.1206 -4.7172 -4.7165 2.3713 2.3738 2.8133 2.8172 3.0616 3.0646 3.3620 3.3754 4.1468 4.1474 4.2841 4.3115 4.4221 4.4577 4.5437 4.5695 4.7368 4.7679 4.8710 4.8942 4.9417 4.9451 5.0615 5.0968 5.3207 5.3488 5.3490 5.4013 5.4881 5.4941 6.0311 6.0470 6.1871 6.1948 6.5356 6.5626 6.6279 6.6344 6.7338 6.7453 6.8700 6.8876 7.1730 7.1761 7.4058 7.4077 7.7095 7.7098 7.9641 7.9700 8.1259 8.1290 10.3713 10.3795 12.2952 12.3123 12.5239 12.5335 13.3113 13.3346 13.8541 13.8748 14.3118 14.3173 k = 0.1528 0.2495-0.0000 ( 3802 PWs) bands (ev): -5.0991 -5.0990 -4.6993 -4.6986 2.3797 2.3827 2.7726 2.7770 3.0430 3.0462 3.3375 3.3509 4.1396 4.1421 4.2800 4.3059 4.4256 4.4567 4.5371 4.5710 4.7467 4.7738 4.8841 4.9043 4.9496 4.9604 5.0874 5.1176 5.3230 5.3484 5.3509 5.4003 5.4979 5.4993 6.0397 6.0556 6.1781 6.1850 6.5365 6.5582 6.6220 6.6270 6.7306 6.7409 6.8969 6.9102 7.1285 7.1308 7.4177 7.4211 7.6693 7.6697 7.9084 7.9150 8.0687 8.0720 10.4242 10.4323 12.2347 12.2493 12.6163 12.6233 13.2922 13.3171 13.7891 13.8113 14.1907 14.1964 k = 0.1592 0.2599-0.0000 ( 3802 PWs) bands (ev): -5.0774 -5.0773 -4.6814 -4.6807 2.3879 2.3914 2.7327 2.7377 3.0208 3.0242 3.3171 3.3306 4.1323 4.1363 4.2750 4.2994 4.4284 4.4548 4.5319 4.5732 4.7564 4.7789 4.8982 4.9134 4.9578 4.9755 5.1142 5.1381 5.3261 5.3484 5.3529 5.4002 5.5056 5.5083 6.0466 6.0620 6.1717 6.1774 6.5333 6.5497 6.6165 6.6199 6.7265 6.7361 6.9237 6.9341 7.0838 7.0888 7.4298 7.4366 7.6329 7.6333 7.8521 7.8595 8.0116 8.0150 10.4809 10.4890 12.1474 12.1604 12.7302 12.7356 13.2743 13.3008 13.7279 13.7517 14.0757 14.0815 k = 0.1655 0.2703-0.0000 ( 3802 PWs) bands (ev): -5.0556 -5.0555 -4.6635 -4.6628 2.3959 2.4001 2.6939 2.6995 2.9956 2.9992 3.3004 3.3140 4.1248 4.1302 4.2692 4.2918 4.4304 4.4525 4.5285 4.5761 4.7658 4.7836 4.9129 4.9216 4.9660 4.9903 5.1419 5.1583 5.3298 5.3488 5.3549 5.4010 5.5133 5.5195 6.0515 6.0661 6.1682 6.1724 6.5257 6.5373 6.6115 6.6134 6.7217 6.7313 6.9426 6.9537 7.0504 7.0542 7.4422 7.4510 7.6005 7.6006 7.7955 7.8038 7.9547 7.9583 10.5414 10.5494 12.0502 12.0624 12.8486 12.8536 13.2576 13.2858 13.6707 13.6960 13.9669 13.9729 k = 0.1719 0.2806-0.0000 ( 3806 PWs) bands (ev): -5.0338 -5.0337 -4.6458 -4.6450 2.4036 2.4085 2.6563 2.6626 2.9685 2.9721 3.2863 3.3001 4.1172 4.1238 4.2626 4.2831 4.4312 4.4498 4.5273 4.5795 4.7748 4.7879 4.9277 4.9288 4.9740 5.0043 5.1701 5.1781 5.3342 5.3497 5.3567 5.4027 5.5224 5.5313 6.0548 6.0681 6.1675 6.1700 6.5136 6.5212 6.6068 6.6078 6.7163 6.7264 6.9341 6.9506 7.0455 7.0475 7.4533 7.4629 7.5722 7.5730 7.7391 7.7485 7.8984 7.9022 10.6054 10.6133 11.9475 11.9592 12.9675 12.9728 13.2423 13.2721 13.6175 13.6444 13.8645 13.8710 k = 0.1783 0.2910-0.0000 ( 3806 PWs) bands (ev): -5.0120 -5.0119 -4.6282 -4.6274 2.4108 2.4166 2.6204 2.6275 2.9402 2.9439 3.2743 3.2883 4.1096 4.1172 4.2551 4.2735 4.4310 4.4469 4.5281 4.5834 4.7835 4.7920 4.9352 4.9421 4.9816 5.0175 5.1974 5.1990 5.3393 5.3510 5.3585 5.4053 5.5328 5.5438 6.0568 6.0687 6.1692 6.1700 6.4976 6.5022 6.6021 6.6029 6.7103 6.7213 6.9002 6.9203 7.0679 7.0738 7.4615 7.4698 7.5489 7.5527 7.6832 7.6943 7.8430 7.8468 10.6729 10.6808 11.8408 11.8523 13.0851 13.0915 13.2283 13.2599 13.5685 13.5970 13.7682 13.7756 k = 0.1846 0.3014-0.0000 ( 3814 PWs) bands (ev): -4.9904 -4.9903 -4.6109 -4.6101 2.4173 2.4243 2.5863 2.5945 2.9115 2.9152 3.2635 3.2777 4.1018 4.1103 4.2470 4.2631 4.4298 4.4440 4.5309 4.5877 4.7918 4.7961 4.9408 4.9558 4.9884 5.0297 5.2162 5.2281 5.3452 5.3530 5.3601 5.4086 5.5445 5.5567 6.0582 6.0686 6.1718 6.1726 6.4783 6.4809 6.5974 6.5984 6.7036 6.7160 6.8585 6.8813 7.1027 7.1113 7.4641 7.4680 7.5323 7.5427 7.6284 7.6422 7.7886 7.7925 10.7437 10.7515 11.7314 11.7426 13.1989 13.2070 13.2173 13.2500 13.5239 13.5538 13.6779 13.6874 k = 0.1910 0.3118-0.0000 ( 3818 PWs) bands (ev): -4.9691 -4.9690 -4.5939 -4.5932 2.4227 2.4313 2.5547 2.5643 2.8831 2.8869 3.2533 3.2677 4.0940 4.1033 4.2382 4.2520 4.4279 4.4411 4.5353 4.5923 4.7997 4.8002 4.9457 4.9684 4.9945 5.0407 5.2342 5.2574 5.3516 5.3556 5.3615 5.4125 5.5576 5.5701 6.0596 6.0688 6.1748 6.1767 6.4567 6.4580 6.5924 6.5940 6.6958 6.7102 6.8155 6.8414 7.1424 7.1533 7.4572 7.4588 7.5219 7.5431 7.5753 7.5950 7.7356 7.7396 10.8177 10.8255 11.6198 11.6308 13.2043 13.2381 13.3099 13.3233 13.4840 13.5148 13.5936 13.6081 k = 0.1974 0.3222-0.0000 ( 3818 PWs) bands (ev): -4.9481 -4.9480 -4.5774 -4.5766 2.4263 2.4369 2.5262 2.5376 2.8556 2.8593 3.2433 3.2579 4.0861 4.0961 4.2290 4.2404 4.4254 4.4381 4.5410 4.5972 4.8043 4.8072 4.9499 4.9797 4.9997 5.0506 5.2515 5.2867 5.3575 5.3601 5.3629 5.4168 5.5719 5.5839 6.0619 6.0698 6.1784 6.1809 6.4335 6.4340 6.5870 6.5892 6.6862 6.7033 6.7740 6.8033 7.1843 7.1974 7.4417 7.4472 7.5070 7.5245 7.5492 7.5625 7.6843 7.6883 10.8949 10.9026 11.5069 11.5177 13.1948 13.2306 13.3965 13.4318 13.4504 13.4798 13.5171 13.5502 k = 0.2037 0.3326-0.0000 ( 3834 PWs) bands (ev): -4.9275 -4.9274 -4.5614 -4.5606 2.4266 2.4392 2.5030 2.5161 2.8292 2.8329 3.2332 3.2479 4.0781 4.0887 4.2194 4.2284 4.4225 4.4351 4.5476 4.6022 4.8083 4.8143 4.9534 4.9894 5.0042 5.0592 5.2678 5.3157 5.3618 5.3643 5.3675 5.4212 5.5873 5.5980 6.0652 6.0720 6.1818 6.1846 6.4096 6.4098 6.5807 6.5835 6.6739 6.6934 6.7367 6.7691 7.2260 7.2412 7.4244 7.4320 7.4766 7.4787 7.5537 7.5569 7.6353 7.6390 10.9750 10.9827 11.3932 11.4038 13.1871 13.2242 13.4012 13.4217 13.4342 13.4507 13.5455 13.5743 k = 0.2101 0.3430-0.0000 ( 3830 PWs) bands (ev): -4.9074 -4.9073 -4.5460 -4.5452 2.4220 2.4344 2.4889 2.5016 2.8044 2.8080 3.2229 3.2377 4.0700 4.0811 4.2097 4.2164 4.4194 4.4321 4.5550 4.6074 4.8125 4.8211 4.9561 4.9975 5.0080 5.0668 5.2832 5.3440 5.3660 5.3664 5.3761 5.4259 5.6036 5.6123 6.0699 6.0757 6.1848 6.1873 6.3859 6.3862 6.5729 6.5761 6.6583 6.6751 6.7103 6.7408 7.2626 7.2788 7.4067 7.4132 7.4431 7.4483 7.5540 7.5644 7.5908 7.5928 11.0580 11.0656 11.2794 11.2897 13.1811 13.2192 13.3527 13.3668 13.3896 13.4239 13.6443 13.6583 k = 0.2165 0.3534-0.0000 ( 3830 PWs) bands (ev): -4.8879 -4.8878 -4.5312 -4.5304 2.4117 2.4210 2.4857 2.4949 2.7812 2.7848 3.2123 3.2271 4.0617 4.0733 4.1999 4.2043 4.4163 4.4291 4.5628 4.6128 4.8166 4.8275 4.9579 5.0037 5.0112 5.0733 5.2974 5.3647 5.3716 5.3746 5.3854 5.4307 5.6207 5.6266 6.0760 6.0806 6.1866 6.1884 6.3634 6.3640 6.5620 6.5653 6.6402 6.6486 6.6964 6.7192 7.2814 7.2930 7.3931 7.3946 7.4298 7.4373 7.5385 7.5471 7.5688 7.5746 11.1437 11.1510 11.1660 11.1763 13.1770 13.2157 13.2932 13.3020 13.3662 13.4017 13.7367 13.7458 k = 0.2228 0.3638-0.0000 ( 3826 PWs) bands (ev): -4.8690 -4.8690 -4.5171 -4.5163 2.3980 2.4037 2.4886 2.4940 2.7597 2.7634 3.2013 3.2160 4.0533 4.0652 4.1901 4.1924 4.4129 4.4259 4.5709 4.6181 4.8207 4.8334 4.9587 5.0081 5.0141 5.0788 5.3105 5.3673 5.3776 5.3951 5.4003 5.4357 5.6384 5.6408 6.0832 6.0867 6.1868 6.1873 6.3431 6.3444 6.5457 6.5489 6.6237 6.6249 6.6866 6.7029 7.2693 7.2729 7.3797 7.3830 7.4457 7.4494 7.5089 7.5124 7.5714 7.5809 11.0534 11.0630 11.2322 11.2398 13.1748 13.2134 13.2349 13.2414 13.3480 13.3834 13.8197 13.8263 k = 0.2292 0.3742-0.0000 ( 3826 PWs) bands (ev): -4.8509 -4.8509 -4.5038 -4.5030 2.3834 2.3865 2.4939 2.4963 2.7402 2.7437 3.1900 3.2046 4.0446 4.0568 4.1804 4.1808 4.4095 4.4227 4.5792 4.6235 4.8246 4.8388 4.9583 5.0107 5.0167 5.0833 5.3223 5.3687 5.3842 5.4051 5.4254 5.4413 5.6550 5.6564 6.0912 6.0934 6.1837 6.1848 6.3260 6.3280 6.5234 6.5266 6.6087 6.6116 6.6775 6.6897 7.2368 7.2375 7.3625 7.3698 7.4425 7.4545 7.5155 7.5179 7.5767 7.5871 10.9424 10.9517 11.3231 11.3307 13.1722 13.1783 13.1872 13.2137 13.3345 13.3691 13.8908 13.8958 k = 0.2356 0.3846-0.0000 ( 3830 PWs) bands (ev): -4.8336 -4.8335 -4.4913 -4.4906 2.3696 2.3709 2.5000 2.5002 2.7224 2.7259 3.1787 3.1930 4.0357 4.0481 4.1696 4.1710 4.4060 4.4193 4.5875 4.6288 4.8284 4.8437 4.9567 5.0114 5.0193 5.0871 5.3331 5.3698 5.3915 5.4150 5.4428 5.4533 5.6689 5.6745 6.0992 6.1001 6.1773 6.1803 6.3132 6.3155 6.4977 6.5007 6.5988 6.6038 6.6681 6.6780 7.1966 7.1994 7.3420 7.3512 7.4197 7.4296 7.5559 7.5663 7.5852 7.5932 10.8333 10.8422 11.4164 11.4240 13.1260 13.1298 13.1787 13.2142 13.3257 13.3586 13.9480 13.9518 k = 0.2419 0.3950-0.0000 ( 3830 PWs) bands (ev): -4.8171 -4.8170 -4.4797 -4.4790 2.3574 2.3576 2.5048 2.5065 2.7063 2.7099 3.1675 3.1815 4.0265 4.0389 4.1590 4.1618 4.4024 4.4158 4.5957 4.6340 4.8320 4.8480 4.9537 5.0104 5.0220 5.0901 5.3429 5.3708 5.3994 5.4245 5.4493 5.4746 5.6827 5.6927 6.1060 6.1065 6.1686 6.1735 6.3052 6.3073 6.4723 6.4742 6.5926 6.5988 6.6584 6.6670 7.1560 7.1599 7.3177 7.3264 7.4001 7.4068 7.5786 7.5947 7.6212 7.6268 10.7266 10.7352 11.5120 11.5196 13.0771 13.0808 13.1827 13.2161 13.3216 13.3518 13.9896 13.9925 k = 0.2483 0.4054-0.0000 ( 3834 PWs) bands (ev): -4.8015 -4.8015 -4.4691 -4.4684 2.3464 2.3478 2.5097 2.5131 2.6918 2.6954 3.1567 3.1703 4.0170 4.0294 4.1489 4.1530 4.3987 4.4121 4.6038 4.6390 4.8354 4.8517 4.9495 5.0077 5.0248 5.0924 5.3517 5.3716 5.4077 5.4336 5.4549 5.4949 5.6965 5.7106 6.1101 6.1119 6.1583 6.1652 6.3018 6.3031 6.4494 6.4495 6.5887 6.5953 6.6482 6.6564 7.1162 7.1209 7.2901 7.2972 7.3861 7.3892 7.5837 7.5987 7.6780 7.6869 10.6230 10.6311 11.6098 11.6174 13.0315 13.0350 13.1890 13.2192 13.3222 13.3488 14.0148 14.0170 k = 0.2547 0.4158-0.0000 ( 3838 PWs) bands (ev): -4.7868 -4.7868 -4.4593 -4.4586 2.3380 2.3405 2.5146 2.5196 2.6786 2.6822 3.1468 3.1599 4.0071 4.0193 4.1395 4.1447 4.3950 4.4084 4.6117 4.6438 4.8383 4.8547 4.9442 5.0034 5.0276 5.0941 5.3595 5.3722 5.4165 5.4420 5.4605 5.5127 5.7105 5.7282 6.1113 6.1143 6.1474 6.1565 6.3027 6.3029 6.4279 6.4305 6.5860 6.5927 6.6375 6.6460 7.0779 7.0830 7.2609 7.2666 7.3756 7.3757 7.5864 7.6012 7.7385 7.7491 10.5229 10.5306 11.7095 11.7171 12.9894 12.9926 13.1974 13.2232 13.3275 13.3495 14.0240 14.0257 k = 0.2610 0.4262-0.0000 ( 3836 PWs) bands (ev): -4.7732 -4.7732 -4.4506 -4.4499 2.3323 2.3357 2.5194 2.5259 2.6664 2.6701 3.1382 3.1507 3.9968 4.0087 4.1309 4.1369 4.3913 4.4047 4.6193 4.6483 4.8408 4.8569 4.9379 4.9977 5.0304 5.0953 5.3660 5.3724 5.4257 5.4499 5.4663 5.5278 5.7248 5.7453 6.1088 6.1128 6.1369 6.1486 6.3062 6.3078 6.4107 6.4164 6.5844 6.5905 6.6265 6.6361 7.0414 7.0467 7.2317 7.2363 7.3650 7.3673 7.5880 7.6027 7.8002 7.8121 10.4268 10.4342 11.8109 11.8185 12.9506 12.9537 13.2074 13.2284 13.3372 13.3540 14.0179 14.0193 k = 0.2674 0.4366-0.0000 ( 3826 PWs) bands (ev): -4.7605 -4.7605 -4.4428 -4.4422 2.3292 2.3337 2.5239 2.5320 2.6551 2.6587 3.1315 3.1432 3.9860 3.9975 4.1231 4.1297 4.3875 4.4008 4.6266 4.6525 4.8428 4.8582 4.9307 4.9907 5.0331 5.0959 5.3709 5.3722 5.4349 5.4579 5.4722 5.5401 5.7398 5.7617 6.1012 6.1068 6.1289 6.1422 6.3133 6.3159 6.3983 6.4070 6.5833 6.5884 6.6155 6.6271 7.0068 7.0122 7.2032 7.2071 7.3562 7.3604 7.5887 7.6032 7.8622 7.8751 10.3356 10.3425 11.9139 11.9215 12.9152 12.9182 13.2188 13.2347 13.3510 13.3623 13.9979 13.9992 k = 0.2738 0.4470-0.0000 ( 3828 PWs) bands (ev): -4.7490 -4.7489 -4.4361 -4.4355 2.3288 2.3343 2.5279 2.5377 2.6441 2.6478 3.1271 3.1381 3.9748 3.9857 4.1160 4.1230 4.3836 4.3969 4.6334 4.6563 4.8441 4.8583 4.9229 4.9825 5.0357 5.0961 5.3716 5.3738 5.4438 5.4666 5.4780 5.5496 5.7553 5.7773 6.0881 6.0964 6.1247 6.1380 6.3231 6.3260 6.3913 6.4019 6.5820 6.5853 6.6053 6.6196 6.9742 6.9797 7.1760 7.1793 7.3486 7.3544 7.5886 7.6029 7.9234 7.9370 10.2498 10.2563 12.0182 12.0257 12.8832 12.8861 13.2315 13.2423 13.3687 13.3744 13.9656 13.9667 k = 0.2801 0.4574-0.0000 ( 3824 PWs) bands (ev): -4.7384 -4.7384 -4.4304 -4.4297 2.3310 2.3377 2.5311 2.5428 2.6335 2.6372 3.1256 3.1358 3.9630 3.9732 4.1098 4.1170 4.3797 4.3929 4.6397 4.6596 4.8446 4.8571 4.9146 4.9733 5.0382 5.0959 5.3702 5.3743 5.4521 5.4766 5.4837 5.5568 5.7716 5.7921 6.0714 6.0825 6.1239 6.1364 6.3348 6.3363 6.3903 6.4008 6.5784 6.5805 6.5982 6.6148 6.9438 6.9492 7.1504 7.1533 7.3421 7.3491 7.5876 7.6018 7.9828 7.9972 10.1702 10.1763 12.1234 12.1309 12.8546 12.8575 13.2451 13.2513 13.3898 13.3904 13.9222 13.9233 k = 0.2865 0.4677-0.0000 ( 3830 PWs) bands (ev): -4.7290 -4.7289 -4.4257 -4.4251 2.3357 2.3436 2.5332 2.5468 2.6230 2.6268 3.1276 3.1369 3.9507 3.9601 4.1044 4.1117 4.3757 4.3888 4.6455 4.6624 4.8442 4.8543 4.9062 4.9633 5.0405 5.0953 5.3680 5.3721 5.4600 5.4881 5.4889 5.5625 5.7883 5.8056 6.0532 6.0660 6.1259 6.1373 6.3446 6.3469 6.3960 6.4034 6.5706 6.5740 6.5963 6.6127 6.9156 6.9209 7.1264 7.1289 7.3363 7.3444 7.5859 7.5999 8.0395 8.0545 10.0978 10.1035 12.2293 12.2367 12.8295 12.8324 13.2596 13.2616 13.4100 13.4142 13.8690 13.8700 k = 0.2929 0.4781-0.0000 ( 3834 PWs) bands (ev): -4.7206 -4.7205 -4.4219 -4.4213 2.3428 2.3522 2.5334 2.5489 2.6131 2.6171 3.1334 3.1419 3.9378 3.9463 4.0998 4.1071 4.3717 4.3847 4.6507 4.6647 4.8428 4.8498 4.8979 4.9525 5.0427 5.0945 5.3648 5.3674 5.4674 5.4936 5.5009 5.5673 5.8053 5.8178 6.0350 6.0485 6.1304 6.1405 6.3503 6.3582 6.4078 6.4097 6.5604 6.5664 6.5982 6.6133 6.8897 6.8948 7.1042 7.1063 7.3312 7.3402 7.5834 7.5972 8.0922 8.1077 10.0336 10.0389 12.3352 12.3425 12.8079 12.8108 13.2735 13.2748 13.4328 13.4413 13.8073 13.8081 k = 0.2992 0.4885-0.0000 ( 3842 PWs) bands (ev): -4.7133 -4.7132 -4.4192 -4.4186 2.3523 2.3634 2.5308 2.5477 2.6044 2.6094 3.1434 3.1511 3.9242 3.9318 4.0960 4.1032 4.3676 4.3805 4.6552 4.6663 4.8402 4.8433 4.8898 4.9413 5.0448 5.0937 5.3604 5.3604 5.4743 5.4975 5.5149 5.5721 5.8221 5.8284 6.0179 6.0307 6.1371 6.1457 6.3545 6.3679 6.4194 6.4235 6.5498 6.5585 6.6023 6.6157 6.8662 6.8710 7.0838 7.0855 7.3267 7.3366 7.5802 7.5937 8.1398 8.1558 9.9786 9.9835 12.4407 12.4478 12.7900 12.7930 13.2867 13.2908 13.4583 13.4708 13.7383 13.7387 k = 0.3056 0.4989-0.0000 ( 3842 PWs) bands (ev): -4.7069 -4.7069 -4.4174 -4.4168 2.3638 2.3769 2.5244 2.5416 2.5979 2.6054 3.1577 3.1646 3.9101 3.9166 4.0930 4.1000 4.3636 4.3763 4.6591 4.6673 4.8350 4.8363 4.8821 4.9297 5.0468 5.0928 5.3516 5.3548 5.4809 5.5005 5.5298 5.5774 5.8368 5.8384 6.0030 6.0138 6.1458 6.1527 6.3582 6.3759 6.4315 6.4411 6.5398 6.5509 6.6083 6.6199 6.8450 6.8497 7.0651 7.0664 7.3230 7.3335 7.5763 7.5895 8.1808 8.1972 9.9339 9.9383 12.5450 12.5518 12.7759 12.7790 13.3014 13.3075 13.4850 13.5020 13.6629 13.6640 k = 0.3120 0.5093-0.0000 ( 3846 PWs) bands (ev): -4.7017 -4.7016 -4.4165 -4.4159 2.3771 2.3928 2.5134 2.5301 2.5941 2.6053 3.1764 3.1826 3.8954 3.9007 4.0909 4.0976 4.3595 4.3721 4.6621 4.6675 4.8250 4.8311 4.8745 4.9180 5.0488 5.0919 5.3416 5.3481 5.4866 5.5027 5.5453 5.5833 5.8426 5.8534 5.9912 5.9986 6.1564 6.1613 6.3621 6.3829 6.4444 6.4591 6.5310 6.5442 6.6160 6.6256 6.8262 6.8307 7.0482 7.0490 7.3199 7.3310 7.5716 7.5846 8.2140 8.2308 9.9006 9.9045 12.6471 12.6536 12.7657 12.7689 13.3173 13.3250 13.5063 13.5306 13.5856 13.5916 k = 0.3183 0.5197-0.0000 ( 3854 PWs) bands (ev): -4.6973 -4.6972 -4.4164 -4.4159 2.3919 2.4109 2.4984 2.5145 2.5929 2.6085 3.1993 3.2050 3.8800 3.8840 4.0895 4.0961 4.3555 4.3679 4.6643 4.6670 4.8137 4.8244 4.8670 4.9064 5.0509 5.0912 5.3306 5.3401 5.4914 5.5041 5.5613 5.5900 5.8453 5.8663 5.9832 5.9863 6.1684 6.1711 6.3666 6.3893 6.4567 6.4768 6.5241 6.5385 6.6256 6.6331 6.8098 6.8142 7.0330 7.0332 7.3175 7.3291 7.5663 7.5789 8.2384 8.2555 9.8794 9.8828 12.7459 12.7490 12.7625 12.7631 13.3343 13.3427 13.4736 13.4867 13.5703 13.5774 k = 0.3247 0.5301-0.0000 ( 3854 PWs) bands (ev): -4.6940 -4.6939 -4.4172 -4.4167 2.4073 2.4308 2.4802 2.4967 2.5933 2.6137 3.2264 3.2315 3.8640 3.8668 4.0889 4.0953 4.3516 4.3637 4.6656 4.6656 4.8013 4.8164 4.8594 4.8950 5.0530 5.0906 5.3191 5.3312 5.4950 5.5046 5.5774 5.5974 5.8449 5.8756 5.9781 5.9795 6.1819 6.1822 6.3719 6.3956 6.4673 6.4934 6.5199 6.5342 6.6371 6.6424 6.7958 6.8001 7.0190 7.0194 7.3160 7.3280 7.5603 7.5726 8.2533 8.2706 9.8706 9.8735 12.7566 12.7612 12.8400 12.8462 13.3486 13.3533 13.3984 13.4015 13.5963 13.6111 k = 0.3311 0.5405-0.0000 ( 3850 PWs) bands (ev): -4.6915 -4.6914 -4.4188 -4.4183 2.4214 2.4511 2.4614 2.4792 2.5948 2.6204 3.2572 3.2619 3.8474 3.8488 4.0892 4.0953 4.3478 4.3595 4.6633 4.6658 4.7881 4.8069 4.8519 4.8840 5.0553 5.0903 5.3076 5.3216 5.4971 5.5043 5.5936 5.6053 5.8416 5.8800 5.9757 5.9797 6.1942 6.1963 6.3781 6.4020 6.4753 6.5083 6.5193 6.5316 6.6505 6.6538 6.7841 6.7885 7.0063 7.0074 7.3155 7.3278 7.5537 7.5655 8.2584 8.2760 9.8743 9.8765 12.7588 12.7639 12.9268 12.9323 13.2871 13.2947 13.3807 13.3920 13.6285 13.6468 k = 0.3374 0.5509-0.0000 ( 3852 PWs) bands (ev): -4.6899 -4.6897 -4.4210 -4.4206 2.4267 2.4364 2.4698 2.4775 2.5969 2.6286 3.2916 3.2959 3.8302 3.8302 4.0901 4.0962 4.3441 4.3553 4.6600 4.6650 4.7743 4.7962 4.8444 4.8736 5.0576 5.0901 5.2962 5.3115 5.4977 5.5029 5.6094 5.6134 5.8363 5.8790 5.9793 5.9831 6.2071 6.2116 6.3853 6.4084 6.4808 6.5204 6.5225 6.5317 6.6654 6.6670 6.7748 6.7793 6.9949 6.9968 7.3161 7.3286 7.5464 7.5578 8.2541 8.2718 9.8895 9.8912 12.7647 12.7709 13.0020 13.0075 13.1934 13.2005 13.4009 13.4130 13.6615 13.6824 k = 0.3438 0.5613-0.0000 ( 3836 PWs) bands (ev): -4.6890 -4.6889 -4.4239 -4.4235 2.4132 2.4141 2.4776 2.5026 2.5992 2.6382 3.3291 3.3332 3.8110 3.8124 4.0919 4.0979 4.3406 4.3513 4.6558 4.6630 4.7600 4.7846 4.8372 4.8638 5.0601 5.0901 5.2853 5.3013 5.4966 5.5005 5.6217 5.6247 5.8299 5.8741 5.9876 5.9889 6.2208 6.2275 6.3936 6.4151 6.4851 6.5266 6.5283 6.5379 6.6817 6.6821 6.7679 6.7725 6.9850 6.9877 7.3180 7.3307 7.5384 7.5494 8.2412 8.2590 9.9152 9.9162 12.7735 12.7817 13.0385 13.0489 13.1231 13.1255 13.4244 13.4370 13.6934 13.7169 k = 0.3438 0.5613-0.0000 ( 3836 PWs) bands (ev): -4.6890 -4.6889 -4.4239 -4.4235 2.4132 2.4141 2.4776 2.5026 2.5992 2.6382 3.3291 3.3332 3.8110 3.8124 4.0919 4.0979 4.3406 4.3513 4.6558 4.6630 4.7600 4.7846 4.8372 4.8638 5.0601 5.0901 5.2853 5.3013 5.4966 5.5005 5.6217 5.6247 5.8299 5.8741 5.9876 5.9889 6.2208 6.2275 6.3936 6.4151 6.4851 6.5266 6.5283 6.5379 6.6817 6.6821 6.7679 6.7725 6.9850 6.9877 7.3180 7.3307 7.5384 7.5494 8.2412 8.2590 9.9152 9.9162 12.7735 12.7817 13.0385 13.0489 13.1231 13.1255 13.4244 13.4370 13.6934 13.7169 k = 0.3315 0.5613-0.0000 ( 3843 PWs) bands (ev): -4.6897 -4.6895 -4.4225 -4.4221 2.4140 2.4252 2.4728 2.4964 2.5978 2.6333 3.3092 3.3135 3.8215 3.8227 4.0912 4.0973 4.3423 4.3533 4.6577 4.6644 4.7675 4.7910 4.8410 4.8691 5.0585 5.0900 5.2910 5.3068 5.4966 5.5011 5.6146 5.6186 5.8332 5.8767 5.9829 5.9859 6.2146 6.2203 6.3896 6.4120 6.4831 6.5235 6.5256 6.5342 6.6722 6.6749 6.7719 6.7768 6.9909 6.9931 7.3170 7.3296 7.5418 7.5531 8.2486 8.2663 9.9018 9.9032 12.7666 12.7737 13.0248 13.0318 13.1499 13.1565 13.4131 13.4246 13.6804 13.7020 k = 0.3192 0.5613-0.0000 ( 3843 PWs) bands (ev): -4.6911 -4.6909 -4.4217 -4.4213 2.4033 2.4219 2.4763 2.5059 2.5961 2.6299 3.2908 3.2955 3.8326 3.8346 4.0913 4.0977 4.3440 4.3551 4.6586 4.6659 4.7748 4.7977 4.8450 4.8749 5.0563 5.0896 5.2969 5.3124 5.4946 5.4998 5.6050 5.6134 5.8359 5.8779 5.9794 5.9838 6.2107 6.2156 6.3867 6.4099 6.4813 6.5184 6.5243 6.5325 6.6631 6.6684 6.7781 6.7839 6.9988 7.0005 7.3166 7.3291 7.5434 7.5549 8.2529 8.2706 9.8931 9.8949 12.7566 12.7630 12.9872 12.9935 13.1796 13.1893 13.4084 13.4171 13.6738 13.6927 k = 0.3069 0.5613-0.0000 ( 3847 PWs) bands (ev): -4.6932 -4.6931 -4.4215 -4.4210 2.3867 2.4055 2.4886 2.5223 2.5942 2.6279 3.2742 3.2796 3.8444 3.8476 4.0923 4.0992 4.3455 4.3568 4.6584 4.6673 4.7817 4.8046 4.8492 4.8811 5.0535 5.0890 5.3028 5.3180 5.4907 5.4964 5.5948 5.6074 5.8382 5.8778 5.9770 5.9825 6.2090 6.2136 6.3850 6.4087 6.4794 6.5126 6.5234 6.5326 6.6544 6.6623 6.7866 6.7933 7.0087 7.0099 7.3168 7.3293 7.5429 7.5548 8.2546 8.2722 9.8886 9.8909 12.7442 12.7502 12.9406 12.9471 13.1905 13.2030 13.4146 13.4216 13.6739 13.6899 k = 0.2947 0.5613-0.0000 ( 3841 PWs) bands (ev): -4.6959 -4.6958 -4.4217 -4.4213 2.3673 2.3843 2.5024 2.5401 2.5924 2.6277 3.2599 3.2661 3.8573 3.8616 4.0944 4.1021 4.3469 4.3582 4.6576 4.6686 4.7882 4.8115 4.8534 4.8877 5.0502 5.0883 5.3087 5.3234 5.4848 5.4910 5.5845 5.6006 5.8400 5.8767 5.9753 5.9817 6.2097 6.2143 6.3844 6.4085 6.4768 6.5069 6.5233 6.5342 6.6465 6.6569 6.7975 6.8053 7.0208 7.0215 7.3175 7.3299 7.5405 7.5527 8.2540 8.2716 9.8878 9.8904 12.7300 12.7358 12.8880 12.8948 13.1786 13.1922 13.4306 13.4403 13.6808 13.6950 k = 0.2824 0.5613-0.0000 ( 3845 PWs) bands (ev): -4.6992 -4.6991 -4.4224 -4.4219 2.3465 2.3614 2.5145 2.5559 2.5918 2.6294 3.2480 3.2551 3.8712 3.8767 4.0976 4.1063 4.3482 4.3594 4.6564 4.6697 4.7945 4.8184 4.8577 4.8947 5.0465 5.0873 5.3142 5.3285 5.4769 5.4834 5.5744 5.5931 5.8413 5.8751 5.9741 5.9813 6.2125 6.2174 6.3846 6.4090 6.4729 6.5011 6.5243 6.5370 6.6394 6.6520 6.8109 6.8194 7.0350 7.0355 7.3186 7.3309 7.5361 7.5487 8.2515 8.2689 9.8899 9.8928 12.7144 12.7203 12.8303 12.8371 13.1483 13.1611 13.4516 13.4657 13.6944 13.7094 k = 0.2701 0.5613-0.0000 ( 3844 PWs) bands (ev): -4.7030 -4.7029 -4.4235 -4.4230 2.3248 2.3378 2.5237 2.5660 2.5954 2.6329 3.2387 3.2467 3.8864 3.8929 4.1019 4.1120 4.3494 4.3603 4.6547 4.6706 4.8004 4.8251 4.8619 4.9017 5.0425 5.0861 5.3192 5.3330 5.4668 5.4738 5.5646 5.5851 5.8424 5.8731 5.9733 5.9811 6.2173 6.2225 6.3857 6.4102 6.4677 6.4953 6.5270 6.5410 6.6331 6.6478 6.8267 6.8359 7.0515 7.0523 7.3200 7.3322 7.5297 7.5428 8.2475 8.2648 9.8941 9.8973 12.6974 12.7039 12.7679 12.7746 13.1046 13.1156 13.4722 13.4903 13.7157 13.7331 k = 0.2578 0.5613-0.0000 ( 3842 PWs) bands (ev): -4.7072 -4.7071 -4.4249 -4.4245 2.3025 2.3139 2.5299 2.5681 2.6047 2.6379 3.2320 3.2410 3.9030 3.9103 4.1075 4.1193 4.3505 4.3610 4.6528 4.6712 4.8060 4.8314 4.8661 4.9089 5.0381 5.0847 5.3237 5.3367 5.4544 5.4626 5.5554 5.5770 5.8434 5.8713 5.9727 5.9810 6.2239 6.2294 6.3872 6.4118 6.4614 6.4891 6.5314 6.5461 6.6278 6.6440 6.8449 6.8545 7.0705 7.0718 7.3218 7.3338 7.5214 7.5351 8.2425 8.2596 9.8998 9.9033 12.6760 12.6859 12.7033 12.7095 13.0500 13.0592 13.4896 13.5107 13.7456 13.7655 k = 0.2456 0.5613-0.0000 ( 3840 PWs) bands (ev): -4.7118 -4.7117 -4.4267 -4.4263 2.2800 2.2900 2.5331 2.5657 2.6160 2.6436 3.2278 3.2378 3.9210 3.9289 4.1144 4.1284 4.3515 4.3616 4.6506 4.6717 4.8114 4.8374 4.8700 4.9159 5.0335 5.0832 5.3273 5.3395 5.4395 5.4501 5.5469 5.5690 5.8445 5.8696 5.9722 5.9809 6.2319 6.2377 6.3890 6.4137 6.4544 6.4825 6.5375 6.5522 6.6234 6.6407 6.8653 6.8751 7.0924 7.0942 7.3238 7.3357 7.5113 7.5257 8.2368 8.2537 9.9064 9.9100 12.6230 12.6323 12.6687 12.6714 12.9862 12.9938 13.5028 13.5256 13.7844 13.8056 k = 0.2333 0.5613-0.0000 ( 3834 PWs) bands (ev): -4.7167 -4.7166 -4.4288 -4.4283 2.2574 2.2662 2.5341 2.5616 2.6265 2.6492 3.2259 3.2368 3.9406 3.9487 4.1227 4.1395 4.3526 4.3620 4.6483 4.6721 4.8164 4.8428 4.8737 4.9227 5.0287 5.0815 5.3299 5.3410 5.4225 5.4364 5.5391 5.5613 5.8456 5.8683 5.9719 5.9808 6.2411 6.2470 6.3906 6.4155 6.4473 6.4756 6.5449 6.5594 6.6199 6.6378 6.8877 6.8975 7.1174 7.1198 7.3259 7.3379 7.4994 7.5149 8.2309 8.2475 9.9133 9.9171 12.5487 12.5566 12.6491 12.6525 12.9140 12.9204 13.5118 13.5351 13.8319 13.8533 k = 0.2210 0.5613-0.0000 ( 3834 PWs) bands (ev): -4.7218 -4.7217 -4.4311 -4.4306 2.2350 2.2426 2.5333 2.5567 2.6351 2.6542 3.2260 3.2377 3.9617 3.9699 4.1323 4.1526 4.3538 4.3623 4.6458 4.6724 4.8212 4.8477 4.8769 4.9290 5.0238 5.0796 5.3312 5.3409 5.4038 5.4218 5.5321 5.5542 5.8470 5.8675 5.9717 5.9806 6.2510 6.2571 6.3916 6.4167 6.4408 6.4687 6.5536 6.5674 6.6174 6.6352 6.9117 6.9214 7.1457 7.1484 7.3281 7.3405 7.4860 7.5030 8.2249 8.2413 9.9200 9.9240 12.4691 12.4766 12.6303 12.6341 12.8343 12.8400 13.5166 13.5395 13.8882 13.9088 k = 0.2087 0.5613-0.0000 ( 3825 PWs) bands (ev): -4.7270 -4.7269 -4.4335 -4.4331 2.2128 2.2195 2.5312 2.5513 2.6418 2.6581 3.2277 3.2400 3.9840 3.9924 4.1435 4.1679 4.3551 4.3626 4.6433 4.6727 4.8255 4.8521 4.8797 4.9348 5.0187 5.0775 5.3306 5.3390 5.3840 5.4069 5.5261 5.5478 5.8486 5.8670 5.9716 5.9805 6.2613 6.2677 6.3916 6.4162 6.4361 6.4623 6.5631 6.5762 6.6158 6.6330 6.9370 6.9465 7.1772 7.1800 7.3301 7.3439 7.4713 7.4907 8.2192 8.2352 9.9263 9.9304 12.3860 12.3931 12.6111 12.6153 12.7481 12.7541 13.5175 13.5393 13.9533 13.9725 k = 0.1964 0.5613-0.0000 ( 3831 PWs) bands (ev): -4.7323 -4.7322 -4.4361 -4.4357 2.1910 2.1970 2.5283 2.5457 2.6467 2.6608 3.2305 3.2433 4.0069 4.0163 4.1561 4.1857 4.3566 4.3629 4.6407 4.6729 4.8294 4.8557 4.8817 4.9396 5.0135 5.0750 5.3259 5.3360 5.3642 5.3926 5.5210 5.5420 5.8504 5.8670 5.9717 5.9803 6.2717 6.2785 6.3899 6.4129 6.4341 6.4570 6.5732 6.5856 6.6154 6.6310 6.9628 6.9723 7.2116 7.2136 7.3316 7.3492 7.4556 7.4786 8.2138 8.2294 9.9318 9.9360 12.2998 12.3067 12.5894 12.5952 12.6573 12.6657 13.5150 13.5353 14.0273 14.0448 k = 0.1842 0.5613-0.0000 ( 3831 PWs) bands (ev): -4.7376 -4.7376 -4.4388 -4.4384 2.1699 2.1751 2.5247 2.5399 2.6499 2.6623 3.2341 3.2472 4.0300 4.0416 4.1703 4.2059 4.3586 4.3635 4.6380 4.6732 4.8328 4.8587 4.8831 4.9434 5.0084 5.0721 5.3146 5.3329 5.3454 5.3801 5.5168 5.5370 5.8524 5.8673 5.9720 5.9803 6.2819 6.2893 6.3864 6.4074 6.4343 6.4532 6.5833 6.5953 6.6167 6.6293 6.9890 6.9986 7.2457 7.2485 7.3321 7.3588 7.4393 7.4686 8.2089 8.2241 9.9364 9.9408 12.2114 12.2179 12.5453 12.5523 12.5853 12.5959 13.5094 13.5280 14.1102 14.1258 k = 0.1719 0.5613-0.0000 ( 3831 PWs) bands (ev): -4.7429 -4.7428 -4.4415 -4.4411 2.1495 2.1541 2.5207 2.5341 2.6516 2.6627 3.2382 3.2513 4.0527 4.0678 4.1864 4.2285 4.3612 4.3644 4.6355 4.6735 4.8355 4.8609 4.8838 4.9459 5.0033 5.0687 5.2975 5.3247 5.3322 5.3701 5.5136 5.5327 5.8547 5.8680 5.9725 5.9804 6.2916 6.2999 6.3817 6.4006 6.4354 6.4513 6.5920 6.6052 6.6207 6.6279 7.0151 7.0252 7.2731 7.2835 7.3315 7.3770 7.4233 7.4633 8.2045 8.2193 9.9401 9.9446 12.1212 12.1275 12.4565 12.4574 12.5629 12.5682 13.5015 13.5183 14.2018 14.2157 k = 0.1596 0.5613-0.0000 ( 3828 PWs) bands (ev): -4.7481 -4.7480 -4.4442 -4.4438 2.1299 2.1340 2.5164 2.5283 2.6523 2.6622 3.2424 3.2553 4.0747 4.0941 4.2046 4.2534 4.3642 4.3663 4.6330 4.6740 4.8375 4.8621 4.8837 4.9466 4.9985 5.0647 5.2772 5.3074 5.3276 5.3619 5.5114 5.5292 5.8572 5.8689 5.9732 5.9806 6.3002 6.3101 6.3765 6.3930 6.4368 6.4508 6.5976 6.6155 6.6265 6.6291 7.0410 7.0517 7.2894 7.3091 7.3332 7.4007 7.4155 7.4679 8.2008 8.2151 9.9429 9.9474 12.0299 12.0361 12.3574 12.3582 12.5450 12.5490 13.4918 13.5068 14.3021 14.3143 k = 0.1473 0.5613-0.0000 ( 3826 PWs) bands (ev): -4.7531 -4.7531 -4.4469 -4.4465 2.1114 2.1149 2.5120 2.5225 2.6520 2.6609 3.2466 3.2590 4.0958 4.1196 4.2253 4.2800 4.3670 4.3704 4.6307 4.6745 4.8384 4.8622 4.8830 4.9452 4.9942 5.0598 5.2560 5.2892 5.3232 5.3547 5.5098 5.5264 5.8599 5.8701 5.9741 5.9810 6.3072 6.3195 6.3718 6.3852 6.4383 6.4512 6.6005 6.6221 6.6311 6.6393 7.0663 7.0779 7.2949 7.3112 7.3448 7.3913 7.4538 7.4880 8.1976 8.2114 9.9447 9.9493 11.9383 11.9442 12.2574 12.2588 12.5282 12.5317 13.4809 13.4943 14.4107 14.4211 k = 0.1351 0.5613-0.0000 ( 3827 PWs) bands (ev): -4.7580 -4.7579 -4.4495 -4.4492 2.0939 2.0970 2.5076 2.5169 2.6511 2.6591 3.2504 3.2623 4.1159 4.1430 4.2487 4.3071 4.3701 4.3774 4.6285 4.6752 4.8383 4.8606 4.8817 4.9414 4.9905 5.0539 5.2355 5.2713 5.3185 5.3477 5.5090 5.5241 5.8626 5.8715 5.9751 5.9815 6.3119 6.3278 6.3681 6.3785 6.4397 6.4520 6.6021 6.6219 6.6429 6.6513 7.0909 7.1037 7.2924 7.3019 7.3537 7.3806 7.5034 7.5239 8.1950 8.2082 9.9457 9.9504 11.8471 11.8528 12.1592 12.1609 12.5123 12.5155 13.4694 13.4812 14.5270 14.5339 k = 0.1228 0.5613-0.0000 ( 3829 PWs) bands (ev): -4.7625 -4.7625 -4.4520 -4.4517 2.0776 2.0804 2.5034 2.5116 2.6497 2.6569 3.2540 3.2652 4.1346 4.1636 4.2750 4.3328 4.3743 4.3884 4.6267 4.6759 4.8367 4.8570 4.8800 4.9355 4.9874 5.0469 5.2164 5.2541 5.3136 5.3409 5.5087 5.5223 5.8653 5.8729 5.9762 5.9821 6.3138 6.3339 6.3653 6.3748 6.4411 6.4529 6.6031 6.6209 6.6562 6.6640 7.1146 7.1288 7.2833 7.2895 7.3570 7.3735 7.5568 7.5700 8.1929 8.2055 9.9461 9.9508 11.7570 11.7626 12.0644 12.0663 12.4975 12.5003 13.4579 13.4681 14.5603 14.5617 k = 0.1105 0.5613-0.0000 ( 3824 PWs) bands (ev): -4.7668 -4.7668 -4.4544 -4.4541 2.0627 2.0651 2.4992 2.5064 2.6480 2.6545 3.2571 3.2675 4.1519 4.1810 4.3038 4.3535 4.3801 4.4060 4.6252 4.6766 4.8336 4.8512 4.8778 4.9281 4.9846 5.0389 5.1996 5.2382 5.3086 5.3340 5.5089 5.5210 5.8680 5.8745 5.9774 5.9828 6.3131 6.3360 6.3644 6.3755 6.4424 6.4538 6.6039 6.6197 6.6699 6.6771 7.1367 7.1531 7.2689 7.2765 7.3572 7.3698 7.6116 7.6210 8.1913 8.2034 9.9460 9.9506 11.6693 11.6746 11.9746 11.9765 12.4837 12.4862 13.4465 13.4554 14.5474 14.5493 k = 0.0982 0.5613-0.0000 ( 3828 PWs) bands (ev): -4.7707 -4.7707 -4.4565 -4.4563 2.0491 2.0511 2.4954 2.5016 2.6463 2.6520 3.2599 3.2692 4.1676 4.1951 4.3340 4.3681 4.3879 4.4306 4.6242 4.6771 4.8282 4.8433 4.8749 4.9197 4.9820 5.0299 5.1853 5.2236 5.3037 5.3271 5.5094 5.5201 5.8707 5.8760 5.9786 5.9835 6.3104 6.3331 6.3671 6.3788 6.4435 6.4546 6.6046 6.6185 6.6836 6.6902 7.1566 7.1761 7.2525 7.2633 7.3563 7.3680 7.6662 7.6735 8.1902 8.2016 9.9454 9.9500 11.5848 11.5898 11.8911 11.8930 12.4710 12.4733 13.4358 13.4433 14.5361 14.5379 k = 0.0859 0.5613-0.0000 ( 3826 PWs) bands (ev): -4.7743 -4.7743 -4.4585 -4.4583 2.0369 2.0387 2.4919 2.4972 2.6445 2.6495 3.2622 3.2706 4.1815 4.2064 4.3636 4.3798 4.3981 4.4592 4.6239 4.6773 4.8199 4.8340 4.8713 4.9111 4.9794 5.0205 5.1739 5.2107 5.2992 5.3204 5.5101 5.5194 5.8732 5.8775 5.9798 5.9843 6.3069 6.3275 6.3720 6.3833 6.4446 6.4551 6.6053 6.6174 6.6970 6.7032 7.1723 7.1969 7.2365 7.2523 7.3550 7.3669 7.7191 7.7251 8.1896 8.2001 9.9447 9.9491 11.5050 11.5097 11.8151 11.8168 12.4597 12.4617 13.4258 13.4322 14.5263 14.5280 k = 0.0737 0.5613-0.0000 ( 3828 PWs) bands (ev): -4.7775 -4.7774 -4.4603 -4.4601 2.0263 2.0278 2.4887 2.4933 2.6428 2.6471 3.2643 3.2715 4.1936 4.2151 4.3842 4.3953 4.4133 4.4886 4.6243 4.6767 4.8079 4.8246 4.8669 4.9027 4.9770 5.0109 5.1652 5.1992 5.2953 5.3140 5.5110 5.5189 5.8755 5.8790 5.9809 5.9849 6.3032 6.3211 6.3775 6.3879 6.4455 6.4553 6.6060 6.6164 6.7100 6.7156 7.1808 7.2085 7.2284 7.2471 7.3538 7.3657 7.7688 7.7739 8.1894 8.1991 9.9438 9.9480 11.4313 11.4356 11.7474 11.7490 12.4497 12.4514 13.4169 13.4222 14.5180 14.5195 k = 0.0614 0.5613-0.0000 ( 3830 PWs) bands (ev): -4.7802 -4.7801 -4.4619 -4.4617 2.0172 2.0184 2.4860 2.4898 2.6413 2.6448 3.2660 3.2721 4.2037 4.2216 4.3948 4.4093 4.4392 4.5168 4.6257 4.6746 4.7931 4.8154 4.8622 4.8944 4.9749 5.0019 5.1591 5.1891 5.2920 5.3080 5.5120 5.5185 5.8775 5.8803 5.9821 5.9855 6.2997 6.3147 6.3829 6.3922 6.4464 6.4553 6.6067 6.6153 6.7221 6.7271 7.1800 7.1985 7.2410 7.2507 7.3525 7.3641 7.8139 7.8184 8.1896 8.1982 9.9430 9.9468 11.3653 11.3691 11.6889 11.6903 12.4411 12.4426 13.4092 13.4135 14.5110 14.5123 k = 0.0491 0.5613-0.0000 ( 3831 PWs) bands (ev): -4.7824 -4.7824 -4.4631 -4.4630 2.0098 2.0107 2.4838 2.4868 2.6401 2.6429 3.2674 3.2723 4.2120 4.2262 4.4040 4.4186 4.4696 4.5424 4.6279 4.6703 4.7780 4.8059 4.8576 4.8862 4.9733 4.9939 5.1552 5.1804 5.2896 5.3026 5.5130 5.5182 5.8793 5.8814 5.9831 5.9860 6.2969 6.3089 6.3878 6.3958 6.4473 6.4550 6.6074 6.6143 6.7330 6.7373 7.1733 7.1851 7.2558 7.2602 7.3512 7.3620 7.8531 7.8570 8.1901 8.1975 9.9423 9.9456 11.3086 11.3118 11.6402 11.6414 12.4341 12.4352 13.4028 13.4062 14.5054 14.5064 k = 0.0368 0.5613-0.0000 ( 3831 PWs) bands (ev): -4.7842 -4.7842 -4.4641 -4.4640 2.0040 2.0046 2.4822 2.4844 2.6391 2.6412 3.2687 3.2723 4.2186 4.2291 4.4125 4.4254 4.5001 4.5637 4.6305 4.6629 4.7655 4.7957 4.8541 4.8780 4.9723 4.9871 5.1533 5.1729 5.2880 5.2979 5.5139 5.5179 5.8808 5.8823 5.9841 5.9863 6.2948 6.3039 6.3920 6.3984 6.4482 6.4544 6.6082 6.6133 6.7423 6.7457 7.1655 7.1732 7.2681 7.2714 7.3499 7.3594 7.8851 7.8884 8.1910 8.1970 9.9419 9.9444 11.2627 11.2652 11.6019 11.6028 12.4286 12.4294 13.3979 13.4003 14.5011 14.5019 k = 0.0246 0.5613-0.0000 ( 3827 PWs) bands (ev): -4.7855 -4.7855 -4.4649 -4.4648 1.9998 2.0003 2.4811 2.4825 2.6385 2.6399 3.2697 3.2722 4.2237 4.2305 4.4200 4.4295 4.5292 4.5787 4.6329 4.6524 4.7585 4.7849 4.8527 4.8702 4.9722 4.9816 5.1532 5.1666 5.2874 5.2941 5.5149 5.5175 5.8819 5.8829 5.9849 5.9864 6.2938 6.2998 6.3955 6.4000 6.4492 6.4535 6.6090 6.6124 6.7495 6.7519 7.1590 7.1638 7.2778 7.2809 7.3491 7.3565 7.9091 7.9114 8.1922 8.1964 9.9416 9.9434 11.2290 11.2307 11.5743 11.5749 12.4246 12.4252 13.3944 13.3960 14.4981 14.4986 k = 0.0123 0.5613-0.0000 ( 3830 PWs) bands (ev): -4.7863 -4.7862 -4.4653 -4.4653 1.9974 1.9976 2.4805 2.4813 2.6383 2.6390 3.2705 3.2718 4.2273 4.2307 4.4258 4.4309 4.5554 4.5841 4.6341 4.6415 4.7584 4.7740 4.8538 4.8631 4.9729 4.9775 5.1546 5.1614 5.2876 5.2910 5.5157 5.5170 5.8827 5.8832 5.9856 5.9863 6.2936 6.2967 6.3982 6.4005 6.4503 6.4526 6.6098 6.6115 6.7543 6.7555 7.1551 7.1575 7.2845 7.2865 7.3493 7.3534 7.9240 7.9252 8.1934 8.1956 9.9417 9.9426 11.2085 11.2093 11.5576 11.5579 12.4223 12.4226 13.3924 13.3932 14.4963 14.4966 k = 0.0000 0.5613-0.0000 ( 3826 PWs) bands (ev): -4.7865 -4.7865 -4.4654 -4.4654 1.9966 1.9966 2.4806 2.4806 2.6385 2.6385 3.2712 3.2712 4.2296 4.2296 4.4296 4.4296 4.5756 4.5756 4.6356 4.6356 4.7644 4.7644 4.8575 4.8575 4.9747 4.9747 5.1574 5.1574 5.2889 5.2889 5.5164 5.5164 5.8831 5.8831 5.9861 5.9861 6.2946 6.2946 6.3998 6.3998 6.4515 6.4515 6.6106 6.6106 6.7563 6.7563 7.1546 7.1546 7.2877 7.2877 7.3508 7.3508 7.9295 7.9295 8.1946 8.1946 9.9420 9.9420 11.2019 11.2019 11.5522 11.5522 12.4216 12.4216 13.3920 13.3920 14.4958 14.4958 k = 0.0000 0.5613-0.0000 ( 3826 PWs) bands (ev): -4.7865 -4.7865 -4.4654 -4.4654 1.9966 1.9966 2.4806 2.4806 2.6385 2.6385 3.2712 3.2712 4.2296 4.2296 4.4296 4.4296 4.5756 4.5756 4.6356 4.6356 4.7644 4.7644 4.8575 4.8575 4.9747 4.9747 5.1574 5.1574 5.2889 5.2889 5.5164 5.5164 5.8831 5.8831 5.9861 5.9861 6.2946 6.2946 6.3998 6.3998 6.4515 6.4515 6.6106 6.6106 6.7563 6.7563 7.1546 7.1546 7.2877 7.2877 7.3508 7.3508 7.9295 7.9295 8.1946 8.1946 9.9420 9.9420 11.2019 11.2019 11.5522 11.5522 12.4216 12.4216 13.3920 13.3920 14.4958 14.4958 k = 0.0000 0.5613 0.0122 ( 3830 PWs) bands (ev): -4.7861 -4.7860 -4.4660 -4.4660 1.9971 1.9971 2.4789 2.4789 2.6407 2.6407 3.2719 3.2719 4.2253 4.2295 4.4271 4.4287 4.5635 4.5721 4.6319 4.6375 4.7463 4.7897 4.8590 4.8657 4.9640 4.9892 5.1546 5.1610 5.2899 5.2916 5.5160 5.5160 5.8826 5.8830 5.9853 5.9857 6.2950 6.2953 6.3995 6.4007 6.4514 6.4517 6.6106 6.6110 6.7555 6.7562 7.1517 7.1522 7.2870 7.2883 7.3528 7.3558 7.9281 7.9299 8.1936 8.1945 9.9370 9.9372 11.1988 11.1998 11.5623 11.5625 12.4081 12.4108 13.4069 13.4091 14.4858 14.4861 k = 0.0000 0.5613 0.0244 ( 3830 PWs) bands (ev): -4.7847 -4.7847 -4.4676 -4.4676 1.9987 1.9987 2.4740 2.4741 2.6473 2.6473 3.2738 3.2738 4.2165 4.2247 4.4202 4.4233 4.5416 4.5548 4.6275 4.6370 4.7379 4.8157 4.8713 4.8813 4.9572 5.0076 5.1527 5.1657 5.2948 5.2981 5.5148 5.5150 5.8814 5.8822 5.9835 5.9842 6.2966 6.2971 6.3998 6.4021 6.4515 6.4520 6.6109 6.6118 6.7537 6.7552 7.1440 7.1449 7.2870 7.2892 7.3612 7.3665 7.9258 7.9292 8.1917 8.1935 9.9226 9.9229 11.1905 11.1924 11.5923 11.5926 12.3735 12.3784 13.4510 13.4551 14.4567 14.4573 k = 0.0000 0.5613 0.0366 ( 3828 PWs) bands (ev): -4.7824 -4.7824 -4.4702 -4.4702 2.0012 2.0013 2.4663 2.4664 2.6577 2.6578 3.2770 3.2770 4.2030 4.2150 4.4059 4.4094 4.5192 4.5327 4.6234 4.6347 4.7371 4.8357 4.8939 4.9001 4.9545 5.0301 5.1515 5.1714 5.3034 5.3081 5.5130 5.5134 5.8796 5.8808 5.9806 5.9816 6.2993 6.3001 6.4006 6.4040 6.4517 6.4525 6.6117 6.6130 6.7510 6.7534 7.1319 7.1329 7.2888 7.2916 7.3745 7.3814 7.9225 7.9277 8.1888 8.1914 9.9004 9.9008 11.1759 11.1788 11.6406 11.6409 12.3255 12.3322 13.5173 13.5228 14.4109 14.4118 k = 0.0000 0.5613 0.0488 ( 3832 PWs) bands (ev): -4.7792 -4.7792 -4.4739 -4.4739 2.0048 2.0049 2.4563 2.4565 2.6717 2.6718 3.2814 3.2814 4.1847 4.1998 4.3806 4.3827 4.5052 4.5158 4.6207 4.6321 4.7403 4.8481 4.9187 4.9229 4.9561 5.0564 5.1507 5.1783 5.3154 5.3214 5.5107 5.5113 5.8772 5.8788 5.9766 5.9780 6.3031 6.3041 6.4019 6.4064 6.4519 6.4531 6.6128 6.6146 6.7475 6.7507 7.1162 7.1170 7.2926 7.2959 7.3910 7.3992 7.9183 7.9252 8.1849 8.1884 9.8724 9.8730 11.1540 11.1577 11.7048 11.7052 12.2726 12.2806 13.5981 13.6047 14.3514 14.3526 k = 0.0000 0.5613 0.0611 ( 3834 PWs) bands (ev): -4.7751 -4.7751 -4.4786 -4.4786 2.0094 2.0095 2.4445 2.4448 2.6887 2.6888 3.2868 3.2868 4.1616 4.1791 4.3441 4.3442 4.5013 4.5080 4.6200 4.6308 4.7454 4.8550 4.9352 4.9514 4.9635 5.0859 5.1506 5.1867 5.3302 5.3374 5.5083 5.5091 5.8741 5.8763 5.9717 5.9733 6.3081 6.3092 6.4039 6.4092 6.4523 6.4539 6.6142 6.6165 6.7433 6.7472 7.0976 7.0979 7.2987 7.3023 7.4097 7.4190 7.9135 7.9221 8.1801 8.1844 9.8410 9.8419 11.1231 11.1276 11.7825 11.7829 12.2221 12.2311 13.6868 13.6942 14.2812 14.2828 k = 0.0000 0.5613 0.0733 ( 3830 PWs) bands (ev): -4.7702 -4.7702 -4.4843 -4.4842 2.0151 2.0152 2.4313 2.4315 2.7085 2.7086 3.2932 3.2933 4.1337 4.1527 4.2989 4.3004 4.5042 4.5077 4.6215 4.6314 4.7512 4.8584 4.9489 4.9647 4.9870 5.1171 5.1513 5.1971 5.3467 5.3549 5.5061 5.5073 5.8705 5.8732 5.9659 5.9677 6.3142 6.3155 6.4063 6.4123 6.4526 6.4549 6.6158 6.6187 6.7384 6.7431 7.0763 7.0765 7.3068 7.3107 7.4300 7.4401 7.9083 7.9184 8.1743 8.1794 9.8086 9.8096 11.0818 11.0870 11.8710 11.8713 12.1796 12.1892 13.7782 13.7861 14.2036 14.2055 k = 0.0000 0.5613 0.0855 ( 3830 PWs) bands (ev): -4.7644 -4.7644 -4.4908 -4.4908 2.0217 2.0218 2.4168 2.4171 2.7310 2.7311 3.3004 3.3004 4.1014 4.1209 4.2511 4.2539 4.5112 4.5122 4.6253 4.6344 4.7573 4.8597 4.9597 4.9725 5.0142 5.1431 5.1588 5.2100 5.3630 5.3723 5.5051 5.5066 5.8662 5.8695 5.9593 5.9611 6.3213 6.3229 6.4093 6.4158 6.4530 6.4559 6.6177 6.6212 6.7328 6.7384 7.0526 7.0535 7.3167 7.3210 7.4511 7.4619 7.9028 7.9145 8.1677 8.1734 9.7772 9.7784 11.0295 11.0351 11.9675 11.9675 12.1494 12.1592 13.8679 13.8763 14.1211 14.1235 k = 0.0000 0.5613 0.0977 ( 3820 PWs) bands (ev): -4.7578 -4.7578 -4.4983 -4.4982 2.0293 2.0294 2.4014 2.4017 2.7559 2.7561 3.3080 3.3082 4.0651 4.0844 4.2032 4.2073 4.5196 4.5206 4.6310 4.6393 4.7639 4.8603 4.9682 4.9794 5.0386 5.1486 5.1880 5.2259 5.3773 5.3874 5.5067 5.5084 5.8615 5.8654 5.9519 5.9537 6.3296 6.3313 6.4128 6.4196 6.4533 6.4571 6.6196 6.6238 6.7269 6.7333 7.0273 7.0288 7.3282 7.3327 7.4725 7.4837 7.8976 7.9108 8.1601 8.1665 9.7487 9.7501 10.9663 10.9721 12.0654 12.0669 12.1373 12.1457 13.9507 13.9587 14.0378 14.0414 k = 0.0000 0.5613 0.1099 ( 3812 PWs) bands (ev): -4.7505 -4.7504 -4.5066 -4.5065 2.0379 2.0380 2.3851 2.3854 2.7832 2.7834 3.3158 3.3160 4.0255 4.0438 4.1567 4.1621 4.5287 4.5311 4.6382 4.6456 4.7712 4.8611 4.9743 4.9850 5.0595 5.1504 5.2213 5.2450 5.3872 5.3980 5.5122 5.5137 5.8564 5.8609 5.9440 5.9456 6.3388 6.3408 6.4168 6.4236 6.4536 6.4585 6.6214 6.6264 6.7207 6.7280 7.0006 7.0028 7.3411 7.3457 7.4934 7.5050 7.8932 7.9076 8.1516 8.1587 9.7245 9.7261 10.8933 10.8991 12.1148 12.1242 12.1912 12.1918 13.9445 13.9470 14.0347 14.0448 k = 0.0000 0.5613 0.1221 ( 3806 PWs) bands (ev): -4.7424 -4.7423 -4.5156 -4.5155 2.0474 2.0475 2.3681 2.3684 2.8129 2.8131 3.3233 3.3236 3.9836 4.0007 4.1123 4.1190 4.5386 4.5423 4.6463 4.6524 4.7798 4.8628 4.9786 4.9894 5.0771 5.1524 5.2542 5.2667 5.3920 5.4027 5.5223 5.5228 5.8508 5.8561 5.9355 5.9369 6.3490 6.3512 6.4213 6.4276 6.4538 6.4599 6.6229 6.6287 6.7144 6.7227 6.9731 6.9758 7.3552 7.3598 7.5131 7.5249 7.8900 7.9055 8.1423 8.1499 9.7059 9.7078 10.8122 10.8180 12.1280 12.1379 12.2958 12.2960 13.8619 13.8652 14.0984 14.1087 k = 0.0000 0.5613 0.1343 ( 3800 PWs) bands (ev): -4.7336 -4.7335 -4.5254 -4.5253 2.0578 2.0580 2.3505 2.3509 2.8447 2.8449 3.3297 3.3302 3.9408 3.9567 4.0701 4.0780 4.5489 4.5537 4.6544 4.6587 4.7904 4.8661 4.9811 4.9923 5.0921 5.1551 5.2855 5.2896 5.3924 5.4029 5.5347 5.5357 5.8452 5.8512 5.9266 5.9276 6.3599 6.3625 6.4264 6.4318 6.4539 6.4616 6.6237 6.6303 6.7085 6.7177 6.9450 6.9482 7.3704 7.3749 7.5306 7.5423 7.8887 7.9051 8.1320 8.1401 9.6939 9.6960 10.7252 10.7308 12.1490 12.1585 12.4029 12.4037 13.7817 13.7858 14.1499 14.1605 k = 0.0000 0.5613 0.1465 ( 3806 PWs) bands (ev): -4.7242 -4.7241 -4.5357 -4.5356 2.0690 2.0693 2.3325 2.3329 2.8785 2.8787 3.3343 3.3350 3.8991 3.9140 4.0301 4.0389 4.5593 4.5650 4.6616 4.6635 4.8033 4.8714 4.9820 4.9939 5.1055 5.1589 5.3109 5.3129 5.3914 5.4016 5.5475 5.5503 5.8395 5.8463 5.9174 5.9179 6.3714 6.3745 6.4321 6.4359 6.4537 6.4634 6.6233 6.6305 6.7034 6.7134 6.9169 6.9204 7.3864 7.3908 7.5452 7.5564 7.8902 7.9070 8.1209 8.1294 9.6893 9.6917 10.6343 10.6397 12.1791 12.1883 12.5058 12.5074 13.7085 13.7137 14.1854 14.1964 k = 0.0000 0.5613 0.1588 ( 3804 PWs) bands (ev): -4.7141 -4.7140 -4.5466 -4.5465 2.0812 2.0814 2.3142 2.3146 2.9143 2.9145 3.3360 3.3368 3.8604 3.8745 3.9921 4.0016 4.5697 4.5762 4.6663 4.6671 4.8185 4.8789 4.9814 4.9940 5.1182 5.1641 5.3250 5.3314 5.3950 5.4050 5.5595 5.5642 5.8342 5.8418 5.9079 5.9081 6.3832 6.3870 6.4386 6.4399 6.4535 6.4659 6.6212 6.6285 6.7000 6.7103 6.8892 6.8930 7.4031 7.4072 7.5561 7.5665 7.8949 7.9118 8.1088 8.1178 9.6928 9.6954 10.5415 10.5467 12.2175 12.2263 12.5992 12.6019 13.6469 13.6534 14.2031 14.2143 k = 0.0000 0.5613 0.1710 ( 3802 PWs) bands (ev): -4.7035 -4.7034 -4.5580 -4.5579 2.0942 2.0944 2.2958 2.2961 2.9517 2.9519 3.3334 3.3344 3.8268 3.8402 3.9562 3.9661 4.5799 4.5871 4.6669 4.6704 4.8355 4.8886 4.9794 4.9929 5.1311 5.1707 5.3265 5.3354 5.4087 5.4193 5.5691 5.5758 5.8297 5.8381 5.8977 5.8987 6.3947 6.3996 6.4435 6.4457 6.4539 6.4693 6.6167 6.6236 6.6990 6.7091 6.8624 6.8664 7.4203 7.4241 7.5627 7.5719 7.9032 7.9196 8.0959 8.1052 9.7047 9.7075 10.4485 10.4534 12.2629 12.2713 12.6762 12.6804 13.6032 13.6113 14.2019 14.2133 k = 0.0000 0.5613 0.1832 ( 3816 PWs) bands (ev): -4.6924 -4.6923 -4.5698 -4.5697 2.1079 2.1082 2.2772 2.2776 2.9906 2.9907 3.3252 3.3264 3.8000 3.8130 3.9221 3.9324 4.5900 4.5978 4.6653 4.6711 4.8534 4.8999 4.9759 4.9904 5.1446 5.1791 5.3177 5.3279 5.4300 5.4418 5.5753 5.5839 5.8266 5.8355 5.8874 5.8894 6.4053 6.4116 6.4464 6.4491 6.4594 6.4744 6.6095 6.6152 6.7007 6.7099 6.8370 6.8411 7.4379 7.4412 7.5648 7.5725 7.9147 7.9305 8.0820 8.0917 9.7252 9.7283 10.3567 10.3614 12.3141 12.3223 12.7292 12.7348 13.5846 13.5943 14.1818 14.1934 k = 0.0000 0.5613 0.1954 ( 3814 PWs) bands (ev): -4.6809 -4.6808 -4.5819 -4.5818 2.1224 2.1227 2.2587 2.2590 3.0306 3.0307 3.3106 3.3118 3.7816 3.7942 3.8903 3.9007 4.5999 4.6083 4.6620 4.6696 4.8717 4.9122 4.9709 4.9867 5.1592 5.1894 5.3036 5.3149 5.4542 5.4669 5.5774 5.5877 5.8252 5.8346 5.8773 5.8804 6.4146 6.4222 6.4484 6.4485 6.4709 6.4823 6.5995 6.6037 6.7050 6.7131 6.8136 6.8177 7.4556 7.4584 7.5627 7.5689 7.9291 7.9440 8.0672 8.0773 9.7546 9.7578 10.2674 10.2719 12.3700 12.3779 12.7524 12.7593 13.5964 13.6075 14.1439 14.1556 k = 0.0000 0.5613 0.2076 ( 3814 PWs) bands (ev): -4.6691 -4.6690 -4.5943 -4.5942 2.1376 2.1379 2.2403 2.2407 3.0715 3.0715 3.2892 3.2902 3.7723 3.7845 3.8609 3.8715 4.6096 4.6184 4.6572 4.6659 4.8894 4.9248 4.9643 4.9817 5.1752 5.2015 5.2867 5.2992 5.4784 5.4919 5.5749 5.5866 5.8261 5.8355 5.8674 5.8716 6.4223 6.4309 6.4468 6.4492 6.4853 6.4932 6.5870 6.5896 6.7114 6.7185 6.7923 6.7964 7.4733 7.4755 7.5569 7.5615 7.9454 7.9595 8.0515 8.0619 9.7926 9.7960 10.1817 10.1861 12.4294 12.4372 12.7459 12.7535 13.6381 13.6499 14.0902 14.1020 k = 0.0000 0.5613 0.2198 ( 3810 PWs) bands (ev): -4.6569 -4.6568 -4.6068 -4.6067 2.1535 2.1538 2.2222 2.2225 3.1124 3.1125 3.2615 3.2624 3.7717 3.7835 3.8344 3.8451 4.6189 4.6282 4.6512 4.6606 4.9060 4.9371 4.9562 4.9754 5.1923 5.2154 5.2683 5.2823 5.5016 5.5154 5.5678 5.5806 5.8291 5.8382 5.8578 5.8632 6.4286 6.4375 6.4445 6.4490 6.5017 6.5070 6.5724 6.5734 6.7199 6.7260 6.7734 6.7776 7.4907 7.4922 7.5480 7.5510 7.9631 7.9763 8.0349 8.0458 9.8391 9.8427 10.1006 10.1049 12.4910 12.4986 12.7157 12.7234 13.7025 13.7146 14.0232 14.0351 k = 0.0000 0.5613 0.2320 ( 3826 PWs) bands (ev): -4.6445 -4.6444 -4.6194 -4.6193 2.1699 2.1702 2.2043 2.2047 3.1528 3.1531 3.2285 3.2292 3.7788 3.7903 3.8113 3.8222 4.6279 4.6375 4.6441 4.6539 4.9211 4.9462 4.9485 4.9677 5.2106 5.2308 5.2490 5.2647 5.5226 5.5366 5.5564 5.5699 5.8341 5.8426 5.8489 5.8554 6.4337 6.4415 6.4422 6.4478 6.5194 6.5226 6.5559 6.5562 6.7302 6.7355 6.7567 6.7612 7.5075 7.5081 7.5364 7.5381 7.9813 7.9938 8.0176 8.0288 9.8937 9.8975 10.0251 10.0292 12.5532 12.5608 12.6694 12.6771 13.7805 13.7926 13.9465 13.9584 k = 0.0000 0.5613 0.2442 ( 3832 PWs) bands (ev): -4.6320 -4.6320 -4.6319 -4.6319 2.1869 2.1869 2.1872 2.1872 3.1919 3.1919 3.1924 3.1924 3.7924 3.7924 3.8036 3.8036 4.6363 4.6363 4.6461 4.6461 4.9346 4.9346 4.9587 4.9587 5.2296 5.2296 5.2474 5.2474 5.5411 5.5411 5.5550 5.5550 5.8408 5.8408 5.8484 5.8484 6.4379 6.4379 6.4455 6.4455 6.5376 6.5376 6.5393 6.5393 6.7424 6.7424 6.7472 6.7472 7.5230 7.5230 7.5235 7.5235 7.9996 7.9996 8.0114 8.0114 9.9559 9.9559 9.9598 9.9598 12.6137 12.6137 12.6213 12.6213 13.8639 13.8639 13.8759 13.8759 k = 0.0000 0.5613 0.2442 ( 3832 PWs) bands (ev): -4.6320 -4.6320 -4.6319 -4.6319 2.1869 2.1869 2.1872 2.1872 3.1919 3.1919 3.1924 3.1924 3.7924 3.7924 3.8036 3.8036 4.6363 4.6363 4.6461 4.6461 4.9346 4.9346 4.9587 4.9587 5.2296 5.2296 5.2474 5.2474 5.5411 5.5411 5.5550 5.5550 5.8408 5.8408 5.8484 5.8484 6.4379 6.4379 6.4455 6.4455 6.5376 6.5376 6.5393 6.5393 6.7424 6.7424 6.7472 6.7472 7.5230 7.5230 7.5235 7.5235 7.9996 7.9996 8.0114 8.0114 9.9559 9.9559 9.9598 9.9598 12.6137 12.6137 12.6213 12.6213 13.8639 13.8639 13.8759 13.8759 k = 0.0123 0.5613 0.2442 ( 3820 PWs) bands (ev): -4.6319 -4.6319 -4.6316 -4.6316 2.1877 2.1877 2.1881 2.1881 3.1908 3.1908 3.1919 3.1919 3.7925 3.7925 3.8037 3.8037 4.6355 4.6355 4.6467 4.6467 4.9344 4.9344 4.9590 4.9590 5.2293 5.2293 5.2473 5.2473 5.5404 5.5404 5.5550 5.5550 5.8411 5.8411 5.8490 5.8490 6.4356 6.4356 6.4473 6.4474 6.5370 6.5371 6.5398 6.5399 6.7421 6.7422 6.7486 6.7486 7.5160 7.5160 7.5255 7.5256 7.9990 7.9990 8.0110 8.0110 9.9592 9.9592 9.9633 9.9633 12.6183 12.6183 12.6260 12.6260 13.8605 13.8605 13.8726 13.8726 k = 0.0246 0.5613 0.2442 ( 3820 PWs) bands (ev): -4.6313 -4.6313 -4.6309 -4.6309 2.1900 2.1900 2.1906 2.1906 3.1880 3.1880 3.1900 3.1900 3.7925 3.7925 3.8040 3.8040 4.6334 4.6334 4.6480 4.6480 4.9338 4.9338 4.9597 4.9597 5.2283 5.2283 5.2469 5.2469 5.5381 5.5381 5.5548 5.5548 5.8418 5.8418 5.8507 5.8508 6.4308 6.4308 6.4502 6.4503 6.5358 6.5358 6.5405 6.5406 6.7421 6.7421 6.7518 6.7519 7.5039 7.5039 7.5229 7.5229 7.9971 7.9971 8.0097 8.0097 9.9691 9.9691 9.9735 9.9735 12.6321 12.6321 12.6401 12.6401 13.8503 13.8503 13.8626 13.8626 k = 0.0368 0.5613 0.2442 ( 3816 PWs) bands (ev): -4.6304 -4.6304 -4.6298 -4.6298 2.1939 2.1940 2.1947 2.1947 3.1836 3.1836 3.1866 3.1866 3.7925 3.7925 3.8045 3.8045 4.6308 4.6308 4.6493 4.6493 4.9329 4.9329 4.9609 4.9609 5.2266 5.2266 5.2462 5.2462 5.5345 5.5346 5.5544 5.5544 5.8430 5.8431 5.8535 5.8535 6.4250 6.4251 6.4528 6.4528 6.5344 6.5345 6.5411 6.5411 6.7428 6.7429 6.7563 6.7563 7.4871 7.4871 7.5154 7.5154 7.9942 7.9942 8.0077 8.0077 9.9854 9.9854 9.9904 9.9904 12.6547 12.6547 12.6630 12.6630 13.8337 13.8337 13.8462 13.8462 k = 0.0491 0.5613 0.2442 ( 3810 PWs) bands (ev): -4.6290 -4.6290 -4.6283 -4.6283 2.1995 2.1995 2.2005 2.2005 3.1778 3.1779 3.1816 3.1816 3.7924 3.7924 3.8049 3.8049 4.6281 4.6281 4.6503 4.6504 4.9316 4.9316 4.9625 4.9625 5.2244 5.2244 5.2450 5.2450 5.5300 5.5301 5.5536 5.5536 5.8448 5.8449 5.8572 5.8572 6.4187 6.4187 6.4548 6.4549 6.5329 6.5330 6.5414 6.5415 6.7445 6.7446 6.7617 6.7617 7.4658 7.4659 7.5033 7.5033 7.9906 7.9906 8.0053 8.0053 10.0076 10.0076 10.0134 10.0134 12.6855 12.6855 12.6942 12.6942 13.8110 13.8110 13.8240 13.8240 k = 0.0614 0.5613 0.2442 ( 3810 PWs) bands (ev): -4.6273 -4.6273 -4.6264 -4.6263 2.2065 2.2065 2.2078 2.2078 3.1707 3.1707 3.1753 3.1753 3.7921 3.7921 3.8052 3.8052 4.6253 4.6253 4.6509 4.6509 4.9299 4.9299 4.9646 4.9646 5.2218 5.2218 5.2433 5.2433 5.5247 5.5248 5.5525 5.5525 5.8472 5.8472 5.8617 5.8617 6.4117 6.4118 6.4562 6.4563 6.5314 6.5315 6.5415 6.5416 6.7472 6.7472 6.7678 6.7679 7.4405 7.4406 7.4869 7.4869 7.9865 7.9865 8.0025 8.0025 10.0353 10.0354 10.0421 10.0421 12.7237 12.7237 12.7326 12.7326 13.7832 13.7832 13.7968 13.7968 k = 0.0737 0.5613 0.2442 ( 3810 PWs) bands (ev): -4.6252 -4.6252 -4.6241 -4.6241 2.2151 2.2151 2.2165 2.2166 3.1624 3.1624 3.1676 3.1676 3.7914 3.7914 3.8052 3.8052 4.6226 4.6226 4.6509 4.6509 4.9280 4.9280 4.9672 4.9672 5.2188 5.2189 5.2410 5.2410 5.5188 5.5189 5.5513 5.5513 5.8500 5.8500 5.8670 5.8670 6.4043 6.4044 6.4571 6.4571 6.5299 6.5299 6.5414 6.5414 6.7507 6.7507 6.7747 6.7747 7.4117 7.4117 7.4667 7.4667 7.9823 7.9823 7.9998 7.9998 10.0681 10.0681 10.0761 10.0761 12.7677 12.7677 12.7767 12.7767 13.7515 13.7515 13.7660 13.7660 k = 0.0859 0.5613 0.2442 ( 3812 PWs) bands (ev): -4.6228 -4.6228 -4.6215 -4.6214 2.2252 2.2252 2.2268 2.2268 3.1529 3.1529 3.1587 3.1587 3.7903 3.7904 3.8047 3.8047 4.6202 4.6202 4.6503 4.6503 4.9257 4.9257 4.9702 4.9702 5.2156 5.2156 5.2380 5.2381 5.5126 5.5126 5.5501 5.5501 5.8533 5.8533 5.8730 5.8730 6.3965 6.3965 6.4573 6.4574 6.5283 6.5284 6.5411 6.5411 6.7549 6.7550 6.7820 6.7821 7.3799 7.3800 7.4431 7.4431 7.9781 7.9781 7.9972 7.9972 10.1054 10.1054 10.1147 10.1147 12.8151 12.8151 12.8242 12.8242 13.7178 13.7178 13.7339 13.7339 k = 0.0982 0.5613 0.2442 ( 3816 PWs) bands (ev): -4.6200 -4.6200 -4.6185 -4.6185 2.2366 2.2366 2.2384 2.2384 3.1425 3.1425 3.1487 3.1487 3.7886 3.7886 3.8036 3.8036 4.6180 4.6180 4.6491 4.6491 4.9232 4.9232 4.9737 4.9737 5.2121 5.2121 5.2344 5.2344 5.5060 5.5060 5.5489 5.5490 5.8571 5.8571 5.8796 5.8796 6.3882 6.3883 6.4571 6.4571 6.5269 6.5269 6.5406 6.5406 6.7598 6.7599 6.7899 6.7899 7.3458 7.3459 7.4168 7.4168 7.9740 7.9741 7.9949 7.9949 10.1467 10.1467 10.1575 10.1575 12.8624 12.8624 12.8722 12.8722 13.6850 13.6850 13.7036 13.7036 k = 0.1105 0.5613 0.2442 ( 3820 PWs) bands (ev): -4.6170 -4.6170 -4.6153 -4.6153 2.2494 2.2494 2.2514 2.2514 3.1312 3.1312 3.1377 3.1378 3.7862 3.7862 3.8016 3.8016 4.6161 4.6161 4.6473 4.6474 4.9204 4.9204 4.9776 4.9776 5.2084 5.2084 5.2301 5.2301 5.4994 5.4995 5.5481 5.5481 5.8613 5.8613 5.8868 5.8868 6.3796 6.3797 6.4563 6.4564 6.5254 6.5254 6.5400 6.5400 6.7652 6.7652 6.7980 6.7980 7.3101 7.3102 7.3883 7.3884 7.9702 7.9703 7.9931 7.9931 10.1916 10.1916 10.2040 10.2040 12.9041 12.9041 12.9160 12.9160 13.6576 13.6576 13.6803 13.6803 k = 0.1228 0.5613 0.2442 ( 3824 PWs) bands (ev): -4.6136 -4.6136 -4.6118 -4.6118 2.2634 2.2634 2.2655 2.2655 3.1192 3.1192 3.1260 3.1260 3.7828 3.7828 3.7987 3.7987 4.6145 4.6146 4.6452 4.6452 4.9174 4.9174 4.9819 4.9820 5.2045 5.2045 5.2253 5.2253 5.4929 5.4929 5.5476 5.5476 5.8659 5.8659 5.8945 5.8945 6.3708 6.3708 6.4552 6.4553 6.5240 6.5240 6.5393 6.5393 6.7709 6.7709 6.8064 6.8064 7.2735 7.2735 7.3584 7.3585 7.9667 7.9668 7.9916 7.9916 10.2397 10.2397 10.2538 10.2538 12.9333 12.9333 12.9491 12.9491 13.6422 13.6422 13.6702 13.6702 k = 0.1351 0.5613 0.2442 ( 3822 PWs) bands (ev): -4.6101 -4.6101 -4.6081 -4.6081 2.2785 2.2785 2.2808 2.2808 3.1067 3.1067 3.1137 3.1137 3.7785 3.7785 3.7948 3.7948 4.6132 4.6132 4.6428 4.6429 4.9143 4.9143 4.9866 4.9866 5.2004 5.2004 5.2199 5.2199 5.4866 5.4867 5.5476 5.5476 5.8708 5.8709 5.9027 5.9027 6.3618 6.3618 6.4538 6.4539 6.5226 6.5226 6.5386 6.5386 6.7768 6.7769 6.8149 6.8150 7.2366 7.2366 7.3276 7.3277 7.9635 7.9635 7.9906 7.9906 10.2906 10.2907 10.3067 10.3067 12.9433 12.9433 12.9638 12.9638 13.6460 13.6460 13.6798 13.6798 k = 0.1473 0.5613 0.2442 ( 3826 PWs) bands (ev): -4.6063 -4.6063 -4.6042 -4.6042 2.2947 2.2947 2.2971 2.2971 3.0936 3.0937 3.1008 3.1008 3.7730 3.7730 3.7896 3.7896 4.6120 4.6120 4.6403 4.6404 4.9111 4.9112 4.9916 4.9916 5.1961 5.1961 5.2143 5.2143 5.4807 5.4807 5.5481 5.5481 5.8762 5.8762 5.9112 5.9113 6.3527 6.3527 6.4520 6.4521 6.5211 6.5212 6.5378 6.5378 6.7828 6.7828 6.8236 6.8236 7.2000 7.2001 7.2965 7.2966 7.9605 7.9605 7.9899 7.9899 10.3443 10.3443 10.3622 10.3622 12.9301 12.9301 12.9545 12.9546 13.6741 13.6741 13.7127 13.7127 k = 0.1596 0.5613 0.2442 ( 3826 PWs) bands (ev): -4.6025 -4.6025 -4.6001 -4.6001 2.3116 2.3116 2.3142 2.3142 3.0803 3.0804 3.0878 3.0878 3.7662 3.7662 3.7832 3.7832 4.6107 4.6107 4.6381 4.6381 4.9080 4.9080 4.9968 4.9969 5.1915 5.1915 5.2085 5.2085 5.4751 5.4752 5.5490 5.5491 5.8819 5.8819 5.9203 5.9203 6.3436 6.3436 6.4500 6.4501 6.5197 6.5197 6.5371 6.5371 6.7886 6.7886 6.8322 6.8323 7.1644 7.1645 7.2656 7.2656 7.9577 7.9578 7.9894 7.9895 10.4003 10.4003 10.4202 10.4202 12.8944 12.8944 12.9210 12.9210 13.7260 13.7260 13.7677 13.7677 k = 0.1719 0.5613 0.2442 ( 3828 PWs) bands (ev): -4.5985 -4.5985 -4.5960 -4.5960 2.3293 2.3293 2.3321 2.3321 3.0668 3.0668 3.0747 3.0747 3.7582 3.7582 3.7757 3.7757 4.6092 4.6092 4.6362 4.6362 4.9051 4.9051 5.0022 5.0022 5.1865 5.1865 5.2028 5.2029 5.4701 5.4702 5.5505 5.5505 5.8879 5.8879 5.9296 5.9297 6.3345 6.3346 6.4478 6.4478 6.5181 6.5182 6.5364 6.5365 6.7940 6.7941 6.8408 6.8408 7.1304 7.1304 7.2352 7.2353 7.9551 7.9551 7.9892 7.9892 10.4586 10.4586 10.4806 10.4806 12.8404 12.8404 12.8675 12.8675 13.7967 13.7967 13.8399 13.8399 k = 0.1842 0.5613 0.2442 ( 3826 PWs) bands (ev): -4.5944 -4.5944 -4.5918 -4.5918 2.3473 2.3474 2.3504 2.3504 3.0532 3.0532 3.0618 3.0618 3.7490 3.7490 3.7669 3.7669 4.6072 4.6072 4.6350 4.6350 4.9024 4.9024 5.0077 5.0078 5.1810 5.1811 5.1975 5.1976 5.4657 5.4657 5.5525 5.5525 5.8943 5.8944 5.9394 5.9394 6.3257 6.3258 6.4453 6.4454 6.5165 6.5166 6.5359 6.5359 6.7990 6.7991 6.8493 6.8494 7.0984 7.0985 7.2059 7.2059 7.9524 7.9525 7.9890 7.9891 10.5191 10.5191 10.5432 10.5432 12.7726 12.7726 12.7993 12.7993 13.8795 13.8795 13.9233 13.9233 k = 0.1964 0.5613 0.2442 ( 3828 PWs) bands (ev): -4.5904 -4.5904 -4.5876 -4.5876 2.3656 2.3657 2.3691 2.3691 3.0397 3.0398 3.0494 3.0494 3.7386 3.7386 3.7571 3.7571 4.6046 4.6047 4.6344 4.6345 4.9001 4.9001 5.0133 5.0133 5.1751 5.1751 5.1927 5.1927 5.4619 5.4619 5.5548 5.5548 5.9011 5.9011 5.9494 5.9494 6.3173 6.3174 6.4427 6.4427 6.5148 6.5148 6.5354 6.5354 6.8032 6.8033 6.8577 6.8577 7.0689 7.0690 7.1778 7.1778 7.9497 7.9498 7.9888 7.9889 10.5816 10.5816 10.6078 10.6078 12.6954 12.6954 12.7211 12.7211 13.9683 13.9683 14.0121 14.0122 k = 0.2087 0.5613 0.2442 ( 3832 PWs) bands (ev): -4.5864 -4.5864 -4.5835 -4.5835 2.3839 2.3839 2.3879 2.3879 3.0266 3.0266 3.0378 3.0378 3.7270 3.7271 3.7463 3.7463 4.6017 4.6017 4.6344 4.6344 4.8984 4.8984 5.0189 5.0189 5.1688 5.1688 5.1882 5.1883 5.4587 5.4587 5.5573 5.5573 5.9081 5.9081 5.9597 5.9597 6.3093 6.3094 6.4399 6.4400 6.5130 6.5130 6.5350 6.5350 6.8065 6.8065 6.8659 6.8660 7.0425 7.0425 7.1512 7.1512 7.9469 7.9470 7.9885 7.9885 10.6461 10.6461 10.6744 10.6744 12.6117 12.6117 12.6361 12.6361 14.0573 14.0573 14.1008 14.1008 k = 0.2210 0.5613 0.2442 ( 3830 PWs) bands (ev): -4.5825 -4.5825 -4.5795 -4.5795 2.4018 2.4018 2.4065 2.4065 3.0139 3.0139 3.0271 3.0271 3.7146 3.7146 3.7347 3.7347 4.5984 4.5984 4.6348 4.6348 4.8973 4.8973 5.0244 5.0244 5.1624 5.1624 5.1842 5.1842 5.4561 5.4561 5.5601 5.5601 5.9154 5.9154 5.9702 5.9702 6.3020 6.3021 6.4371 6.4372 6.5110 6.5111 6.5346 6.5347 6.8085 6.8085 6.8740 6.8740 7.0195 7.0195 7.1263 7.1264 7.9439 7.9440 7.9880 7.9880 10.7124 10.7124 10.7429 10.7429 12.5240 12.5240 12.5469 12.5469 14.1408 14.1408 14.1836 14.1836 k = 0.2333 0.5613 0.2442 ( 3830 PWs) bands (ev): -4.5787 -4.5787 -4.5756 -4.5756 2.4190 2.4190 2.4246 2.4246 3.0022 3.0022 3.0176 3.0177 3.7013 3.7013 3.7225 3.7225 4.5949 4.5949 4.6352 4.6352 4.8969 4.8969 5.0298 5.0298 5.1561 5.1561 5.1804 5.1804 5.4541 5.4541 5.5630 5.5630 5.9229 5.9229 5.9808 5.9808 6.2955 6.2955 6.4344 6.4344 6.5090 6.5091 6.5344 6.5344 6.8090 6.8090 6.8818 6.8819 7.0002 7.0002 7.1033 7.1034 7.9406 7.9406 7.9871 7.9871 10.7804 10.7804 10.8132 10.8132 12.4341 12.4342 12.4554 12.4554 14.2130 14.2130 14.2545 14.2546 k = 0.2456 0.5613 0.2442 ( 3832 PWs) bands (ev): -4.5752 -4.5752 -4.5720 -4.5720 2.4351 2.4351 2.4417 2.4418 2.9916 2.9916 3.0098 3.0098 3.6875 3.6875 3.7099 3.7099 4.5914 4.5914 4.6355 4.6355 4.8973 4.8973 5.0351 5.0351 5.1500 5.1500 5.1768 5.1768 5.4526 5.4526 5.5660 5.5660 5.9305 5.9306 5.9916 5.9916 6.2899 6.2899 6.4317 6.4318 6.5068 6.5069 6.5341 6.5341 6.8078 6.8079 6.8895 6.8895 6.9850 6.9850 7.0823 7.0824 7.9368 7.9369 7.9858 7.9858 10.8500 10.8500 10.8850 10.8850 12.3436 12.3436 12.3632 12.3632 14.2683 14.2683 14.3081 14.3082 k = 0.2578 0.5613 0.2442 ( 3830 PWs) bands (ev): -4.5720 -4.5720 -4.5687 -4.5687 2.4499 2.4499 2.4577 2.4577 2.9826 2.9826 3.0038 3.0038 3.6733 3.6733 3.6972 3.6972 4.5879 4.5879 4.6356 4.6356 4.8986 4.8986 5.0403 5.0403 5.1442 5.1442 5.1734 5.1734 5.4515 5.4515 5.5688 5.5688 5.9383 5.9383 6.0023 6.0023 6.2853 6.2854 6.4293 6.4293 6.5045 6.5046 6.5338 6.5338 6.8051 6.8052 6.8970 6.8970 6.9737 6.9737 7.0635 7.0636 7.9325 7.9326 7.9839 7.9839 10.9209 10.9209 10.9580 10.9580 12.2538 12.2539 12.2717 12.2717 14.3029 14.3029 14.3405 14.3405 k = 0.2701 0.5613 0.2442 ( 3830 PWs) bands (ev): -4.5690 -4.5690 -4.5657 -4.5657 2.4630 2.4630 2.4720 2.4720 2.9754 2.9755 2.9998 2.9998 3.6591 3.6591 3.6846 3.6846 4.5844 4.5844 4.6352 4.6352 4.9007 4.9007 5.0452 5.0452 5.1390 5.1390 5.1703 5.1703 5.4507 5.4507 5.5715 5.5715 5.9460 5.9460 6.0130 6.0130 6.2819 6.2820 6.4271 6.4272 6.5021 6.5021 6.5334 6.5335 6.8012 6.8012 6.9043 6.9044 6.9661 6.9661 7.0470 7.0471 7.9276 7.9277 7.9813 7.9814 10.9927 10.9927 11.0319 11.0319 12.1662 12.1662 12.1824 12.1824 14.3157 14.3157 14.3507 14.3507 k = 0.2824 0.5613 0.2442 ( 3834 PWs) bands (ev): -4.5665 -4.5665 -4.5631 -4.5631 2.4740 2.4740 2.4842 2.4842 2.9706 2.9706 2.9983 2.9983 3.6451 3.6451 3.6723 3.6723 4.5811 4.5811 4.6344 4.6344 4.9035 4.9035 5.0497 5.0498 5.1343 5.1343 5.1674 5.1674 5.4502 5.4502 5.5739 5.5739 5.9536 5.9536 6.0235 6.0235 6.2798 6.2799 6.4255 6.4255 6.4995 6.4995 6.5330 6.5330 6.7965 6.7965 6.9115 6.9116 6.9615 6.9616 7.0329 7.0329 7.9220 7.9220 7.9780 7.9780 11.0648 11.0648 11.1058 11.1058 12.0820 12.0820 12.0968 12.0968 14.3087 14.3087 14.3414 14.3414 k = 0.2947 0.5613 0.2442 ( 3828 PWs) bands (ev): -4.5645 -4.5645 -4.5609 -4.5609 2.4827 2.4828 2.4940 2.4941 2.9683 2.9683 2.9992 2.9992 3.6315 3.6315 3.6607 3.6607 4.5778 4.5778 4.6331 4.6331 4.9069 4.9069 5.0539 5.0539 5.1303 5.1303 5.1649 5.1649 5.4497 5.4498 5.5760 5.5760 5.9610 5.9610 6.0337 6.0337 6.2792 6.2792 6.4244 6.4245 6.4968 6.4968 6.5325 6.5326 6.7916 6.7917 6.9186 6.9187 6.9593 6.9593 7.0214 7.0214 7.9155 7.9156 7.9738 7.9738 11.1361 11.1361 11.1786 11.1786 12.0033 12.0033 12.0169 12.0169 14.2860 14.2860 14.3167 14.3167 k = 0.3069 0.5613 0.2442 ( 3824 PWs) bands (ev): -4.5629 -4.5629 -4.5593 -4.5593 2.4891 2.4891 2.5013 2.5013 2.9688 2.9688 3.0028 3.0028 3.6186 3.6187 3.6499 3.6499 4.5747 4.5747 4.6313 4.6313 4.9106 4.9106 5.0575 5.0576 5.1270 5.1270 5.1630 5.1630 5.4493 5.4494 5.5777 5.5777 5.9682 5.9682 6.0435 6.0435 6.2799 6.2799 6.4241 6.4241 6.4940 6.4941 6.5320 6.5321 6.7872 6.7872 6.9256 6.9256 6.9587 6.9587 7.0127 7.0127 7.9081 7.9082 7.9685 7.9686 11.2047 11.2047 11.2478 11.2478 11.9324 11.9324 11.9457 11.9457 14.2515 14.2515 14.2807 14.2807 k = 0.3192 0.5613 0.2442 ( 3824 PWs) bands (ev): -4.5619 -4.5619 -4.5583 -4.5583 2.4931 2.4932 2.5059 2.5059 2.9722 2.9722 3.0088 3.0088 3.6068 3.6068 3.6402 3.6402 4.5716 4.5716 4.6290 4.6291 4.9146 4.9146 5.0605 5.0605 5.1244 5.1244 5.1618 5.1618 5.4488 5.4489 5.5789 5.5789 5.9749 5.9749 6.0527 6.0527 6.2820 6.2820 6.4245 6.4245 6.4912 6.4912 6.5315 6.5315 6.7835 6.7836 6.9324 6.9325 6.9589 6.9589 7.0071 7.0072 7.8997 7.8997 7.9622 7.9622 11.2673 11.2673 11.3095 11.3095 11.8733 11.8733 11.8879 11.8879 14.2087 14.2087 14.2369 14.2369 k = 0.3315 0.5613 0.2442 ( 3822 PWs) bands (ev): -4.5615 -4.5615 -4.5579 -4.5579 2.4949 2.4949 2.5078 2.5079 2.9782 2.9782 3.0171 3.0171 3.5961 3.5961 3.6317 3.6317 4.5686 4.5687 4.6264 4.6264 4.9184 4.9184 5.0627 5.0627 5.1224 5.1224 5.1616 5.1616 5.4482 5.4482 5.5797 5.5797 5.9813 5.9813 6.0612 6.0612 6.2855 6.2855 6.4257 6.4257 6.4885 6.4885 6.5310 6.5311 6.7811 6.7812 6.9389 6.9390 6.9597 6.9597 7.0049 7.0050 7.8901 7.8901 7.9546 7.9546 11.3182 11.3182 11.3565 11.3565 11.8322 11.8322 11.8511 11.8511 14.1602 14.1602 14.1877 14.1877 k = 0.3438 0.5613 0.2442 ( 3826 PWs) bands (ev): -4.5618 -4.5618 -4.5582 -4.5582 2.4947 2.4947 2.5075 2.5075 2.9868 2.9868 3.0275 3.0275 3.5869 3.5869 3.6246 3.6246 4.5657 4.5657 4.6235 4.6235 4.9219 4.9220 5.0641 5.0641 5.1210 5.1210 5.1626 5.1626 5.4472 5.4472 5.5799 5.5799 5.9870 5.9871 6.0687 6.0688 6.2902 6.2903 6.4277 6.4277 6.4860 6.4860 6.5306 6.5307 6.7800 6.7801 6.9448 6.9448 6.9614 6.9614 7.0058 7.0059 7.8792 7.8793 7.9457 7.9458 11.3496 11.3496 11.3802 11.3802 11.8173 11.8173 11.8445 11.8445 14.1078 14.1078 14.1349 14.1349 k = 0.3438 0.5613 0.2442 ( 3826 PWs) bands (ev): -4.5618 -4.5618 -4.5582 -4.5582 2.4947 2.4947 2.5075 2.5075 2.9868 2.9868 3.0275 3.0275 3.5869 3.5869 3.6246 3.6246 4.5657 4.5657 4.6235 4.6235 4.9219 4.9220 5.0641 5.0641 5.1210 5.1210 5.1626 5.1626 5.4472 5.4472 5.5799 5.5799 5.9870 5.9871 6.0687 6.0688 6.2902 6.2903 6.4277 6.4277 6.4860 6.4860 6.5306 6.5307 6.7800 6.7801 6.9448 6.9448 6.9614 6.9614 7.0058 7.0059 7.8792 7.8793 7.9457 7.9458 11.3496 11.3496 11.3802 11.3802 11.8173 11.8173 11.8445 11.8445 14.1078 14.1078 14.1349 14.1349 k = 0.3374 0.5509 0.2442 ( 3822 PWs) bands (ev): -4.5609 -4.5609 -4.5573 -4.5573 2.4962 2.4962 2.5096 2.5096 2.9694 2.9694 3.0072 3.0072 3.6033 3.6033 3.6370 3.6371 4.5709 4.5709 4.6288 4.6288 4.9160 4.9160 5.0620 5.0620 5.1233 5.1233 5.1602 5.1602 5.4489 5.4489 5.5796 5.5796 5.9770 5.9770 6.0555 6.0555 6.2800 6.2801 6.4228 6.4228 6.4910 6.4910 6.5314 6.5315 6.7816 6.7817 6.9338 6.9339 6.9568 6.9568 7.0045 7.0045 7.9000 7.9001 7.9628 7.9629 11.3055 11.3055 11.3524 11.3524 11.8264 11.8264 11.8362 11.8363 14.2045 14.2045 14.2322 14.2323 k = 0.3311 0.5405 0.2442 ( 3814 PWs) bands (ev): -4.5607 -4.5607 -4.5572 -4.5572 2.4967 2.4967 2.5105 2.5105 2.9543 2.9543 2.9893 2.9893 3.6204 3.6204 3.6503 3.6503 4.5753 4.5753 4.6331 4.6331 4.9104 4.9104 5.0591 5.0591 5.1259 5.1259 5.1593 5.1593 5.4497 5.4497 5.5785 5.5785 5.9678 5.9678 6.0428 6.0428 6.2702 6.2702 6.4176 6.4176 6.4966 6.4967 6.5327 6.5327 6.7851 6.7852 6.9230 6.9231 6.9508 6.9508 7.0088 7.0089 7.9187 7.9188 7.9776 7.9776 11.2510 11.2510 11.3105 11.3105 11.8488 11.8488 11.8524 11.8524 14.2887 14.2887 14.3175 14.3175 k = 0.3247 0.5301 0.2442 ( 3822 PWs) bands (ev): -4.5613 -4.5613 -4.5578 -4.5578 2.4962 2.4962 2.5104 2.5104 2.9416 2.9416 2.9739 2.9739 3.6380 3.6380 3.6642 3.6642 4.5790 4.5790 4.6362 4.6362 4.9052 4.9053 5.0552 5.0552 5.1285 5.1286 5.1598 5.1598 5.4493 5.4494 5.5764 5.5764 5.9597 5.9597 6.0308 6.0308 6.2607 6.2607 6.4123 6.4124 6.5025 6.5025 6.5340 6.5340 6.7906 6.7906 6.9131 6.9132 6.9445 6.9445 7.0173 7.0174 7.9351 7.9351 7.9898 7.9898 11.1923 11.1923 11.2606 11.2606 11.8767 11.8767 11.8893 11.8893 14.3592 14.3592 14.3893 14.3893 k = 0.3183 0.5197 0.2442 ( 3820 PWs) bands (ev): -4.5628 -4.5628 -4.5593 -4.5593 2.4949 2.4949 2.5093 2.5093 2.9314 2.9314 2.9610 2.9610 3.6559 3.6559 3.6786 3.6786 4.5819 4.5820 4.6382 4.6382 4.9005 4.9005 5.0503 5.0503 5.1315 5.1315 5.1617 5.1617 5.4478 5.4478 5.5733 5.5734 5.9527 5.9527 6.0199 6.0200 6.2519 6.2519 6.4073 6.4073 6.5083 6.5083 6.5353 6.5354 6.7979 6.7979 6.9044 6.9044 6.9390 6.9391 7.0289 7.0289 7.9490 7.9490 7.9992 7.9993 11.1333 11.1333 11.2077 11.2077 11.9148 11.9148 11.9336 11.9336 14.4149 14.4149 14.4467 14.4467 k = 0.3120 0.5093 0.2442 ( 3830 PWs) bands (ev): -4.5651 -4.5651 -4.5617 -4.5617 2.4930 2.4930 2.5075 2.5075 2.9237 2.9237 2.9506 2.9506 3.6739 3.6739 3.6933 3.6933 4.5842 4.5842 4.6392 4.6392 4.8959 4.8959 5.0444 5.0444 5.1347 5.1347 5.1646 5.1646 5.4450 5.4450 5.5692 5.5692 5.9470 5.9470 6.0102 6.0102 6.2437 6.2438 6.4025 6.4025 6.5138 6.5139 6.5365 6.5365 6.8067 6.8067 6.8967 6.8967 6.9354 6.9354 7.0429 7.0430 7.9602 7.9602 8.0058 8.0059 11.0765 11.0765 11.1556 11.1556 11.9597 11.9597 11.9830 11.9831 14.4554 14.4554 14.4891 14.4891 k = 0.3056 0.4989 0.2442 ( 3838 PWs) bands (ev): -4.5683 -4.5683 -4.5651 -4.5651 2.4908 2.4908 2.5055 2.5055 2.9182 2.9182 2.9427 2.9427 3.6919 3.6919 3.7083 3.7083 4.5858 4.5858 4.6391 4.6391 4.8917 4.8917 5.0376 5.0376 5.1381 5.1381 5.1684 5.1684 5.4408 5.4408 5.5638 5.5638 5.9425 5.9425 6.0019 6.0019 6.2364 6.2365 6.3979 6.3980 6.5190 6.5190 6.5374 6.5374 6.8165 6.8166 6.8900 6.8901 6.9345 6.9345 7.0594 7.0595 7.9686 7.9686 8.0094 8.0095 11.0236 11.0236 11.1064 11.1064 12.0096 12.0096 12.0362 12.0362 14.4806 14.4806 14.5163 14.5163 k = 0.2992 0.4885 0.2442 ( 3838 PWs) bands (ev): -4.5725 -4.5725 -4.5694 -4.5694 2.4887 2.4887 2.5035 2.5035 2.9149 2.9149 2.9370 2.9370 3.7098 3.7098 3.7233 3.7234 4.5867 4.5867 4.6382 4.6382 4.8877 4.8877 5.0302 5.0302 5.1416 5.1416 5.1728 5.1728 5.4354 5.4354 5.5573 5.5573 5.9393 5.9393 5.9949 5.9950 6.2301 6.2302 6.3937 6.3938 6.5238 6.5238 6.5380 6.5380 6.8265 6.8266 6.8844 6.8845 6.9372 6.9372 7.0783 7.0784 7.9742 7.9742 8.0101 8.0101 10.9755 10.9755 11.0614 11.0614 12.0631 12.0631 12.0922 12.0922 14.4908 14.4908 14.5286 14.5286 k = 0.2929 0.4781 0.2442 ( 3830 PWs) bands (ev): -4.5777 -4.5777 -4.5747 -4.5747 2.4870 2.4870 2.5019 2.5019 2.9135 2.9135 2.9333 2.9333 3.7272 3.7272 3.7385 3.7385 4.5870 4.5870 4.6364 4.6364 4.8839 4.8839 5.0223 5.0223 5.1452 5.1452 5.1774 5.1775 5.4287 5.4287 5.5496 5.5496 5.9374 5.9374 5.9894 5.9894 6.2249 6.2249 6.3899 6.3899 6.5283 6.5284 6.5382 6.5382 6.8356 6.8357 6.8799 6.8799 6.9448 6.9448 7.0995 7.0996 7.9768 7.9768 8.0077 8.0078 10.9329 10.9329 11.0216 11.0216 12.1194 12.1194 12.1505 12.1505 14.4868 14.4868 14.5265 14.5265 k = 0.2865 0.4677 0.2442 ( 3834 PWs) bands (ev): -4.5839 -4.5839 -4.5810 -4.5810 2.4861 2.4861 2.5011 2.5012 2.9137 2.9137 2.9314 2.9314 3.7439 3.7439 3.7535 3.7536 4.5867 4.5867 4.6338 4.6338 4.8802 4.8802 5.0140 5.0140 5.1484 5.1484 5.1821 5.1821 5.4209 5.4209 5.5407 5.5407 5.9364 5.9364 5.9851 5.9851 6.2207 6.2208 6.3863 6.3864 6.5326 6.5327 6.5380 6.5381 6.8428 6.8428 6.8765 6.8765 6.9578 6.9579 7.1231 7.1231 7.9764 7.9765 8.0024 8.0024 10.8962 10.8962 10.9874 10.9874 12.1780 12.1780 12.2106 12.2106 14.4695 14.4695 14.5111 14.5111 k = 0.2801 0.4574 0.2442 ( 3834 PWs) bands (ev): -4.5911 -4.5911 -4.5884 -4.5884 2.4864 2.4864 2.5016 2.5016 2.9154 2.9154 2.9311 2.9311 3.7597 3.7597 3.7685 3.7685 4.5858 4.5859 4.6304 4.6304 4.8766 4.8766 5.0054 5.0054 5.1513 5.1514 5.1865 5.1865 5.4123 5.4123 5.5309 5.5309 5.9363 5.9363 5.9820 5.9820 6.2178 6.2179 6.3832 6.3832 6.5368 6.5369 6.5376 6.5377 6.8477 6.8477 6.8743 6.8743 6.9766 6.9766 7.1489 7.1490 7.9732 7.9733 7.9943 7.9943 10.8656 10.8656 10.9591 10.9591 12.2384 12.2384 12.2722 12.2722 14.4403 14.4403 14.4833 14.4834 k = 0.2738 0.4470 0.2442 ( 3830 PWs) bands (ev): -4.5994 -4.5994 -4.5968 -4.5968 2.4881 2.4881 2.5035 2.5035 2.9183 2.9183 2.9321 2.9321 3.7744 3.7744 3.7833 3.7833 4.5844 4.5845 4.6264 4.6264 4.8731 4.8731 4.9968 4.9968 5.1537 5.1538 5.1905 5.1906 5.4031 5.4032 5.5203 5.5203 5.9368 5.9368 5.9797 5.9798 6.2163 6.2163 6.3805 6.3805 6.5369 6.5369 6.5411 6.5411 6.8508 6.8508 6.8733 6.8734 7.0005 7.0005 7.1772 7.1772 7.9672 7.9672 7.9836 7.9837 10.8413 10.8413 10.9368 10.9368 12.3003 12.3003 12.3351 12.3351 14.4004 14.4004 14.4446 14.4446 k = 0.2674 0.4366 0.2442 ( 3834 PWs) bands (ev): -4.6087 -4.6087 -4.6063 -4.6063 2.4915 2.4915 2.5072 2.5072 2.9221 2.9221 2.9343 2.9343 3.7879 3.7879 3.7976 3.7976 4.5825 4.5825 4.6218 4.6218 4.8695 4.8695 4.9881 4.9881 5.1555 5.1555 5.1939 5.1939 5.3937 5.3937 5.5091 5.5091 5.9375 5.9375 5.9780 5.9780 6.2161 6.2162 6.3781 6.3782 6.5360 6.5361 6.5455 6.5455 6.8526 6.8526 6.8735 6.8736 7.0288 7.0289 7.2077 7.2077 7.9584 7.9584 7.9707 7.9708 10.8232 10.8232 10.9205 10.9205 12.3634 12.3634 12.3989 12.3989 14.3510 14.3511 14.3960 14.3961 k = 0.2610 0.4262 0.2442 ( 3842 PWs) bands (ev): -4.6190 -4.6190 -4.6168 -4.6168 2.4968 2.4968 2.5128 2.5128 2.9268 2.9268 2.9375 2.9375 3.8002 3.8002 3.8111 3.8112 4.5801 4.5801 4.6167 4.6167 4.8658 4.8658 4.9795 4.9795 5.1564 5.1564 5.1964 5.1964 5.3843 5.3843 5.4974 5.4974 5.9381 5.9381 5.9766 5.9766 6.2175 6.2176 6.3763 6.3764 6.5352 6.5352 6.5501 6.5502 6.8538 6.8538 6.8746 6.8746 7.0609 7.0610 7.2404 7.2404 7.9469 7.9469 7.9563 7.9563 10.8112 10.8112 10.9101 10.9101 12.4276 12.4276 12.4635 12.4635 14.2937 14.2937 14.3391 14.3391 k = 0.2547 0.4158 0.2442 ( 3842 PWs) bands (ev): -4.6303 -4.6303 -4.6283 -4.6283 2.5043 2.5043 2.5206 2.5207 2.9322 2.9322 2.9416 2.9416 3.8114 3.8114 3.8237 3.8237 4.5772 4.5773 4.6111 4.6111 4.8622 4.8622 4.9710 4.9710 5.1565 5.1565 5.1978 5.1978 5.3752 5.3752 5.4854 5.4854 5.9384 5.9384 5.9752 5.9752 6.2206 6.2207 6.3751 6.3752 6.5346 6.5346 6.5553 6.5553 6.8550 6.8550 6.8765 6.8765 7.0963 7.0964 7.2752 7.2753 7.9325 7.9325 7.9410 7.9410 10.8051 10.8051 10.9053 10.9053 12.4925 12.4925 12.5285 12.5285 14.2294 14.2295 14.2749 14.2749 k = 0.2483 0.4054 0.2442 ( 3848 PWs) bands (ev): -4.6427 -4.6427 -4.6409 -4.6409 2.5140 2.5140 2.5308 2.5308 2.9380 2.9380 2.9464 2.9464 3.8214 3.8214 3.8351 3.8351 4.5739 4.5740 4.6051 4.6051 4.8583 4.8584 4.9626 4.9626 5.1555 5.1555 5.1979 5.1979 5.3666 5.3666 5.4733 5.4733 5.9379 5.9379 5.9736 5.9736 6.2255 6.2255 6.3746 6.3746 6.5342 6.5343 6.5609 6.5609 6.8565 6.8566 6.8790 6.8790 7.1346 7.1347 7.3120 7.3121 7.9155 7.9155 7.9254 7.9254 10.8047 10.8047 10.9058 10.9058 12.5580 12.5580 12.5939 12.5939 14.1595 14.1595 14.2047 14.2047 k = 0.2419 0.3950 0.2442 ( 3844 PWs) bands (ev): -4.6560 -4.6560 -4.6543 -4.6543 2.5260 2.5260 2.5433 2.5434 2.9443 2.9443 2.9519 2.9519 3.8302 3.8302 3.8451 3.8451 4.5703 4.5703 4.5988 4.5988 4.8545 4.8545 4.9545 4.9545 5.1536 5.1536 5.1969 5.1969 5.3587 5.3587 5.4612 5.4612 5.9366 5.9366 5.9716 5.9716 6.2320 6.2320 6.3747 6.3748 6.5345 6.5345 6.5671 6.5672 6.8586 6.8586 6.8819 6.8819 7.1755 7.1756 7.3507 7.3508 7.8969 7.8969 7.9095 7.9095 10.8095 10.8095 10.9113 10.9113 12.6238 12.6238 12.6594 12.6594 14.0850 14.0850 14.1295 14.1295 k = 0.2356 0.3846 0.2442 ( 3840 PWs) bands (ev): -4.6702 -4.6702 -4.6687 -4.6687 2.5405 2.5405 2.5583 2.5584 2.9509 2.9509 2.9579 2.9579 3.8376 3.8377 3.8536 3.8536 4.5663 4.5663 4.5922 4.5922 4.8504 4.8504 4.9466 4.9466 5.1506 5.1506 5.1946 5.1946 5.3515 5.3515 5.4493 5.4493 5.9341 5.9341 5.9690 5.9690 6.2401 6.2402 6.3757 6.3757 6.5353 6.5354 6.5740 6.5741 6.8611 6.8612 6.8852 6.8852 7.2187 7.2188 7.3909 7.3910 7.8778 7.8778 7.8933 7.8934 10.8193 10.8193 10.9214 10.9214 12.6897 12.6897 12.7247 12.7247 14.0067 14.0067 14.0503 14.0503 k = 0.2292 0.3742 0.2442 ( 3844 PWs) bands (ev): -4.6852 -4.6852 -4.6839 -4.6839 2.5574 2.5574 2.5758 2.5758 2.9577 2.9577 2.9645 2.9645 3.8437 3.8437 3.8606 3.8606 4.5619 4.5619 4.5854 4.5854 4.8462 4.8462 4.9389 4.9389 5.1466 5.1466 5.1913 5.1913 5.3448 5.3448 5.4374 5.4374 5.9303 5.9303 5.9658 5.9658 6.2497 6.2498 6.3773 6.3774 6.5370 6.5371 6.5815 6.5816 6.8643 6.8643 6.8888 6.8888 7.2639 7.2640 7.4323 7.4324 7.8590 7.8590 7.8773 7.8773 10.8335 10.8335 10.9355 10.9355 12.7554 12.7554 12.7896 12.7896 13.9257 13.9257 13.9680 13.9680 k = 0.2228 0.3638 0.2442 ( 3840 PWs) bands (ev): -4.7011 -4.7011 -4.7000 -4.7000 2.5768 2.5768 2.5957 2.5958 2.9647 2.9647 2.9715 2.9715 3.8484 3.8484 3.8660 3.8660 4.5573 4.5573 4.5785 4.5785 4.8419 4.8419 4.9316 4.9316 5.1416 5.1416 5.1872 5.1872 5.3385 5.3386 5.4258 5.4258 5.9252 5.9252 5.9618 5.9618 6.2607 6.2607 6.3798 6.3798 6.5397 6.5397 6.5897 6.5897 6.8682 6.8682 6.8927 6.8927 7.3108 7.3109 7.4743 7.4743 7.8414 7.8414 7.8620 7.8620 10.8517 10.8517 10.9532 10.9532 12.8209 12.8209 12.8538 12.8538 13.8427 13.8427 13.8834 13.8834 k = 0.2165 0.3534 0.2442 ( 3840 PWs) bands (ev): -4.7178 -4.7177 -4.7168 -4.7168 2.5986 2.5986 2.6181 2.6181 2.9718 2.9718 2.9788 2.9788 3.8516 3.8516 3.8696 3.8696 4.5524 4.5524 4.5716 4.5716 4.8373 4.8373 4.9245 4.9245 5.1358 5.1358 5.1826 5.1826 5.3324 5.3324 5.4144 5.4145 5.9186 5.9187 5.9569 5.9569 6.2727 6.2727 6.3830 6.3831 6.5434 6.5434 6.5983 6.5984 6.8726 6.8726 6.8967 6.8967 7.3592 7.3592 7.5159 7.5160 7.8262 7.8262 7.8482 7.8483 10.8734 10.8734 10.9740 10.9740 12.8858 12.8858 12.9172 12.9172 13.7585 13.7585 13.7974 13.7974 k = 0.2101 0.3430 0.2442 ( 3840 PWs) bands (ev): -4.7351 -4.7351 -4.7342 -4.7342 2.6227 2.6227 2.6428 2.6429 2.9790 2.9790 2.9866 2.9866 3.8533 3.8533 3.8716 3.8716 4.5474 4.5474 4.5647 4.5647 4.8324 4.8324 4.9177 4.9177 5.1292 5.1292 5.1777 5.1777 5.3261 5.3261 5.4033 5.4033 5.9108 5.9108 5.9511 5.9512 6.2855 6.2856 6.3870 6.3871 6.5483 6.5483 6.6074 6.6075 6.8776 6.8776 6.9008 6.9008 7.4084 7.4084 7.5558 7.5559 7.8147 7.8147 7.8374 7.8374 10.8980 10.8980 10.9973 10.9973 12.9497 12.9497 12.9793 12.9793 13.6738 13.6738 13.7107 13.7107 k = 0.2037 0.3326 0.2442 ( 3832 PWs) bands (ev): -4.7530 -4.7530 -4.7523 -4.7523 2.6491 2.6491 2.6698 2.6699 2.9862 2.9862 2.9946 2.9946 3.8535 3.8535 3.8718 3.8718 4.5422 4.5422 4.5580 4.5580 4.8273 4.8273 4.9112 4.9112 5.1222 5.1222 5.1727 5.1728 5.3195 5.3195 5.3923 5.3923 5.9017 5.9018 5.9444 5.9444 6.2989 6.2990 6.3918 6.3919 6.5544 6.5544 6.6168 6.6169 6.8831 6.8831 6.9049 6.9049 7.4579 7.4579 7.5916 7.5916 7.8081 7.8081 7.8319 7.8319 10.9250 10.9250 11.0225 11.0225 13.0124 13.0124 13.0398 13.0398 13.5894 13.5894 13.6243 13.6243 k = 0.1974 0.3222 0.2442 ( 3830 PWs) bands (ev): -4.7715 -4.7715 -4.7709 -4.7709 2.6777 2.6777 2.6990 2.6990 2.9935 2.9935 3.0029 3.0029 3.8522 3.8522 3.8704 3.8704 4.5370 4.5370 4.5514 4.5515 4.8219 4.8219 4.9050 4.9050 5.1149 5.1149 5.1678 5.1679 5.3124 5.3124 5.3815 5.3815 5.8916 5.8916 5.9366 5.9366 6.3126 6.3127 6.3972 6.3972 6.5617 6.5618 6.6264 6.6264 6.8889 6.8890 6.9088 6.9088 7.5066 7.5067 7.6202 7.6203 7.8065 7.8065 7.8364 7.8364 10.9539 10.9539 11.0491 11.0491 13.0730 13.0731 13.0983 13.0983 13.5062 13.5062 13.5395 13.5395 k = 0.1910 0.3118 0.2442 ( 3826 PWs) bands (ev): -4.7905 -4.7905 -4.7900 -4.7900 2.7082 2.7082 2.7300 2.7301 3.0009 3.0009 3.0115 3.0115 3.8493 3.8493 3.8672 3.8672 4.5316 4.5317 4.5452 4.5452 4.8161 4.8161 4.8991 4.8991 5.1076 5.1076 5.1631 5.1632 5.3048 5.3048 5.3709 5.3709 5.8804 5.8804 5.9278 5.9278 6.3263 6.3264 6.4031 6.4032 6.5703 6.5704 6.6360 6.6360 6.8950 6.8950 6.9125 6.9125 7.5530 7.5530 7.6400 7.6400 7.8096 7.8096 7.8551 7.8552 10.9839 10.9839 11.0764 11.0764 13.1293 13.1293 13.1541 13.1541 13.4252 13.4252 13.4592 13.4592 k = 0.1846 0.3014 0.2442 ( 3834 PWs) bands (ev): -4.8098 -4.8098 -4.8094 -4.8094 2.7405 2.7405 2.7629 2.7629 3.0082 3.0083 3.0205 3.0205 3.8450 3.8450 3.8625 3.8625 4.5263 4.5263 4.5393 4.5394 4.8099 4.8099 4.8934 4.8934 5.1004 5.1004 5.1587 5.1587 5.2966 5.2967 5.3603 5.3603 5.8683 5.8684 5.9180 5.9180 6.3397 6.3398 6.4094 6.4095 6.5800 6.5800 6.6453 6.6454 6.9010 6.9010 6.9158 6.9158 7.5945 7.5945 7.6526 7.6526 7.8196 7.8196 7.8874 7.8874 11.0145 11.0145 11.1037 11.1037 13.1724 13.1724 13.2065 13.2065 13.3481 13.3481 13.3920 13.3920 k = 0.1783 0.2910 0.2442 ( 3830 PWs) bands (ev): -4.8295 -4.8295 -4.8291 -4.8291 2.7745 2.7745 2.7973 2.7973 3.0157 3.0157 3.0298 3.0298 3.8392 3.8393 3.8563 3.8563 4.5211 4.5211 4.5339 4.5339 4.8034 4.8034 4.8879 4.8879 5.0935 5.0936 5.1545 5.1545 5.2880 5.2881 5.3498 5.3499 5.8555 5.8556 5.9071 5.9072 6.3527 6.3528 6.4161 6.4162 6.5906 6.5907 6.6544 6.6544 6.9068 6.9068 6.9187 6.9187 7.6275 7.6275 7.6635 7.6635 7.8394 7.8395 7.9292 7.9293 11.0449 11.0449 11.1303 11.1303 13.1785 13.1785 13.2362 13.2363 13.2953 13.2954 13.3617 13.3617 k = 0.1719 0.2806 0.2442 ( 3830 PWs) bands (ev): -4.8494 -4.8494 -4.8490 -4.8490 2.8098 2.8098 2.8330 2.8330 3.0232 3.0232 3.0398 3.0398 3.8321 3.8321 3.8486 3.8486 4.5160 4.5160 4.5289 4.5289 4.7965 4.7965 4.8826 4.8826 5.0872 5.0872 5.1506 5.1507 5.2791 5.2791 5.3394 5.3395 5.8421 5.8421 5.8953 5.8954 6.3653 6.3653 6.4231 6.4232 6.6019 6.6020 6.6629 6.6629 6.9121 6.9121 6.9210 6.9210 7.6481 7.6481 7.6788 7.6788 7.8707 7.8708 7.9771 7.9772 11.0745 11.0745 11.1553 11.1553 13.1371 13.1372 13.1784 13.1784 13.3317 13.3317 13.3803 13.3804 k = 0.1655 0.2703 0.2442 ( 3832 PWs) bands (ev): -4.8695 -4.8695 -4.8690 -4.8690 2.8460 2.8460 2.8695 2.8695 3.0308 3.0309 3.0507 3.0507 3.8237 3.8238 3.8396 3.8396 4.5111 4.5112 4.5244 4.5244 4.7892 4.7892 4.8773 4.8773 5.0814 5.0814 5.1471 5.1471 5.2699 5.2699 5.3292 5.3292 5.8281 5.8281 5.8826 5.8826 6.3772 6.3772 6.4302 6.4303 6.6138 6.6139 6.6708 6.6708 6.9162 6.9162 6.9228 6.9229 7.6605 7.6605 7.6985 7.6985 7.9121 7.9122 8.0286 8.0287 11.1024 11.1024 11.1781 11.1781 13.0757 13.0758 13.1053 13.1053 13.3853 13.3853 13.4213 13.4213 k = 0.1592 0.2599 0.2442 ( 3828 PWs) bands (ev): -4.8896 -4.8896 -4.8891 -4.8891 2.8826 2.8826 2.9063 2.9063 3.0388 3.0388 3.0630 3.0630 3.8142 3.8142 3.8294 3.8294 4.5065 4.5066 4.5203 4.5203 4.7815 4.7816 4.8721 4.8721 5.0763 5.0764 5.1439 5.1439 5.2607 5.2607 5.3191 5.3192 5.8136 5.8136 5.8690 5.8690 6.3885 6.3885 6.4375 6.4375 6.6259 6.6259 6.6780 6.6780 6.9185 6.9185 6.9247 6.9247 7.6727 7.6727 7.7193 7.7193 7.9608 7.9609 8.0824 8.0825 11.1277 11.1277 11.1977 11.1977 13.0106 13.0106 13.0342 13.0342 13.4399 13.4399 13.4686 13.4686 k = 0.1528 0.2495 0.2442 ( 3824 PWs) bands (ev): -4.9097 -4.9096 -4.9091 -4.9091 2.9186 2.9186 2.9429 2.9429 3.0474 3.0474 3.0775 3.0775 3.8036 3.8036 3.8182 3.8182 4.5023 4.5023 4.5166 4.5167 4.7736 4.7736 4.8669 4.8669 5.0720 5.0720 5.1409 5.1409 5.2514 5.2515 5.3095 5.3095 5.7987 5.7988 5.8546 5.8546 6.3992 6.3992 6.4447 6.4447 6.6379 6.6380 6.6844 6.6845 6.9186 6.9186 6.9265 6.9266 7.6877 7.6877 7.7416 7.7416 8.0141 8.0142 8.1375 8.1376 11.1495 11.1495 11.2133 11.2133 12.9466 12.9466 12.9678 12.9678 13.4940 13.4941 13.5177 13.5177 k = 0.1464 0.2391 0.2442 ( 3820 PWs) bands (ev): -4.9296 -4.9296 -4.9290 -4.9290 2.9525 2.9525 2.9780 2.9781 3.0576 3.0576 3.0955 3.0955 3.7920 3.7921 3.8061 3.8061 4.4984 4.4984 4.5134 4.5134 4.7652 4.7652 4.8616 4.8616 5.0683 5.0683 5.1382 5.1383 5.2423 5.2424 5.3003 5.3003 5.7836 5.7836 5.8394 5.8394 6.4092 6.4093 6.4519 6.4519 6.6497 6.6497 6.6900 6.6901 6.9169 6.9169 6.9277 6.9278 7.7068 7.7068 7.7666 7.7666 8.0702 8.0702 8.1932 8.1933 11.1670 11.1670 11.2240 11.2240 12.8855 12.8855 12.9075 12.9075 13.5475 13.5475 13.5673 13.5673 k = 0.1401 0.2287 0.2442 ( 3822 PWs) bands (ev): -4.9493 -4.9493 -4.9487 -4.9487 2.9822 2.9823 3.0097 3.0098 3.0715 3.0715 3.1184 3.1184 3.7797 3.7797 3.7932 3.7932 4.4949 4.4949 4.5106 4.5106 4.7566 4.7566 4.8562 4.8562 5.0652 5.0653 5.1358 5.1358 5.2334 5.2334 5.2917 5.2918 5.7682 5.7682 5.8235 5.8235 6.4187 6.4188 6.4589 6.4589 6.6609 6.6610 6.6949 6.6950 6.9138 6.9138 6.9278 6.9278 7.7305 7.7305 7.7951 7.7951 8.1277 8.1277 8.2491 8.2491 11.1792 11.1792 11.2290 11.2290 12.8288 12.8288 12.8541 12.8541 13.6002 13.6002 13.6170 13.6170 k = 0.1337 0.2183 0.2442 ( 3826 PWs) bands (ev): -4.9688 -4.9688 -4.9681 -4.9681 3.0063 3.0063 3.0340 3.0340 3.0937 3.0937 3.1467 3.1468 3.7667 3.7667 3.7797 3.7797 4.4917 4.4917 4.5081 4.5081 4.7477 4.7477 4.8508 4.8508 5.0627 5.0627 5.1336 5.1336 5.2248 5.2248 5.2841 5.2841 5.7526 5.7527 5.8070 5.8070 6.4278 6.4278 6.4658 6.4658 6.6714 6.6715 6.6989 6.6990 6.9095 6.9095 6.9267 6.9267 7.7589 7.7589 7.8274 7.8274 8.1858 8.1858 8.3047 8.3048 11.1851 11.1851 11.2275 11.2275 12.7776 12.7776 12.8077 12.8077 13.6520 13.6520 13.6668 13.6668 k = 0.1273 0.2079 0.2442 ( 3824 PWs) bands (ev): -4.9879 -4.9879 -4.9871 -4.9871 3.0248 3.0248 3.0494 3.0494 3.1253 3.1253 3.1801 3.1801 3.7532 3.7532 3.7658 3.7658 4.4889 4.4889 4.5059 4.5060 4.7385 4.7385 4.8452 4.8452 5.0606 5.0607 5.1317 5.1317 5.2166 5.2167 5.2774 5.2775 5.7370 5.7370 5.7899 5.7899 6.4363 6.4364 6.4724 6.4725 6.6812 6.6813 6.7023 6.7023 6.9042 6.9042 6.9244 6.9244 7.7921 7.7921 7.8637 7.8637 8.2439 8.2439 8.3597 8.3597 11.1840 11.1840 11.2192 11.2192 12.7328 12.7329 12.7685 12.7685 13.7031 13.7031 13.7170 13.7170 k = 0.1210 0.1975 0.2442 ( 3822 PWs) bands (ev): -5.0065 -5.0065 -5.0058 -5.0058 3.0391 3.0391 3.0595 3.0595 3.1625 3.1625 3.2171 3.2171 3.7393 3.7393 3.7516 3.7516 4.4865 4.4865 4.5041 4.5041 4.7292 4.7292 4.8395 4.8395 5.0588 5.0588 5.1300 5.1300 5.2090 5.2090 5.2719 5.2720 5.7213 5.7214 5.7724 5.7724 6.4445 6.4446 6.4789 6.4789 6.6901 6.6901 6.7049 6.7050 6.8980 6.8981 6.9210 6.9210 7.8298 7.8298 7.9039 7.9039 8.3015 8.3016 8.4137 8.4138 11.1754 11.1754 11.2036 11.2036 12.6952 12.6952 12.7363 12.7363 13.7535 13.7535 13.7677 13.7677 k = 0.1146 0.1871 0.2442 ( 3826 PWs) bands (ev): -5.0247 -5.0247 -5.0239 -5.0239 3.0504 3.0504 3.0672 3.0672 3.2019 3.2019 3.2562 3.2562 3.7252 3.7253 3.7374 3.7374 4.4844 4.4844 4.5025 4.5025 4.7198 4.7198 4.8337 4.8337 5.0570 5.0570 5.1286 5.1286 5.2021 5.2022 5.2676 5.2676 5.7057 5.7057 5.7545 5.7545 6.4523 6.4524 6.4851 6.4852 6.6980 6.6981 6.7069 6.7070 6.8911 6.8911 6.9166 6.9166 7.8718 7.8718 7.9476 7.9476 8.3583 8.3583 8.4665 8.4666 11.1590 11.1590 11.1808 11.1808 12.6647 12.6647 12.7109 12.7109 13.8033 13.8033 13.8189 13.8189 k = 0.1082 0.1767 0.2442 ( 3818 PWs) bands (ev): -5.0422 -5.0422 -5.0414 -5.0414 3.0597 3.0597 3.0737 3.0737 3.2421 3.2421 3.2963 3.2963 3.7112 3.7112 3.7233 3.7233 4.4826 4.4826 4.5012 4.5012 4.7104 4.7104 4.8277 4.8277 5.0552 5.0552 5.1275 5.1275 5.1963 5.1963 5.2645 5.2645 5.6902 5.6902 5.7363 5.7363 6.4599 6.4599 6.4912 6.4912 6.7049 6.7049 6.7086 6.7086 6.8837 6.8837 6.9115 6.9115 7.9176 7.9177 7.9946 7.9947 8.4138 8.4139 8.5178 8.5179 11.1347 11.1347 11.1511 11.1511 12.6413 12.6413 12.6918 12.6918 13.8530 13.8530 13.8708 13.8708 k = 0.1019 0.1663 0.2442 ( 3822 PWs) bands (ev): -5.0592 -5.0591 -5.0583 -5.0583 3.0676 3.0676 3.0794 3.0794 3.2821 3.2821 3.3366 3.3366 3.6972 3.6972 3.7095 3.7095 4.4810 4.4810 4.5000 4.5000 4.7012 4.7012 4.8214 4.8215 5.0532 5.0532 5.1265 5.1265 5.1916 5.1916 5.2625 5.2625 5.6748 5.6748 5.7178 5.7178 6.4671 6.4672 6.4969 6.4970 6.7087 6.7087 6.7118 6.7119 6.8758 6.8758 6.9056 6.9057 7.9670 7.9670 8.0446 8.0446 8.4678 8.4679 8.5673 8.5674 11.1029 11.1029 11.1150 11.1150 12.6246 12.6246 12.6782 12.6782 13.9028 13.9028 13.9232 13.9232 k = 0.0955 0.1559 0.2442 ( 3830 PWs) bands (ev): -5.0754 -5.0754 -5.0746 -5.0746 3.0745 3.0745 3.0845 3.0845 3.3214 3.3215 3.3765 3.3765 3.6835 3.6835 3.6961 3.6961 4.4797 4.4797 4.4989 4.4989 4.6921 4.6921 4.8149 4.8150 5.0509 5.0509 5.1256 5.1256 5.1883 5.1883 5.2615 5.2615 5.6597 5.6597 5.6992 5.6993 6.4741 6.4741 6.5025 6.5025 6.7094 6.7094 6.7168 6.7169 6.8677 6.8677 6.8993 6.8994 8.0193 8.0194 8.0969 8.0969 8.5200 8.5200 8.6147 8.6148 11.0642 11.0643 11.0731 11.0732 12.6137 12.6138 12.6693 12.6694 13.9529 13.9529 13.9761 13.9761 k = 0.0891 0.1455 0.2442 ( 3834 PWs) bands (ev): -5.0908 -5.0908 -5.0900 -5.0900 3.0805 3.0805 3.0891 3.0892 3.3597 3.3598 3.4154 3.4154 3.6703 3.6703 3.6834 3.6834 4.4786 4.4786 4.4980 4.4980 4.6835 4.6835 4.8081 4.8081 5.0485 5.0485 5.1246 5.1246 5.1866 5.1866 5.2614 5.2615 5.6448 5.6448 5.6807 5.6807 6.4808 6.4809 6.5078 6.5078 6.7095 6.7096 6.7212 6.7212 6.8595 6.8596 6.8927 6.8928 8.0742 8.0743 8.1513 8.1513 8.5701 8.5702 8.6599 8.6599 11.0197 11.0197 11.0265 11.0265 12.6079 12.6079 12.6643 12.6643 14.0035 14.0035 14.0296 14.0296 k = 0.0828 0.1351 0.2442 ( 3826 PWs) bands (ev): -5.1054 -5.1054 -5.1046 -5.1046 3.0859 3.0859 3.0934 3.0934 3.3965 3.3965 3.4528 3.4529 3.6578 3.6578 3.6717 3.6717 4.4778 4.4778 4.4972 4.4972 4.6754 4.6754 4.8009 4.8009 5.0462 5.0462 5.1233 5.1233 5.1868 5.1868 5.2623 5.2623 5.6303 5.6303 5.6622 5.6622 6.4874 6.4875 6.5130 6.5130 6.7094 6.7094 6.7248 6.7249 6.8516 6.8516 6.8859 6.8860 8.1312 8.1313 8.2071 8.2072 8.6179 8.6180 8.7025 8.7026 10.9702 10.9702 10.9758 10.9758 12.6061 12.6061 12.6622 12.6622 14.0545 14.0545 14.0834 14.0834 k = 0.0764 0.1247 0.2442 ( 3814 PWs) bands (ev): -5.1191 -5.1191 -5.1184 -5.1184 3.0908 3.0908 3.0973 3.0973 3.4313 3.4313 3.4882 3.4882 3.6464 3.6464 3.6613 3.6614 4.4772 4.4772 4.4965 4.4965 4.6680 4.6680 4.7931 4.7932 5.0441 5.0441 5.1216 5.1216 5.1886 5.1887 5.2638 5.2638 5.6162 5.6162 5.6439 5.6440 6.4939 6.4939 6.5179 6.5180 6.7090 6.7090 6.7277 6.7277 6.8438 6.8439 6.8790 6.8791 8.1897 8.1898 8.2640 8.2640 8.6633 8.6634 8.7425 8.7425 10.9171 10.9171 10.9219 10.9219 12.6075 12.6075 12.6622 12.6622 14.1059 14.1059 14.1374 14.1374 k = 0.0700 0.1143 0.2442 ( 3814 PWs) bands (ev): -5.1319 -5.1319 -5.1313 -5.1312 3.0951 3.0951 3.1008 3.1008 3.4634 3.4635 3.5204 3.5204 3.6366 3.6366 3.6528 3.6528 4.4767 4.4767 4.4957 4.4957 4.6615 4.6615 4.7848 4.7848 5.0425 5.0425 5.1193 5.1193 5.1920 5.1921 5.2658 5.2658 5.6025 5.6025 5.6260 5.6261 6.5000 6.5001 6.5226 6.5227 6.7084 6.7085 6.7298 6.7298 6.8364 6.8365 6.8721 6.8721 8.2491 8.2492 8.3211 8.3211 8.7059 8.7060 8.7795 8.7796 10.8614 10.8614 10.8657 10.8657 12.6111 12.6111 12.6635 12.6635 14.1576 14.1576 14.1914 14.1914 k = 0.0637 0.1039 0.2442 ( 3816 PWs) bands (ev): -5.1438 -5.1438 -5.1431 -5.1431 3.0990 3.0990 3.1039 3.1039 3.4921 3.4921 3.5480 3.5480 3.6297 3.6297 3.6471 3.6471 4.4763 4.4763 4.4949 4.4949 4.6559 4.6559 4.7759 4.7759 5.0414 5.0414 5.1166 5.1166 5.1968 5.1968 5.2681 5.2682 5.5893 5.5894 5.6087 5.6087 6.5060 6.5061 6.5271 6.5271 6.7078 6.7078 6.7311 6.7312 6.8296 6.8296 6.8651 6.8652 8.3088 8.3088 8.3779 8.3779 8.7457 8.7458 8.8135 8.8136 10.8043 10.8043 10.8083 10.8083 12.6161 12.6162 12.6656 12.6656 14.2093 14.2093 14.2450 14.2450 k = 0.0573 0.0935 0.2442 ( 3812 PWs) bands (ev): -5.1546 -5.1546 -5.1540 -5.1540 3.1024 3.1024 3.1067 3.1067 3.5160 3.5160 3.5673 3.5673 3.6288 3.6288 3.6456 3.6456 4.4761 4.4762 4.4941 4.4942 4.6514 4.6514 4.7664 4.7664 5.0411 5.0411 5.1135 5.1135 5.2027 5.2027 5.2707 5.2707 5.5768 5.5768 5.5920 5.5920 6.5118 6.5118 6.5313 6.5313 6.7071 6.7072 6.7317 6.7318 6.8234 6.8235 6.8584 6.8584 8.3680 8.3681 8.4336 8.4337 8.7825 8.7826 8.8444 8.8444 10.7469 10.7469 10.7509 10.7509 12.6221 12.6221 12.6679 12.6679 14.2606 14.2606 14.2977 14.2977 k = 0.0509 0.0832 0.2442 ( 3814 PWs) bands (ev): -5.1644 -5.1644 -5.1639 -5.1638 3.1055 3.1055 3.1092 3.1092 3.5338 3.5338 3.5747 3.5748 3.6359 3.6359 3.6507 3.6507 4.4761 4.4761 4.4932 4.4933 4.6482 4.6482 4.7563 4.7563 5.0417 5.0417 5.1100 5.1100 5.2094 5.2094 5.2732 5.2733 5.5650 5.5650 5.5762 5.5763 6.5173 6.5173 6.5351 6.5351 6.7066 6.7067 6.7316 6.7317 6.8181 6.8182 6.8517 6.8518 8.4260 8.4260 8.4874 8.4875 8.8162 8.8162 8.8719 8.8719 10.6901 10.6901 10.6944 10.6944 12.6284 12.6284 12.6701 12.6701 14.3111 14.3111 14.3488 14.3488 k = 0.0446 0.0728 0.2442 ( 3818 PWs) bands (ev): -5.1731 -5.1731 -5.1726 -5.1726 3.1081 3.1082 3.1113 3.1113 3.5446 3.5446 3.5737 3.5737 3.6474 3.6474 3.6635 3.6635 4.4763 4.4763 4.4923 4.4923 4.6463 4.6463 4.7457 4.7458 5.0431 5.0431 5.1061 5.1061 5.2167 5.2167 5.2755 5.2755 5.5539 5.5539 5.5616 5.5616 6.5225 6.5225 6.5385 6.5386 6.7063 6.7063 6.7308 6.7309 6.8137 6.8138 6.8453 6.8454 8.4817 8.4818 8.5383 8.5383 8.8466 8.8467 8.8960 8.8960 10.6354 10.6354 10.6401 10.6401 12.6348 12.6348 12.6719 12.6719 14.3601 14.3602 14.3977 14.3977 k = 0.0382 0.0624 0.2442 ( 3818 PWs) bands (ev): -5.1807 -5.1807 -5.1803 -5.1803 3.1104 3.1105 3.1131 3.1131 3.5496 3.5496 3.5695 3.5695 3.6610 3.6610 3.6794 3.6794 4.4767 4.4767 4.4912 4.4912 4.6458 4.6458 4.7348 4.7349 5.0454 5.0454 5.1019 5.1019 5.2244 5.2245 5.2773 5.2774 5.5437 5.5437 5.5484 5.5485 6.5274 6.5274 6.5415 6.5416 6.7062 6.7063 6.7293 6.7294 6.8104 6.8105 6.8393 6.8393 8.5344 8.5344 8.5852 8.5853 8.8738 8.8739 8.9166 8.9167 10.5839 10.5839 10.5890 10.5890 12.6409 12.6409 12.6732 12.6732 14.4069 14.4070 14.4434 14.4434 k = 0.0318 0.0520 0.2442 ( 3818 PWs) bands (ev): -5.1872 -5.1872 -5.1868 -5.1868 3.1124 3.1124 3.1146 3.1146 3.5510 3.5510 3.5645 3.5646 3.6755 3.6755 3.6944 3.6944 4.4773 4.4773 4.4900 4.4900 4.6467 4.6467 4.7238 4.7238 5.0484 5.0485 5.0974 5.0974 5.2324 5.2324 5.2785 5.2785 5.5344 5.5344 5.5369 5.5369 6.5319 6.5319 6.5440 6.5441 6.7064 6.7065 6.7273 6.7273 6.8082 6.8083 6.8335 6.8336 8.5828 8.5828 8.6270 8.6271 8.8977 8.8977 8.9337 8.9338 10.5371 10.5371 10.5424 10.5424 12.6467 12.6467 12.6738 12.6738 14.4507 14.4507 14.4849 14.4849 k = 0.0255 0.0416 0.2442 ( 3822 PWs) bands (ev): -5.1925 -5.1925 -5.1922 -5.1922 3.1140 3.1141 3.1158 3.1158 3.5506 3.5506 3.5599 3.5599 3.6896 3.6896 3.7070 3.7070 4.4781 4.4781 4.4888 4.4888 4.6491 4.6492 4.7127 4.7127 5.0522 5.0522 5.0926 5.0926 5.2403 5.2404 5.2788 5.2788 5.5262 5.5262 5.5274 5.5274 6.5359 6.5360 6.5459 6.5459 6.7070 6.7071 6.7248 6.7248 6.8070 6.8071 6.8282 6.8282 8.6257 8.6257 8.6625 8.6626 8.9181 8.9181 8.9472 8.9472 10.4964 10.4965 10.5015 10.5015 12.6519 12.6519 12.6738 12.6738 14.4903 14.4903 14.5209 14.5209 k = 0.0191 0.0312 0.2442 ( 3822 PWs) bands (ev): -5.1966 -5.1966 -5.1964 -5.1964 3.1154 3.1154 3.1166 3.1166 3.5497 3.5497 3.5559 3.5559 3.7022 3.7022 3.7164 3.7164 4.4791 4.4791 4.4874 4.4874 4.6530 4.6531 4.7019 4.7019 5.0565 5.0566 5.0876 5.0876 5.2481 5.2481 5.2779 5.2779 5.5191 5.5192 5.5202 5.5203 6.5394 6.5395 6.5471 6.5471 6.7080 6.7081 6.7220 6.7221 6.8069 6.8070 6.8233 6.8233 8.6619 8.6620 8.6905 8.6905 8.9349 8.9350 8.9569 8.9570 10.4633 10.4633 10.4676 10.4676 12.6566 12.6567 12.6732 12.6732 14.5247 14.5247 14.5501 14.5501 k = 0.0127 0.0208 0.2442 ( 3820 PWs) bands (ev): -5.1996 -5.1996 -5.1994 -5.1994 3.1163 3.1163 3.1172 3.1172 3.5489 3.5489 3.5528 3.5528 3.7124 3.7124 3.7225 3.7225 4.4803 4.4803 4.4860 4.4860 4.6584 4.6584 4.6915 4.6915 5.0613 5.0613 5.0824 5.0824 5.2554 5.2555 5.2758 5.2759 5.5139 5.5139 5.5150 5.5150 6.5424 6.5425 6.5476 6.5477 6.7095 6.7096 6.7191 6.7192 6.8077 6.8078 6.8189 6.8190 8.6903 8.6904 8.7098 8.7099 8.9482 8.9482 8.9629 8.9630 10.4388 10.4388 10.4420 10.4420 12.6608 12.6608 12.6719 12.6719 14.5526 14.5526 14.5710 14.5710 k = 0.0064 0.0104 0.2442 ( 3820 PWs) bands (ev): -5.2013 -5.2013 -5.2013 -5.2013 3.1170 3.1170 3.1174 3.1174 3.5487 3.5487 3.5505 3.5505 3.7198 3.7198 3.7250 3.7250 4.4817 4.4817 4.4845 4.4846 4.6650 4.6650 4.6818 4.6818 5.0664 5.0664 5.0771 5.0771 5.2621 5.2621 5.2724 5.2725 5.5109 5.5109 5.5116 5.5116 6.5448 6.5449 6.5474 6.5475 6.7114 6.7115 6.7163 6.7164 6.8094 6.8095 6.8151 6.8151 8.7099 8.7099 8.7198 8.7198 8.9577 8.9577 8.9651 8.9651 10.4241 10.4241 10.4258 10.4258 12.6644 12.6644 12.6700 12.6700 14.5723 14.5723 14.5821 14.5821 k = 0.0000 0.0000 0.2442 ( 3824 PWs) bands (ev): -5.2019 -5.2019 -5.2019 -5.2019 3.1174 3.1174 3.1174 3.1174 3.5492 3.5492 3.5492 3.5492 3.7241 3.7241 3.7241 3.7241 4.4831 4.4831 4.4831 4.4831 4.6728 4.6728 4.6729 4.6729 5.0717 5.0717 5.0717 5.0717 5.2678 5.2678 5.2678 5.2678 5.5102 5.5102 5.5102 5.5102 6.5464 6.5464 6.5465 6.5465 6.7137 6.7137 6.7137 6.7137 6.8119 6.8119 6.8119 6.8119 8.7198 8.7198 8.7199 8.7199 8.9633 8.9633 8.9634 8.9634 10.4197 10.4197 10.4197 10.4197 12.6675 12.6675 12.6675 12.6675 14.5825 14.5825 14.5825 14.5825 k = 0.0000 0.0000 0.2442 ( 3824 PWs) bands (ev): -5.2019 -5.2019 -5.2019 -5.2019 3.1174 3.1174 3.1174 3.1174 3.5492 3.5492 3.5492 3.5492 3.7241 3.7241 3.7241 3.7241 4.4831 4.4831 4.4831 4.4831 4.6728 4.6728 4.6729 4.6729 5.0717 5.0717 5.0717 5.0717 5.2678 5.2678 5.2678 5.2678 5.5102 5.5102 5.5102 5.5102 6.5464 6.5464 6.5465 6.5465 6.7137 6.7137 6.7137 6.7137 6.8119 6.8119 6.8119 6.8119 8.7198 8.7198 8.7199 8.7199 8.9633 8.9633 8.9634 8.9634 10.4197 10.4197 10.4197 10.4197 12.6675 12.6675 12.6675 12.6675 14.5825 14.5825 14.5825 14.5825 k = 0.0000 0.0000 0.2320 ( 3812 PWs) bands (ev): -5.2192 -5.2192 -5.1844 -5.1844 3.0589 3.0589 3.1652 3.1652 3.5403 3.5403 3.5707 3.5707 3.7054 3.7054 3.7449 3.7449 4.4791 4.4791 4.4868 4.4868 4.6668 4.6668 4.6786 4.6786 5.0593 5.0593 5.0834 5.0834 5.2539 5.2539 5.2807 5.2807 5.4860 5.4860 5.5355 5.5355 6.5324 6.5324 6.5594 6.5594 6.7036 6.7036 6.7251 6.7251 6.8098 6.8098 6.8135 6.8135 8.6959 8.6959 8.7430 8.7430 8.9530 8.9530 8.9710 8.9710 10.3956 10.3956 10.4387 10.4387 12.6576 12.6576 12.6893 12.6893 14.5174 14.5174 14.6500 14.6500 k = 0.0000 0.0000 0.2198 ( 3812 PWs) bands (ev): -5.2363 -5.2363 -5.1669 -5.1669 2.9944 2.9944 3.1977 3.1977 3.5446 3.5446 3.6037 3.6037 3.6899 3.6899 3.7672 3.7672 4.4749 4.4749 4.4903 4.4903 4.6604 4.6604 4.6840 4.6840 5.0463 5.0463 5.0939 5.0939 5.2396 5.2396 5.2917 5.2917 5.4642 5.4642 5.5611 5.5611 6.5172 6.5172 6.5708 6.5708 6.6945 6.6945 6.7377 6.7377 6.8071 6.8071 6.8146 6.8146 8.6713 8.6713 8.7652 8.7652 8.9396 8.9396 8.9762 8.9762 10.3674 10.3674 10.4518 10.4518 12.6596 12.6596 12.7225 12.7225 14.4550 14.4550 14.7196 14.7196 k = 0.0000 0.0000 0.2076 ( 3820 PWs) bands (ev): -5.2530 -5.2530 -5.1494 -5.1494 2.9271 2.9271 3.2134 3.2134 3.5582 3.5582 3.6466 3.6466 3.6811 3.6811 3.7908 3.7908 4.4703 4.4703 4.4935 4.4935 4.6537 4.6537 4.6890 4.6890 5.0327 5.0328 5.1027 5.1028 5.2254 5.2254 5.2995 5.2995 5.4466 5.4466 5.5864 5.5864 6.5015 6.5015 6.5801 6.5801 6.6863 6.6863 6.7513 6.7513 6.8038 6.8039 6.8152 6.8152 8.6463 8.6463 8.7857 8.7857 8.9234 8.9234 8.9792 8.9792 10.3363 10.3363 10.4588 10.4588 12.6732 12.6732 12.7666 12.7666 14.3954 14.3954 14.7901 14.7901 k = 0.0000 0.0000 0.1954 ( 3814 PWs) bands (ev): -5.2692 -5.2692 -5.1321 -5.1321 2.8593 2.8593 3.2150 3.2150 3.5722 3.5722 3.6730 3.6730 3.7092 3.7092 3.8157 3.8157 4.4654 4.4654 4.4965 4.4965 4.6467 4.6467 4.6937 4.6937 5.0188 5.0188 5.1094 5.1094 5.2117 5.2117 5.3030 5.3030 5.4352 5.4352 5.6110 5.6110 6.4856 6.4856 6.5873 6.5874 6.6791 6.6791 6.7656 6.7656 6.8004 6.8004 6.8157 6.8158 8.6211 8.6211 8.8037 8.8037 8.9050 8.9050 8.9804 8.9804 10.3036 10.3036 10.4597 10.4597 12.6977 12.6977 12.8206 12.8206 14.3388 14.3388 14.8358 14.8358 k = 0.0000 0.0000 0.1832 ( 3806 PWs) bands (ev): -5.2850 -5.2850 -5.1150 -5.1150 2.7924 2.7924 3.2075 3.2075 3.5771 3.5771 3.6884 3.6884 3.7708 3.7709 3.8424 3.8424 4.4602 4.4602 4.4993 4.4994 4.6395 4.6396 4.6982 4.6982 5.0042 5.0042 5.1130 5.1130 5.1987 5.1987 5.3020 5.3020 5.4311 5.4311 5.6346 5.6346 6.4697 6.4697 6.5921 6.5921 6.6726 6.6726 6.7790 6.7790 6.7976 6.7976 6.8166 6.8167 8.5957 8.5957 8.8156 8.8156 8.8878 8.8878 8.9803 8.9803 10.2706 10.2706 10.4548 10.4548 12.7320 12.7320 12.8836 12.8836 14.2852 14.2852 14.8161 14.8161 k = 0.0000 0.0000 0.1710 ( 3802 PWs) bands (ev): -5.3000 -5.3000 -5.0984 -5.0984 2.7273 2.7273 3.1948 3.1948 3.5725 3.5725 3.7150 3.7150 3.8354 3.8354 3.8740 3.8740 4.4545 4.4545 4.5019 4.5020 4.6321 4.6321 4.7027 4.7027 4.9887 4.9887 5.1130 5.1130 5.1869 5.1869 5.2986 5.2986 5.4334 5.4334 5.6570 5.6570 6.4540 6.4540 6.5942 6.5942 6.6667 6.6667 6.7849 6.7849 6.7999 6.7999 6.8201 6.8201 8.5705 8.5705 8.8128 8.8128 8.8805 8.8805 8.9789 8.9789 10.2386 10.2386 10.4449 10.4449 12.7748 12.7748 12.9547 12.9547 14.2347 14.2347 14.7912 14.7912 k = 0.0000 0.0000 0.1588 ( 3802 PWs) bands (ev): -5.3144 -5.3144 -5.0822 -5.0822 2.6649 2.6649 3.1795 3.1795 3.5632 3.5632 3.7487 3.7487 3.8830 3.8830 3.9258 3.9258 4.4483 4.4483 4.5043 4.5043 4.6245 4.6245 4.7074 4.7074 4.9720 4.9720 5.1091 5.1092 5.1764 5.1764 5.2954 5.2954 5.4401 5.4401 5.6779 5.6779 6.4386 6.4386 6.5934 6.5934 6.6615 6.6615 6.7823 6.7823 6.8042 6.8042 6.8302 6.8302 8.5456 8.5456 8.7913 8.7913 8.8871 8.8871 8.9767 8.9767 10.2083 10.2083 10.4309 10.4309 12.8246 12.8246 13.0328 13.0328 14.1874 14.1874 14.7657 14.7657 k = 0.0000 0.0000 0.1465 ( 3804 PWs) bands (ev): -5.3280 -5.3280 -5.0667 -5.0667 2.6055 2.6055 3.1632 3.1632 3.5522 3.5522 3.7860 3.7860 3.9147 3.9147 3.9939 3.9939 4.4415 4.4415 4.5064 4.5064 4.6167 4.6167 4.7127 4.7127 4.9533 4.9534 5.1022 5.1022 5.1678 5.1678 5.2944 5.2944 5.4493 5.4493 5.6972 5.6972 6.4238 6.4238 6.5894 6.5894 6.6567 6.6567 6.7779 6.7779 6.8050 6.8050 6.8457 6.8457 8.5211 8.5211 8.7598 8.7598 8.8997 8.8997 8.9739 8.9739 10.1805 10.1805 10.4136 10.4136 12.8798 12.8798 13.1169 13.1169 14.1434 14.1434 14.7400 14.7400 k = 0.0000 0.0000 0.1343 ( 3812 PWs) bands (ev): -5.3408 -5.3408 -5.0520 -5.0520 2.5497 2.5497 3.1468 3.1468 3.5408 3.5408 3.8253 3.8253 3.9440 3.9440 4.0624 4.0624 4.4340 4.4340 4.5082 4.5082 4.6087 4.6087 4.7189 4.7189 4.9324 4.9324 5.0936 5.0936 5.1616 5.1616 5.2960 5.2960 5.4596 5.4596 5.7148 5.7148 6.4097 6.4097 6.5821 6.5821 6.6523 6.6523 6.7734 6.7734 6.8042 6.8042 6.8629 6.8629 8.4973 8.4973 8.7234 8.7234 8.9135 8.9135 8.9707 8.9707 10.1556 10.1556 10.3941 10.3941 12.9388 12.9388 13.2060 13.2060 14.1027 14.1027 14.7144 14.7144 k = 0.0000 0.0000 0.1221 ( 3805 PWs) bands (ev): -5.3527 -5.3527 -5.0381 -5.0381 2.4978 2.4978 3.1310 3.1310 3.5299 3.5299 3.8656 3.8656 3.9733 3.9733 4.1269 4.1269 4.4259 4.4259 4.5097 4.5097 4.6005 4.6005 4.7265 4.7265 4.9089 4.9089 5.0849 5.0849 5.1583 5.1583 5.2999 5.2999 5.4703 5.4703 5.7305 5.7305 6.3964 6.3964 6.5716 6.5716 6.6484 6.6484 6.7694 6.7694 6.8029 6.8030 6.8806 6.8806 8.4744 8.4744 8.6847 8.6847 8.9269 8.9269 8.9673 8.9673 10.1338 10.1338 10.3732 10.3732 12.9999 12.9999 13.2991 13.2991 14.0655 14.0655 14.6890 14.6890 k = 0.0000 0.0000 0.1099 ( 3813 PWs) bands (ev): -5.3636 -5.3636 -5.0251 -5.0251 2.4500 2.4500 3.1161 3.1161 3.5196 3.5196 3.9061 3.9061 4.0031 4.0031 4.1849 4.1849 4.4169 4.4169 4.5107 4.5107 4.5922 4.5922 4.7356 4.7356 4.8830 4.8830 5.0773 5.0773 5.1589 5.1589 5.3052 5.3052 5.4807 5.4807 5.7442 5.7442 6.3840 6.3840 6.5578 6.5579 6.6446 6.6446 6.7660 6.7660 6.8013 6.8013 6.8979 6.8979 8.4527 8.4527 8.6450 8.6450 8.9393 8.9393 8.9641 8.9641 10.1152 10.1152 10.3519 10.3519 13.0616 13.0616 13.3951 13.3951 14.0316 14.0316 14.6641 14.6641 k = 0.0000 0.0000 0.0977 ( 3807 PWs) bands (ev): -5.3735 -5.3735 -5.0132 -5.0132 2.4067 2.4067 3.1024 3.1024 3.5101 3.5101 3.9464 3.9464 4.0334 4.0334 4.2347 4.2347 4.4073 4.4073 4.5110 4.5110 4.5840 4.5840 4.7457 4.7457 4.8557 4.8557 5.0712 5.0712 5.1642 5.1642 5.3114 5.3114 5.4906 5.4906 5.7558 5.7558 6.3727 6.3727 6.5413 6.5413 6.6413 6.6413 6.7634 6.7635 6.7996 6.7997 6.9145 6.9145 8.4323 8.4323 8.6059 8.6059 8.9495 8.9495 8.9621 8.9621 10.0995 10.0995 10.3309 10.3309 13.1225 13.1225 13.4928 13.4928 14.0013 14.0013 14.6398 14.6398 k = 0.0000 0.0000 0.0855 ( 3807 PWs) bands (ev): -5.3823 -5.3823 -5.0024 -5.0024 2.3680 2.3680 3.0900 3.0900 3.5017 3.5017 3.9856 3.9856 4.0647 4.0647 4.2749 4.2749 4.3973 4.3974 4.5102 4.5102 4.5760 4.5760 4.7551 4.7551 4.8291 4.8291 5.0664 5.0664 5.1747 5.1747 5.3179 5.3179 5.4997 5.4997 5.7652 5.7652 6.3625 6.3625 6.5224 6.5224 6.6382 6.6382 6.7615 6.7615 6.7980 6.7980 6.9301 6.9301 8.4136 8.4136 8.5683 8.5683 8.9531 8.9531 8.9656 8.9656 10.0866 10.0866 10.3109 10.3109 13.1809 13.1809 13.5907 13.5907 13.9744 13.9744 14.6165 14.6165 k = 0.0000 0.0000 0.0733 ( 3811 PWs) bands (ev): -5.3901 -5.3901 -4.9929 -4.9929 2.3341 2.3341 3.0791 3.0791 3.4942 3.4942 4.0231 4.0231 4.0968 4.0968 4.3044 4.3044 4.3881 4.3881 4.5078 4.5078 4.5687 4.5687 4.7583 4.7583 4.8091 4.8091 5.0627 5.0627 5.1906 5.1906 5.3243 5.3243 5.5079 5.5079 5.7723 5.7723 6.3534 6.3534 6.5019 6.5019 6.6355 6.6355 6.7602 6.7602 6.7964 6.7964 6.9442 6.9442 8.3968 8.3968 8.5333 8.5333 8.9515 8.9515 8.9734 8.9734 10.0762 10.0762 10.2924 10.2924 13.2355 13.2355 13.6869 13.6869 13.9512 13.9512 14.5946 14.5946 k = 0.0000 0.0000 0.0611 ( 3815 PWs) bands (ev): -5.3967 -5.3967 -4.9848 -4.9848 2.3052 2.3052 3.0697 3.0697 3.4879 3.4879 4.0579 4.0579 4.1298 4.1298 4.3211 4.3211 4.3821 4.3821 4.5031 4.5031 4.5625 4.5625 4.7464 4.7464 4.8046 4.8046 5.0597 5.0597 5.2108 5.2108 5.3302 5.3302 5.5149 5.5149 5.7771 5.7771 6.3456 6.3456 6.4810 6.4810 6.6332 6.6332 6.7593 6.7593 6.7950 6.7950 6.9567 6.9567 8.3820 8.3820 8.5021 8.5021 8.9491 8.9491 8.9808 8.9808 10.0680 10.0680 10.2760 10.2760 13.2849 13.2849 13.7792 13.7792 13.9317 13.9317 14.5745 14.5745 k = 0.0000 0.0000 0.0488 ( 3817 PWs) bands (ev): -5.4021 -5.4021 -4.9780 -4.9780 2.2814 2.2814 3.0620 3.0620 3.4827 3.4827 4.0895 4.0895 4.1628 4.1629 4.3235 4.3235 4.3824 4.3824 4.4956 4.4956 4.5579 4.5579 4.7260 4.7260 4.8098 4.8098 5.0573 5.0573 5.2335 5.2335 5.3357 5.3357 5.5208 5.5208 5.7800 5.7800 6.3391 6.3391 6.4610 6.4610 6.6312 6.6312 6.7588 6.7588 6.7937 6.7937 6.9674 6.9674 8.3696 8.3696 8.4754 8.4754 8.9470 8.9470 8.9872 8.9872 10.0618 10.0618 10.2620 10.2620 13.3276 13.3276 13.8630 13.8630 13.9173 13.9173 14.5567 14.5567 k = 0.0000 0.0000 0.0366 ( 3815 PWs) bands (ev): -5.4064 -5.4064 -4.9726 -4.9726 2.2627 2.2627 3.0559 3.0559 3.4786 3.4786 4.1172 4.1172 4.1946 4.1946 4.3158 4.3158 4.3865 4.3865 4.4858 4.4858 4.5549 4.5549 4.7064 4.7064 4.8162 4.8162 5.0555 5.0555 5.2558 5.2558 5.3405 5.3405 5.5253 5.5253 5.7810 5.7810 6.3341 6.3341 6.4433 6.4433 6.6297 6.6297 6.7585 6.7585 6.7927 6.7927 6.9759 6.9759 8.3598 8.3598 8.4538 8.4538 8.9452 8.9452 8.9922 8.9922 10.0571 10.0571 10.2508 10.2508 13.3625 13.3625 13.8980 13.8980 13.9447 13.9447 14.5418 14.5418 k = 0.0000 0.0000 0.0244 ( 3815 PWs) bands (ev): -5.4094 -5.4094 -4.9688 -4.9688 2.2493 2.2493 3.0515 3.0515 3.4757 3.4757 4.1400 4.1400 4.2227 4.2227 4.3044 4.3044 4.3900 4.3900 4.4751 4.4751 4.5532 4.5532 4.6910 4.6910 4.8214 4.8214 5.0542 5.0542 5.2744 5.2744 5.3446 5.3446 5.5286 5.5286 5.7810 5.7810 6.3304 6.3304 6.4293 6.4293 6.6286 6.6286 6.7584 6.7584 6.7919 6.7919 6.9821 6.9821 8.3526 8.3526 8.4381 8.4381 8.9439 8.9439 8.9958 8.9958 10.0540 10.0540 10.2426 10.2426 13.3884 13.3884 13.8910 13.8910 14.0020 14.0020 14.5305 14.5305 k = 0.0000 0.0000 0.0122 ( 3817 PWs) bands (ev): -5.4113 -5.4113 -4.9664 -4.9664 2.2413 2.2413 3.0489 3.0489 3.4739 3.4739 4.1557 4.1557 4.2433 4.2433 4.2942 4.2942 4.3913 4.3913 4.4666 4.4666 4.5524 4.5524 4.6814 4.6814 4.8246 4.8246 5.0534 5.0534 5.2866 5.2866 5.3475 5.3475 5.5305 5.5305 5.7806 5.7806 6.3282 6.3282 6.4203 6.4203 6.6280 6.6280 6.7583 6.7583 6.7915 6.7915 6.9858 6.9858 8.3483 8.3483 8.4285 8.4285 8.9431 8.9431 8.9980 8.9980 10.0522 10.0522 10.2377 10.2377 13.4044 13.4044 13.8859 13.8859 14.0403 14.0403 14.5234 14.5234 k = 0.0000 0.0000 0.0000 ( 3809 PWs) bands (ev): -5.4119 -5.4119 -4.9657 -4.9657 2.2386 2.2386 3.0480 3.0480 3.4733 3.4733 4.1616 4.1616 4.2514 4.2514 4.2897 4.2897 4.3914 4.3914 4.4633 4.4633 4.5521 4.5521 4.6782 4.6782 4.8257 4.8257 5.0532 5.0532 5.2908 5.2908 5.3486 5.3486 5.5312 5.5312 5.7803 5.7803 6.3275 6.3275 6.4173 6.4173 6.6278 6.6278 6.7584 6.7584 6.7914 6.7914 6.9871 6.9871 8.3468 8.3468 8.4252 8.4252 8.9428 8.9428 8.9987 8.9987 10.0516 10.0516 10.2360 10.2360 13.4098 13.4098 13.8842 13.8842 14.0537 14.0537 14.5210 14.5210 k = 0.0000 0.0000 0.0000 ( 3809 PWs) bands (ev): -5.4119 -5.4119 -4.9657 -4.9657 2.2386 2.2386 3.0480 3.0480 3.4733 3.4733 4.1616 4.1616 4.2514 4.2514 4.2897 4.2897 4.3914 4.3914 4.4633 4.4633 4.5521 4.5521 4.6782 4.6782 4.8257 4.8257 5.0532 5.0532 5.2908 5.2908 5.3486 5.3486 5.5312 5.5312 5.7803 5.7803 6.3275 6.3275 6.4173 6.4173 6.6278 6.6278 6.7584 6.7584 6.7914 6.7914 6.9871 6.9871 8.3468 8.3468 8.4252 8.4252 8.9428 8.9428 8.9987 8.9987 10.0516 10.0516 10.2360 10.2360 13.4098 13.4098 13.8842 13.8842 14.0537 14.0537 14.5210 14.5210 k =-0.0104 0.0064 0.0000 ( 3813 PWs) bands (ev): -5.4113 -5.4112 -4.9652 -4.9652 2.2393 2.2393 3.0475 3.0482 3.4734 3.4737 4.1564 4.1653 4.2427 4.2525 4.2774 4.2994 4.3838 4.3923 4.4600 4.4745 4.5489 4.5570 4.6739 4.6841 4.8229 4.8285 5.0522 5.0538 5.2664 5.2910 5.3488 5.3750 5.5302 5.5347 5.7773 5.7835 6.3273 6.3276 6.4156 6.4194 6.6274 6.6287 6.7576 6.7594 6.7907 6.7922 6.9869 6.9873 8.3446 8.3452 8.4215 8.4217 8.9412 8.9413 8.9972 8.9979 10.0342 10.0362 10.2592 10.2606 13.4053 13.4058 13.8878 13.8878 14.0495 14.0501 14.5191 14.5210 k =-0.0208 0.0128 0.0000 ( 3815 PWs) bands (ev): -5.4094 -5.4094 -4.9640 -4.9639 2.2413 2.2415 3.0467 3.0480 3.4738 3.4744 4.1495 4.1676 4.2276 4.2437 4.2648 4.3058 4.3733 4.3876 4.4623 4.4905 4.5468 4.5640 4.6713 4.6917 4.8203 4.8315 5.0507 5.0542 5.2390 5.2675 5.3750 5.4059 5.5315 5.5420 5.7742 5.7870 6.3271 6.3277 6.4144 6.4221 6.6276 6.6300 6.7572 6.7608 6.7904 6.7933 6.9867 6.9875 8.3385 8.3398 8.4108 8.4114 8.9362 8.9362 8.9934 8.9947 10.0003 10.0034 10.3148 10.3167 13.3925 13.3934 13.8985 13.8985 14.0376 14.0389 14.5148 14.5186 k =-0.0312 0.0191 0.0000 ( 3815 PWs) bands (ev): -5.4062 -5.4062 -4.9619 -4.9617 2.2448 2.2450 3.0454 3.0475 3.4745 3.4755 4.1406 4.1682 4.2069 4.2228 4.2546 4.3089 4.3636 4.3816 4.4657 4.5071 4.5463 4.5729 4.6708 4.7008 4.8177 4.8345 5.0486 5.0545 5.2129 5.2417 5.4051 5.4348 5.5354 5.5552 5.7709 5.7913 6.3269 6.3277 6.4137 6.4254 6.6282 6.6319 6.7573 6.7626 6.7903 6.7948 6.9865 6.9878 8.3285 8.3305 8.3941 8.3949 8.9266 8.9267 8.9873 8.9892 9.9671 9.9710 10.3856 10.3874 13.3714 13.3728 13.9162 13.9163 14.0191 14.0206 14.5063 14.5120 k =-0.0417 0.0255 0.0000 ( 3803 PWs) bands (ev): -5.4018 -5.4018 -4.9589 -4.9587 2.2496 2.2500 3.0439 3.0466 3.4757 3.4770 4.1284 4.1669 4.1826 4.1931 4.2451 4.3093 4.3558 4.3760 4.4680 4.5185 4.5511 4.5826 4.6729 4.7115 4.8154 4.8378 5.0460 5.0548 5.1893 5.2179 5.4333 5.4576 5.5429 5.5773 5.7672 5.7969 6.3266 6.3277 6.4136 6.4294 6.6294 6.6342 6.7578 6.7649 6.7905 6.7966 6.9864 6.9881 8.3141 8.3168 8.3725 8.3737 8.9113 8.9113 8.9788 8.9812 9.9417 9.9460 10.4644 10.4662 13.3425 13.3443 13.9399 13.9410 13.9954 13.9963 14.4909 14.4983 k =-0.0521 0.0319 0.0000 ( 3807 PWs) bands (ev): -5.3962 -5.3962 -4.9552 -4.9549 2.2558 2.2563 3.0419 3.0453 3.4771 3.4787 4.1099 4.1550 4.1586 4.1656 4.2359 4.3077 4.3494 4.3701 4.4690 4.5204 4.5643 4.5915 4.6778 4.7234 4.8134 4.8413 5.0427 5.0553 5.1684 5.1968 5.4562 5.4731 5.5552 5.6089 5.7630 5.8045 6.3262 6.3276 6.4139 6.4339 6.6310 6.6370 6.7586 6.7675 6.7910 6.7988 6.9862 6.9884 8.2949 8.2983 8.3478 8.3494 8.8891 8.8892 8.9678 8.9705 9.9267 9.9315 10.5483 10.5499 13.3061 13.3081 13.9556 13.9637 13.9760 13.9818 14.4652 14.4740 k =-0.0625 0.0383 0.0000 ( 3815 PWs) bands (ev): -5.3894 -5.3893 -4.9505 -4.9502 2.2633 2.2638 3.0395 3.0436 3.4787 3.4806 4.0818 4.1151 4.1392 4.1588 4.2278 4.3052 4.3433 4.3630 4.4691 4.5170 4.5814 4.5988 4.6856 4.7363 4.8118 4.8451 5.0389 5.0563 5.1503 5.1789 5.4724 5.4828 5.5722 5.6482 5.7583 5.8152 6.3257 6.3274 6.4146 6.4390 6.6331 6.6403 6.7598 6.7703 6.7918 6.8013 6.9859 6.9885 8.2705 8.2743 8.3217 8.3233 8.8597 8.8599 8.9541 8.9572 9.9232 9.9283 10.6356 10.6371 13.2625 13.2649 13.9278 13.9328 14.0120 14.0146 14.4262 14.4356 k =-0.0729 0.0447 0.0000 ( 3815 PWs) bands (ev): -5.3814 -5.3813 -4.9451 -4.9448 2.2720 2.2727 3.0366 3.0414 3.4806 3.4827 4.0452 4.0707 4.1242 4.1507 4.2210 4.3020 4.3368 4.3539 4.4687 4.5118 4.5988 4.6045 4.6958 4.7500 4.8108 4.8495 5.0348 5.0580 5.1349 5.1642 5.4827 5.4890 5.5914 5.6923 5.7532 5.8303 6.3252 6.3272 6.4159 6.4449 6.6357 6.6440 6.7615 6.7737 6.7929 6.8042 6.9858 6.9889 8.2408 8.2447 8.2952 8.2965 8.8229 8.8232 8.9380 8.9412 9.9310 9.9363 10.7253 10.7267 13.2125 13.2150 13.8925 13.8970 14.0566 14.0588 14.3723 14.3817 k =-0.0833 0.0510 0.0000 ( 3815 PWs) bands (ev): -5.3722 -5.3721 -4.9389 -4.9385 2.2820 2.2827 3.0333 3.0388 3.4826 3.4850 4.0034 4.0234 4.1113 4.1407 4.2155 4.2984 4.3296 4.3428 4.4678 4.5060 4.6091 4.6153 4.7075 4.7641 4.8106 4.8545 5.0305 5.0606 5.1220 5.1524 5.4892 5.4932 5.6091 5.7356 5.7515 5.8508 6.3246 6.3268 6.4175 6.4514 6.6386 6.6480 6.7636 6.7774 6.7943 6.8076 6.9857 6.9893 8.2068 8.2103 8.2682 8.2689 8.7794 8.7797 8.9195 8.9229 9.9491 9.9546 10.8165 10.8178 13.1564 13.1590 13.8551 13.8593 14.1076 14.1096 14.3045 14.3134 k =-0.0938 0.0574 0.0000 ( 3819 PWs) bands (ev): -5.3618 -5.3617 -4.9320 -4.9315 2.2931 2.2939 3.0293 3.0355 3.4846 3.4873 3.9582 3.9738 4.0993 4.1294 4.2106 4.2938 4.3213 4.3304 4.4666 4.5002 4.6130 4.6302 4.7199 4.7785 4.8115 4.8602 5.0266 5.0641 5.1113 5.1434 5.4934 5.4964 5.6230 5.7381 5.7922 5.8773 6.3238 6.3265 6.4196 6.4587 6.6419 6.6524 6.7660 6.7816 6.7962 6.8114 6.9857 6.9897 8.1695 8.1725 8.2401 8.2401 8.7299 8.7301 8.8989 8.9025 9.9762 9.9818 10.9082 10.9094 13.0948 13.0974 13.8168 13.8208 14.1645 14.1660 14.2255 14.2341 k =-0.1042 0.0638 0.0000 ( 3815 PWs) bands (ev): -5.3503 -5.3502 -4.9243 -4.9237 2.3052 2.3061 3.0246 3.0316 3.4866 3.4895 3.9107 3.9225 4.0878 4.1176 4.2058 4.2870 4.3123 4.3184 4.4650 4.4949 4.6164 4.6430 4.7322 4.7927 4.8138 4.8668 5.0235 5.0687 5.1026 5.1367 5.4965 5.4989 5.6321 5.7311 5.8430 5.9093 6.3231 6.3261 6.4221 6.4668 6.6455 6.6570 6.7690 6.7861 6.7985 6.8157 6.9857 6.9902 8.1298 8.1324 8.2099 8.2106 8.6754 8.6755 8.8765 8.8802 10.0108 10.0164 10.9997 11.0008 13.0283 13.0308 13.7784 13.7818 14.1393 14.1452 14.2269 14.2304 k =-0.1146 0.0702 0.0000 ( 3817 PWs) bands (ev): -5.3378 -5.3377 -4.9158 -4.9153 2.3183 2.3193 3.0192 3.0269 3.4884 3.4915 3.8616 3.8700 4.0768 4.1057 4.2005 4.2760 4.3029 4.3092 4.4631 4.4900 4.6194 4.6537 4.7442 4.8061 4.8178 4.8743 5.0216 5.0742 5.0961 5.1320 5.4986 5.5009 5.6368 5.7229 5.8952 5.9457 6.3221 6.3255 6.4249 6.4757 6.6495 6.6619 6.7723 6.7912 6.8014 6.8206 6.9857 6.9907 8.0884 8.0906 8.1779 8.1793 8.6169 8.6170 8.8524 8.8563 10.0513 10.0570 11.0902 11.0912 12.9574 12.9597 13.7396 13.7424 14.0507 14.0559 14.2945 14.2978 k =-0.1250 0.0766 0.0000 ( 3821 PWs) bands (ev): -5.3242 -5.3241 -4.9067 -4.9061 2.3323 2.3333 3.0129 3.0214 3.4898 3.4931 3.8114 3.8166 4.0663 4.0940 4.1942 4.2605 4.2935 4.3035 4.4610 4.4859 4.6219 4.6617 4.7556 4.8181 4.8242 4.8827 5.0213 5.0788 5.0929 5.1292 5.5003 5.5026 5.6379 5.7141 5.9481 5.9851 6.3211 6.3249 6.4280 6.4854 6.6537 6.6670 6.7762 6.7967 6.8049 6.8261 6.9857 6.9912 8.0459 8.0477 8.1442 8.1462 8.5552 8.5556 8.8269 8.8309 10.0964 10.1022 11.1787 11.1796 12.8827 12.8847 13.6993 13.7010 13.9648 13.9689 14.3668 14.3704 k =-0.1354 0.0829 0.0000 ( 3817 PWs) bands (ev): -5.3096 -5.3095 -4.8969 -4.8963 2.3471 2.3482 3.0055 3.0149 3.4907 3.4941 3.7608 3.7631 4.0567 4.0830 4.1865 4.2424 4.2848 4.2999 4.4587 4.4823 4.6239 4.6672 4.7662 4.8278 4.8335 4.8921 5.0229 5.0789 5.0967 5.1279 5.5016 5.5042 5.6362 5.7047 6.0011 6.0262 6.3200 6.3243 6.4313 6.4960 6.6581 6.6722 6.7806 6.8028 6.8091 6.8323 6.9858 6.9919 8.0026 8.0040 8.1088 8.1114 8.4912 8.4919 8.8000 8.8042 10.1450 10.1507 11.2643 11.2651 12.8046 12.8063 13.6536 13.6538 13.8889 13.8915 14.4433 14.4475 k =-0.1458 0.0893 0.0000 ( 3815 PWs) bands (ev): -5.2941 -5.2939 -4.8865 -4.8858 2.3625 2.3636 2.9970 3.0071 3.4907 3.4940 3.7101 3.7106 4.0478 4.0729 4.1775 4.2232 4.2771 4.2974 4.4563 4.4792 4.6252 4.6704 4.7761 4.8371 4.8431 4.9023 5.0265 5.0763 5.1055 5.1282 5.5027 5.5057 5.6324 5.6948 6.0539 6.0678 6.3187 6.3236 6.4348 6.5075 6.6627 6.6774 6.7857 6.8095 6.8140 6.8390 6.9860 6.9926 7.9586 7.9596 8.0718 8.0750 8.4256 8.4267 8.7721 8.7764 10.1958 10.2016 11.3461 11.3468 12.7236 12.7249 13.5957 13.5973 13.8311 13.8320 14.5228 14.5281 k =-0.1562 0.0957 0.0000 ( 3823 PWs) bands (ev): -5.2776 -5.2775 -4.8755 -4.8748 2.3784 2.3796 2.9870 2.9979 3.4889 3.4920 3.6587 3.6619 4.0400 4.0637 4.1672 4.2038 4.2706 4.2954 4.4538 4.4764 4.6257 4.6715 4.7852 4.8472 4.8515 4.9133 5.0322 5.0736 5.1162 5.1300 5.5035 5.5070 5.6271 5.6846 6.1060 6.1088 6.3174 6.3230 6.4383 6.5198 6.6674 6.6827 6.7915 6.8170 6.8198 6.8464 6.9862 6.9934 7.9142 7.9147 8.0333 8.0371 8.3589 8.3605 8.7432 8.7477 10.2481 10.2539 11.4231 11.4237 12.6403 12.6411 13.5246 13.5278 13.7955 13.7959 14.6035 14.6109 k =-0.1667 0.1021 0.0000 ( 3827 PWs) bands (ev): -5.2603 -5.2602 -4.8640 -4.8632 2.3947 2.3959 2.9753 2.9870 3.4839 3.4868 3.6109 3.6166 4.0334 4.0558 4.1561 4.1848 4.2652 4.2936 4.4513 4.4739 4.6255 4.6707 4.7936 4.8566 4.8600 4.9250 5.0397 5.0714 5.1282 5.1334 5.5040 5.5083 5.6207 5.6742 6.1482 6.1569 6.3162 6.3226 6.4419 6.5328 6.6721 6.6879 6.7984 6.8256 6.8265 6.8545 6.9866 6.9944 7.8695 7.8695 7.9934 7.9979 8.2917 8.2939 8.7135 8.7181 10.3008 10.3067 11.4945 11.4949 12.5551 12.5553 13.4446 13.4487 13.7806 13.7813 14.6785 14.6910 k =-0.1771 0.1085 0.0000 ( 3819 PWs) bands (ev): -5.2422 -5.2421 -4.8519 -4.8512 2.4113 2.4125 2.9618 2.9742 3.4724 3.4752 3.5705 3.5782 4.0280 4.0491 4.1449 4.1668 4.2609 4.2919 4.4487 4.4715 4.6246 4.6686 4.8011 4.8621 4.8716 4.9373 5.0485 5.0700 5.1386 5.1412 5.5044 5.5096 5.6138 5.6639 6.1852 6.2059 6.3155 6.3226 6.4454 6.5466 6.6768 6.6932 6.8066 6.8341 6.8354 6.8632 6.9871 6.9955 7.8241 7.8246 7.9525 7.9575 8.2245 8.2272 8.6832 8.6878 10.3533 10.3592 11.5593 11.5595 12.4680 12.4683 13.3612 13.3658 13.7831 13.7837 14.7201 14.7435 k =-0.1875 0.1148 0.0000 ( 3821 PWs) bands (ev): -5.2234 -5.2232 -4.8394 -4.8386 2.4279 2.4291 2.9458 2.9587 3.4494 3.4533 3.5428 3.5513 4.0241 4.0437 4.1340 4.1500 4.2573 4.2902 4.4461 4.4692 4.6229 4.6652 4.8078 4.8655 4.8843 4.9500 5.0580 5.0693 5.1456 5.1547 5.5047 5.5109 5.6064 5.6537 6.2185 6.2511 6.3166 6.3236 6.4489 6.5607 6.6814 6.6982 6.8166 6.8427 6.8465 6.8726 6.9877 6.9968 7.7785 7.7796 7.9104 7.9160 8.1575 8.1609 8.6522 8.6570 10.4048 10.4107 11.6169 11.6171 12.3797 12.3805 13.2783 13.2831 13.8005 13.8006 14.7008 14.7251 k =-0.1979 0.1212 0.0000 ( 3813 PWs) bands (ev): -5.2039 -5.2038 -4.8265 -4.8257 2.4445 2.4456 2.9270 2.9404 3.4159 3.4217 3.5277 3.5357 4.0215 4.0397 4.1240 4.1349 4.2542 4.2885 4.4434 4.4668 4.6205 4.6608 4.8138 4.8676 4.8976 4.9629 5.0678 5.0695 5.1545 5.1688 5.5049 5.5124 5.5990 5.6438 6.2467 6.2849 6.3266 6.3267 6.4523 6.5748 6.6859 6.7031 6.8287 6.8524 6.8592 6.8828 6.9888 6.9984 7.7327 7.7345 7.8674 7.8737 8.0912 8.0953 8.6209 8.6258 10.4545 10.4606 11.6670 11.6671 12.2907 12.2921 13.1984 13.2034 13.8304 13.8312 14.6552 14.6760 k =-0.2083 0.1276 0.0000 ( 3825 PWs) bands (ev): -5.1838 -5.1837 -4.8132 -4.8124 2.4609 2.4618 2.9052 2.9187 3.3782 3.3858 3.5193 3.5266 4.0204 4.0370 4.1153 4.1217 4.2515 4.2867 4.4407 4.4643 4.6175 4.6556 4.8188 4.8686 4.9111 4.9760 5.0705 5.0773 5.1651 5.1829 5.5050 5.5140 5.5917 5.6344 6.2676 6.2957 6.3333 6.3568 6.4555 6.5884 6.6901 6.7077 6.8428 6.8633 6.8732 6.8937 6.9902 7.0004 7.6869 7.6893 7.8236 7.8304 8.0260 8.0308 8.5892 8.5941 10.5019 10.5080 11.7094 11.7094 12.2015 12.2034 13.1230 13.1281 13.8720 13.8741 14.6028 14.6203 k =-0.2188 0.1340 0.0000 ( 3821 PWs) bands (ev): -5.1633 -5.1631 -4.7996 -4.7987 2.4768 2.4775 2.8800 2.8932 3.3413 3.3501 3.5135 3.5203 4.0207 4.0355 4.1086 4.1107 4.2490 4.2847 4.4379 4.4617 4.6140 4.6498 4.8231 4.8688 4.9248 4.9891 5.0724 5.0866 5.1773 5.1970 5.5052 5.5159 5.5850 5.6257 6.2799 6.2964 6.3450 6.3936 6.4586 6.6011 6.6940 6.7119 6.8584 6.8762 6.8884 6.9058 6.9925 7.0031 7.6412 7.6444 7.7791 7.7863 7.9623 7.9679 8.5574 8.5624 10.5463 10.5525 11.7441 11.7443 12.1127 12.1149 13.0533 13.0585 13.9241 13.9280 14.5485 14.5627 k =-0.2292 0.1404 0.0000 ( 3820 PWs) bands (ev): -5.1422 -5.1421 -4.7858 -4.7848 2.4922 2.4924 2.8514 2.8638 3.3072 3.3167 3.5086 3.5148 4.0223 4.0351 4.1022 4.1040 4.2466 4.2827 4.4350 4.4590 4.6099 4.6433 4.8266 4.8683 4.9385 5.0019 5.0753 5.0955 5.1905 5.2107 5.5056 5.5183 5.5790 5.6180 6.2854 6.2948 6.3602 6.4284 6.4621 6.6125 6.6975 6.7155 6.8738 6.8923 6.9036 6.9194 6.9963 7.0069 7.5956 7.5996 7.7340 7.7414 7.9005 7.9068 8.5255 8.5305 10.5870 10.5934 11.7712 11.7719 12.0251 12.0271 12.9903 12.9955 13.9850 13.9916 14.4942 14.5043 k =-0.2396 0.1467 0.0000 ( 3820 PWs) bands (ev): -5.1208 -5.1207 -4.7717 -4.7707 2.5063 2.5067 2.8194 2.8305 3.2769 3.2865 3.5037 3.5096 4.0252 4.0359 4.0963 4.1018 4.2444 4.2806 4.4320 4.4561 4.6054 4.6365 4.8294 4.8673 4.9520 5.0143 5.0792 5.1040 5.2043 5.2239 5.5061 5.5211 5.5739 5.6113 6.2869 6.2923 6.3759 6.4551 6.4702 6.6222 6.7006 6.7185 6.8877 6.9116 6.9178 6.9342 7.0032 7.0126 7.5502 7.5552 7.6884 7.6956 7.8410 7.8479 8.4936 8.4987 10.6237 10.6302 11.7896 11.7922 11.9405 11.9411 12.9347 12.9399 14.0520 14.0634 14.4417 14.4459 k =-0.2500 0.1531 0.0000 ( 3830 PWs) bands (ev): -5.0992 -5.0990 -4.7574 -4.7565 2.5189 2.5203 2.7844 2.7937 3.2506 3.2599 3.4988 3.5042 4.0291 4.0377 4.0931 4.1022 4.2421 4.2784 4.4289 4.4530 4.6005 4.6292 4.8314 4.8659 4.9652 5.0260 5.0841 5.1124 5.2181 5.2361 5.5070 5.5243 5.5699 5.6059 6.2864 6.2895 6.3907 6.4624 6.4939 6.6302 6.7033 6.7209 6.9008 6.9311 6.9315 6.9477 7.0153 7.0218 7.5050 7.5111 7.6425 7.6490 7.7842 7.7915 8.4619 8.4670 10.6558 10.6625 11.7911 11.8010 11.8619 11.8684 12.8873 12.8924 14.1201 14.1410 14.3882 14.3946 k =-0.2604 0.1595 0.0000 ( 3842 PWs) bands (ev): -5.0773 -5.0772 -4.7431 -4.7421 2.5296 2.5326 2.7474 2.7540 3.2282 3.2370 3.4935 3.4986 4.0340 4.0407 4.0927 4.1049 4.2400 4.2761 4.4257 4.4496 4.5952 4.6216 4.8326 4.8640 4.9781 5.0368 5.0901 5.1208 5.2313 5.2471 5.5086 5.5285 5.5671 5.6018 6.2849 6.2863 6.4038 6.4647 6.5185 6.6366 6.7053 6.7227 6.9135 6.9437 6.9485 6.9573 7.0344 7.0361 7.4603 7.4677 7.5965 7.6016 7.7305 7.7379 8.4304 8.4356 10.6830 10.6900 11.7428 11.7570 11.8320 11.8424 12.8487 12.8536 14.1760 14.2199 14.3340 14.3646 k =-0.2708 0.1659 0.0000 ( 3842 PWs) bands (ev): -5.0554 -5.0553 -4.7287 -4.7277 2.5375 2.5431 2.7098 2.7126 3.2093 3.2173 3.4879 3.4926 4.0401 4.0451 4.0949 4.1097 4.2380 4.2739 4.4225 4.4461 4.5896 4.6138 4.8332 4.8619 4.9904 5.0466 5.0973 5.1291 5.2436 5.2568 5.5111 5.5334 5.5657 5.5994 6.2827 6.2829 6.4153 6.4661 6.5401 6.6417 6.7070 6.7240 6.9261 6.9561 6.9606 6.9630 7.0563 7.0597 7.4162 7.4250 7.5510 7.5537 7.6800 7.6873 8.3993 8.4044 10.7052 10.7124 11.6664 11.6782 11.8343 11.8421 12.8192 12.8240 14.1898 14.2539 14.3275 14.3792 k =-0.2812 0.1723 0.0000 ( 3848 PWs) bands (ev): -5.0335 -5.0333 -4.7143 -4.7134 2.5406 2.5506 2.6713 2.6741 3.1935 3.2007 3.4820 3.4863 4.0473 4.0508 4.0993 4.1165 4.2362 4.2719 4.4192 4.4424 4.5838 4.6058 4.8333 4.8595 5.0021 5.0553 5.1055 5.1375 5.2544 5.2649 5.5147 5.5394 5.5658 5.5987 6.2794 6.2801 6.4252 6.4670 6.5587 6.6455 6.7080 6.7247 6.9387 6.9655 6.9681 6.9689 7.0805 7.0889 7.3728 7.3834 7.5057 7.5066 7.6327 7.6397 8.3686 8.3738 10.7223 10.7298 11.5869 11.5981 11.8361 11.8431 12.7993 12.8039 14.1603 14.2058 14.4034 14.4375 k =-0.2917 0.1786 0.0000 ( 3844 PWs) bands (ev): -5.0116 -5.0115 -4.7000 -4.6991 2.5349 2.5514 2.6344 2.6449 3.1803 3.1866 3.4759 3.4798 4.0558 4.0581 4.1056 4.1246 4.2349 4.2703 4.4158 4.4385 4.5777 4.5978 4.8328 4.8569 5.0131 5.0630 5.1145 5.1460 5.2636 5.2712 5.5197 5.5463 5.5676 5.5999 6.2757 6.2772 6.4337 6.4674 6.5744 6.6483 6.7086 6.7249 6.9511 6.9674 6.9725 6.9808 7.1056 7.1200 7.3304 7.3434 7.4583 7.4643 7.5886 7.5952 8.3386 8.3437 10.7345 10.7421 11.5086 11.5197 11.8354 11.8420 12.7890 12.7934 14.1148 14.1506 14.4842 14.5095 k =-0.3021 0.1850 0.0000 ( 3834 PWs) bands (ev): -4.9900 -4.9899 -4.6859 -4.6849 2.5157 2.5367 2.6115 2.6276 3.1693 3.1747 3.4696 3.4731 4.0658 4.0669 4.1132 4.1339 4.2342 4.2691 4.4124 4.4345 4.5714 4.5897 4.8318 4.8540 5.0233 5.0697 5.1240 5.1544 5.2707 5.2757 5.5261 5.5543 5.5711 5.6030 6.2720 6.2742 6.4409 6.4675 6.5877 6.6501 6.7086 6.7247 6.9633 6.9680 6.9748 6.9926 7.1280 7.1511 7.2896 7.3054 7.4125 7.4259 7.5475 7.5540 8.3092 8.3143 10.7419 10.7498 11.4325 11.4437 11.8320 11.8385 12.7883 12.7924 14.0647 14.0951 14.5602 14.5812 k =-0.3125 0.1914 0.0000 ( 3842 PWs) bands (ev): -4.9687 -4.9686 -4.6719 -4.6710 2.4842 2.5035 2.6059 2.6213 3.1601 3.1647 3.4631 3.4663 4.0770 4.0771 4.1216 4.1436 4.2345 4.2687 4.4090 4.4303 4.5650 4.5816 4.8304 4.8510 5.0326 5.0754 5.1338 5.1627 5.2757 5.2782 5.5339 5.5630 5.5761 5.6080 6.2682 6.2709 6.4468 6.4672 6.5988 6.6511 6.7080 6.7239 6.9678 6.9743 6.9763 7.0040 7.1436 7.1790 7.2513 7.2703 7.3699 7.3936 7.5092 7.5163 8.2805 8.2855 10.7450 10.7532 11.3592 11.3705 11.8264 11.8328 12.7969 12.8008 14.0132 14.0402 14.6277 14.6462 k =-0.3229 0.1978 0.0000 ( 3844 PWs) bands (ev): -4.9478 -4.9477 -4.6583 -4.6573 2.4462 2.4625 2.6075 2.6207 3.1524 3.1563 3.4565 3.4593 4.0881 4.0895 4.1303 4.1534 4.2363 4.2695 4.4055 4.4260 4.5584 4.5736 4.8287 4.8477 5.0409 5.0803 5.1436 5.1709 5.2787 5.2790 5.5430 5.5725 5.5830 5.6149 6.2643 6.2675 6.4517 6.4666 6.6080 6.6515 6.7069 6.7226 6.9670 6.9749 6.9863 7.0146 7.1475 7.1910 7.2246 7.2389 7.3344 7.3706 7.4739 7.4829 8.2526 8.2576 10.7442 10.7527 11.2890 11.3004 11.8190 11.8252 12.8143 12.8179 13.9618 13.9862 14.6834 14.7004 k =-0.3333 0.2042 0.0000 ( 3852 PWs) bands (ev): -4.9274 -4.9273 -4.6449 -4.6440 2.4059 2.4196 2.6109 2.6223 3.1460 3.1493 3.4499 3.4524 4.0996 4.1026 4.1393 4.1629 4.2401 4.2717 4.4021 4.4215 4.5517 4.5657 4.8266 4.8444 5.0483 5.0844 5.1534 5.1788 5.2783 5.2798 5.5533 5.5825 5.5915 5.6236 6.2604 6.2641 6.4555 6.4656 6.6155 6.6512 6.7053 6.7207 6.9655 6.9730 6.9962 7.0236 7.1377 7.1669 7.2110 7.2202 7.3156 7.3575 7.4418 7.4560 8.2257 8.2306 10.7402 10.7489 11.2222 11.2337 11.8101 11.8162 12.8399 12.8432 13.9110 13.9335 14.7249 14.7409 k =-0.3438 0.2105 0.0000 ( 3860 PWs) bands (ev): -4.9076 -4.9075 -4.6319 -4.6311 2.3652 2.3769 2.6144 2.6244 3.1407 3.1435 3.4434 3.4455 4.1105 4.1151 4.1490 4.1724 4.2464 4.2757 4.3987 4.4170 4.5450 4.5580 4.8244 4.8409 5.0547 5.0877 5.1629 5.1863 5.2761 5.2793 5.5645 5.5929 5.6015 5.6339 6.2565 6.2605 6.4585 6.4644 6.6215 6.6504 6.7030 6.7182 6.9635 6.9694 7.0046 7.0298 7.1182 7.1365 7.1851 7.2025 7.3194 7.3487 7.4146 7.4395 8.1999 8.2046 10.7335 10.7425 11.1591 11.1706 11.8002 11.8062 12.8729 12.8759 13.8613 13.8823 14.7507 14.7658 k =-0.3542 0.2169 0.0000 ( 3860 PWs) bands (ev): -4.8885 -4.8884 -4.6194 -4.6186 2.3251 2.3352 2.6176 2.6265 3.1363 3.1387 3.4370 3.4388 4.1198 4.1252 4.1607 4.1827 4.2553 4.2818 4.3955 4.4125 4.5383 4.5506 4.8220 4.8373 5.0602 5.0902 5.1723 5.1936 5.2728 5.2774 5.5764 5.6036 5.6130 5.6455 6.2527 6.2570 6.4607 6.4629 6.6263 6.6492 6.7002 6.7151 6.9607 6.9637 7.0105 7.0295 7.0953 7.1119 7.1609 7.1746 7.3283 7.3357 7.3979 7.4375 8.1752 8.1798 10.7248 10.7339 11.0999 11.1114 11.7897 11.7955 12.9126 12.9153 13.8131 13.8328 14.7601 14.7744 k =-0.3646 0.2233 0.0000 ( 3858 PWs) bands (ev): -4.8702 -4.8702 -4.6074 -4.6066 2.2863 2.2951 2.6202 2.6282 3.1328 3.1347 3.4308 3.4324 4.1261 4.1315 4.1753 4.1947 4.2663 4.2898 4.3924 4.4080 4.5316 4.5434 4.8195 4.8336 5.0648 5.0920 5.1813 5.2003 5.2686 5.2745 5.5888 5.6144 5.6258 5.6582 6.2490 6.2535 6.4613 6.4622 6.6299 6.6477 6.6968 6.7112 6.9552 6.9571 7.0121 7.0178 7.0736 7.0989 7.1403 7.1460 7.3172 7.3230 7.4011 7.4470 8.1517 8.1561 10.7145 10.7237 11.0448 11.0562 11.7789 11.7845 12.9583 12.9606 13.7665 13.7852 14.7536 14.7671 k =-0.3750 0.2297 0.0000 ( 3850 PWs) bands (ev): -4.8529 -4.8529 -4.5960 -4.5952 2.2493 2.2570 2.6223 2.6295 3.1300 3.1316 3.4249 3.4261 4.1293 4.1342 4.1925 4.2090 4.2789 4.2997 4.3895 4.4037 4.5249 4.5364 4.8170 4.8300 5.0684 5.0930 5.1899 5.2064 5.2638 5.2710 5.6013 5.6251 5.6395 5.6718 6.2455 6.2502 6.4596 6.4631 6.6324 6.6459 6.6927 6.7065 6.9435 6.9525 6.9958 7.0071 7.0566 7.0950 7.1216 7.1254 7.2968 7.3060 7.4184 7.4623 8.1296 8.1338 10.7031 10.7124 10.9938 11.0051 11.7681 11.7735 13.0093 13.0112 13.7220 13.7399 14.7323 14.7452 k =-0.3854 0.2361 0.0000 ( 3846 PWs) bands (ev): -4.8365 -4.8365 -4.5852 -4.5845 2.2143 2.2210 2.6239 2.6304 3.1278 3.1291 3.4192 3.4202 4.1298 4.1343 4.2112 4.2252 4.2924 4.3109 4.3868 4.3995 4.5183 4.5297 4.8145 4.8263 5.0712 5.0933 5.1979 5.2116 5.2587 5.2672 5.6137 5.6357 5.6541 5.6857 6.2421 6.2469 6.4577 6.4633 6.6339 6.6437 6.6879 6.7008 6.9287 6.9465 6.9696 6.9951 7.0455 7.0865 7.1104 7.1169 7.2767 7.2862 7.4396 7.4794 8.1089 8.1129 10.6913 10.7006 10.9471 10.9583 11.7576 11.7627 13.0651 13.0663 13.6798 13.6971 14.6974 14.7109 k =-0.3958 0.2424 0.0000 ( 3840 PWs) bands (ev): -4.8213 -4.8213 -4.5751 -4.5744 2.1816 2.1875 2.6250 2.6308 3.1262 3.1272 3.4139 3.4147 4.1284 4.1326 4.2306 4.2426 4.3062 4.3231 4.3844 4.3956 4.5118 4.5233 4.8120 4.8226 5.0732 5.0929 5.2053 5.2157 5.2536 5.2637 5.6259 5.6459 5.6692 5.6999 6.2389 6.2437 6.4559 6.4632 6.6344 6.6413 6.6825 6.6941 6.9117 6.9381 6.9443 6.9790 7.0382 7.0702 7.1128 7.1137 7.2582 7.2671 7.4608 7.4965 8.0896 8.0934 10.6793 10.6885 10.9048 10.9157 11.7476 11.7524 13.1249 13.1253 13.6401 13.6573 14.6509 14.6658 k =-0.4062 0.2488 0.0000 ( 3844 PWs) bands (ev): -4.8073 -4.8072 -4.5658 -4.5651 2.1515 2.1566 2.6258 2.6309 3.1249 3.1258 3.4090 3.4095 4.1259 4.1298 4.2500 4.2607 4.3199 4.3356 4.3824 4.3921 4.5054 4.5172 4.8096 4.8190 5.0744 5.0918 5.2116 5.2184 5.2490 5.2609 5.6375 5.6555 5.6844 5.7139 6.2359 6.2406 6.4541 6.4627 6.6340 6.6387 6.6766 6.6865 6.8937 6.9161 6.9327 6.9621 7.0329 7.0554 7.1136 7.1177 7.2419 7.2496 7.4808 7.5126 8.0719 8.0754 10.6676 10.6766 10.8669 10.8773 11.7382 11.7426 13.1875 13.1883 13.6034 13.6208 14.5958 14.6107 k =-0.4167 0.2552 0.0000 ( 3848 PWs) bands (ev): -4.7945 -4.7945 -4.5573 -4.5567 2.1240 2.1284 2.6262 2.6308 3.1241 3.1248 3.4044 3.4049 4.1226 4.1262 4.2688 4.2787 4.3327 4.3481 4.3807 4.3892 4.4992 4.5111 4.8073 4.8156 5.0750 5.0902 5.2163 5.2195 5.2456 5.2592 5.6485 5.6644 5.6997 5.7275 6.2332 6.2377 6.4525 6.4618 6.6325 6.6356 6.6703 6.6783 6.8760 6.8926 6.9240 6.9461 7.0289 7.0435 7.1147 7.1224 7.2283 7.2345 7.4991 7.5272 8.0559 8.0591 10.6565 10.6651 10.8333 10.8433 11.7296 11.7336 13.2520 13.2548 13.5698 13.5884 14.5336 14.5481 k =-0.4271 0.2616 0.0000 ( 3846 PWs) bands (ev): -4.7830 -4.7830 -4.5496 -4.5491 2.0995 2.1032 2.6265 2.6304 3.1236 3.1241 3.4004 3.4006 4.1190 4.1223 4.2867 4.2962 4.3442 4.3602 4.3798 4.3874 4.4931 4.5053 4.8052 4.8123 5.0751 5.0882 5.2187 5.2190 5.2444 5.2588 5.6586 5.6725 5.7146 5.7403 6.2307 6.2350 6.4511 6.4608 6.6297 6.6319 6.6642 6.6700 6.8597 6.8716 6.9155 6.9317 7.0256 7.0344 7.1159 7.1261 7.2175 7.2220 7.5154 7.5399 8.0416 8.0445 10.6462 10.6544 10.8041 10.8134 11.7218 11.7254 13.3172 13.3235 13.5400 13.5613 14.4657 14.4797 k =-0.4375 0.2680 0.0000 ( 3850 PWs) bands (ev): -4.7730 -4.7729 -4.5428 -4.5424 2.0780 2.0811 2.6266 2.6299 3.1232 3.1237 3.3967 3.3969 4.1154 4.1184 4.3031 4.3129 4.3532 4.3712 4.3798 4.3873 4.4874 4.4996 4.8032 4.8092 5.0747 5.0858 5.2176 5.2186 5.2455 5.2592 5.6678 5.6797 5.7289 5.7519 6.2286 6.2325 6.4500 6.4596 6.6256 6.6273 6.6587 6.6623 6.8452 6.8535 6.9075 6.9193 7.0229 7.0276 7.1166 7.1281 7.2097 7.2124 7.5298 7.5507 8.0291 8.0316 10.6370 10.6445 10.7791 10.7876 11.7150 11.7182 13.3794 13.3932 13.5151 13.5432 14.3935 14.4071 k =-0.4479 0.2743 0.0000 ( 3862 PWs) bands (ev): -4.7643 -4.7643 -4.5370 -4.5366 2.0596 2.0622 2.6265 2.6294 3.1231 3.1235 3.3936 3.3938 4.1121 4.1146 4.3176 4.3283 4.3588 4.3775 4.3841 4.3897 4.4819 4.4941 4.8015 4.8065 5.0741 5.0832 5.2155 5.2168 5.2482 5.2601 5.6758 5.6857 5.7421 5.7621 6.2267 6.2302 6.4492 6.4583 6.6201 6.6216 6.6543 6.6559 6.8328 6.8383 6.9004 6.9089 7.0206 7.0227 7.1165 7.1283 7.2044 7.2057 7.5421 7.5596 8.0184 8.0206 10.6290 10.6358 10.7584 10.7659 11.7092 11.7119 13.4267 13.4539 13.5045 13.5454 14.3184 14.3316 k =-0.4583 0.2807 0.0000 ( 3858 PWs) bands (ev): -4.7572 -4.7572 -4.5322 -4.5319 2.0445 2.0466 2.6265 2.6288 3.1231 3.1234 3.3911 3.3911 4.1091 4.1112 4.3295 4.3419 4.3613 4.3792 4.3923 4.3943 4.4772 4.4886 4.8001 4.8040 5.0735 5.0807 5.2134 5.2146 5.2514 5.2611 5.6827 5.6906 5.7541 5.7707 6.2253 6.2282 6.4488 6.4570 6.6142 6.6152 6.6510 6.6514 6.8227 6.8261 6.8946 6.9005 7.0186 7.0191 7.1162 7.1270 7.2012 7.2016 7.5524 7.5664 8.0097 8.0114 10.6225 10.6282 10.7418 10.7482 11.7045 11.7067 13.4428 13.4603 13.5534 13.5840 14.2418 14.2546 k =-0.4688 0.2871 0.0000 ( 3854 PWs) bands (ev): -4.7517 -4.7516 -4.5284 -4.5282 2.0328 2.0343 2.6265 2.6282 3.1231 3.1233 3.3891 3.3891 4.1068 4.1084 4.3388 4.3525 4.3629 4.3808 4.3994 4.3995 4.4734 4.4834 4.7991 4.8020 5.0729 5.0783 5.2116 5.2125 5.2546 5.2618 5.6884 5.6943 5.7643 5.7771 6.2243 6.2266 6.4489 6.4556 6.6083 6.6089 6.6484 6.6486 6.8148 6.8168 6.8901 6.8941 7.0166 7.0170 7.1157 7.1247 7.1994 7.1995 7.5608 7.5713 8.0029 8.0042 10.6175 10.6220 10.7293 10.7342 11.7008 11.7025 13.4400 13.4482 13.6245 13.6452 14.1657 14.1778 k =-0.4792 0.2935 0.0000 ( 3854 PWs) bands (ev): -4.7477 -4.7476 -4.5257 -4.5255 2.0244 2.0254 2.6266 2.6277 3.1232 3.1233 3.3876 3.3876 4.1051 4.1062 4.3455 4.3562 4.3682 4.3820 4.4041 4.4047 4.4709 4.4786 4.7984 4.8004 5.0727 5.0762 5.2102 5.2108 5.2573 5.2621 5.6927 5.6967 5.7725 5.7812 6.2237 6.2253 6.4494 6.4542 6.6035 6.6037 6.6466 6.6469 6.8092 6.8103 6.8869 6.8895 7.0151 7.0156 7.1157 7.1220 7.1984 7.1987 7.5672 7.5742 7.9981 7.9990 10.6142 10.6173 10.7207 10.7241 11.6983 11.6994 13.4339 13.4380 13.6953 13.7106 14.0932 14.1043 k =-0.4896 0.2999 0.0000 ( 3846 PWs) bands (ev): -4.7452 -4.7452 -4.5240 -4.5239 2.0194 2.0199 2.6268 2.6273 3.1233 3.1233 3.3867 3.3867 4.1042 4.1047 4.3501 4.3555 4.3750 4.3820 4.4073 4.4078 4.4702 4.4744 4.7983 4.7992 5.0728 5.0746 5.2094 5.2097 5.2595 5.2618 5.6958 5.6978 5.7785 5.7829 6.2235 6.2243 6.4503 6.4527 6.6002 6.6003 6.6457 6.6459 6.8060 6.8064 6.8853 6.8865 7.0143 7.0147 7.1163 7.1196 7.1982 7.1984 7.5718 7.5753 7.9953 7.9957 10.6125 10.6141 10.7159 10.7176 11.6968 11.6974 13.4296 13.4313 13.7571 13.7670 14.0331 14.0412 k =-0.5000 0.3062 0.0000 ( 3850 PWs) bands (ev): -4.7444 -4.7444 -4.5234 -4.5234 2.0179 2.0179 2.6270 2.6270 3.1233 3.1233 3.3864 3.3864 4.1040 4.1040 4.3533 4.3533 4.3797 4.3797 4.4086 4.4086 4.4715 4.4715 4.7985 4.7985 5.0734 5.0734 5.2092 5.2092 5.2609 5.2609 5.6975 5.6975 5.7820 5.7820 6.2237 6.2237 6.4514 6.4514 6.5991 6.5991 6.6455 6.6455 6.8050 6.8050 6.8851 6.8851 7.0142 7.0142 7.1175 7.1175 7.1982 7.1982 7.5745 7.5745 7.9945 7.9945 10.6124 10.6124 10.7149 10.7149 11.6965 11.6965 13.4286 13.4286 13.7891 13.7891 14.0092 14.0092 k =-0.5000 0.3062 0.0000 ( 3850 PWs) bands (ev): -4.7444 -4.7444 -4.5234 -4.5234 2.0179 2.0179 2.6270 2.6270 3.1233 3.1233 3.3864 3.3864 4.1040 4.1040 4.3533 4.3533 4.3797 4.3797 4.4086 4.4086 4.4715 4.4715 4.7985 4.7985 5.0734 5.0734 5.2092 5.2092 5.2609 5.2609 5.6975 5.6975 5.7820 5.7820 6.2237 6.2237 6.4514 6.4514 6.5991 6.5991 6.6455 6.6455 6.8050 6.8050 6.8851 6.8851 7.0142 7.0142 7.1175 7.1175 7.1982 7.1982 7.5745 7.5745 7.9945 7.9945 10.6124 10.6124 10.7149 10.7149 11.6965 11.6965 13.4286 13.4286 13.7891 13.7891 14.0092 14.0092 k =-0.4938 0.3164-0.0000 ( 3846 PWs) bands (ev): -4.7442 -4.7442 -4.5232 -4.5232 2.0186 2.0188 2.6262 2.6276 3.1178 3.1242 3.3857 3.3909 4.1028 4.1037 4.3483 4.3512 4.3758 4.3778 4.4081 4.4173 4.4696 4.4767 4.7984 4.7987 5.0732 5.0738 5.2086 5.2101 5.2602 5.2631 5.6961 5.6990 5.7813 5.7827 6.2222 6.2237 6.4500 6.4525 6.5973 6.5996 6.6440 6.6468 6.8041 6.8057 6.8787 6.8897 7.0080 7.0148 7.1074 7.1296 7.1912 7.2065 7.5756 7.5766 7.9898 7.9901 10.6196 10.6203 10.7139 10.7143 11.7028 11.7035 13.4297 13.4310 13.7880 13.7887 14.0109 14.0119 k =-0.4875 0.3266-0.0000 ( 3852 PWs) bands (ev): -4.7437 -4.7436 -4.5224 -4.5224 2.0208 2.0212 2.6253 2.6281 3.1081 3.1204 3.3888 3.3987 4.1001 4.1019 4.3363 4.3437 4.3694 4.3717 4.4152 4.4285 4.4712 4.4848 4.7983 4.7989 5.0731 5.0742 5.2082 5.2112 5.2609 5.2665 5.6948 5.7005 5.7807 5.7834 6.2192 6.2222 6.4481 6.4531 6.5943 6.5987 6.6423 6.6478 6.8028 6.8060 6.8704 6.8923 6.9962 7.0111 7.0995 7.1395 7.1883 7.2159 7.5799 7.5820 7.9761 7.9766 10.6406 10.6425 10.7119 10.7130 11.7221 11.7235 13.4344 13.4370 13.7852 13.7867 14.0167 14.0189 k =-0.4813 0.3368-0.0000 ( 3844 PWs) bands (ev): -4.7427 -4.7427 -4.5211 -4.5210 2.0245 2.0252 2.6242 2.6284 3.0949 3.1123 3.3956 3.4093 4.0956 4.0985 4.3197 4.3318 4.3600 4.3675 4.4246 4.4401 4.4758 4.4950 4.7984 4.7992 5.0733 5.0749 5.2081 5.2123 5.2632 5.2714 5.6936 5.7022 5.7801 5.7842 6.2149 6.2194 6.4458 6.4532 6.5903 6.5965 6.6407 6.6483 6.8014 6.8061 6.8603 6.8925 6.9807 7.0050 7.0923 7.1400 7.1949 7.2266 7.5875 7.5906 7.9542 7.9549 10.6687 10.6727 10.7144 10.7172 11.7542 11.7562 13.4426 13.4465 13.7809 13.7832 14.0265 14.0302 k =-0.4750 0.3470-0.0000 ( 3848 PWs) bands (ev): -4.7413 -4.7413 -4.5193 -4.5192 2.0298 2.0307 2.6229 2.6286 3.0786 3.1002 3.4054 3.4221 4.0889 4.0930 4.3007 4.3167 4.3515 4.3627 4.4344 4.4517 4.4825 4.5066 4.7984 4.7994 5.0735 5.0755 5.2081 5.2134 5.2672 5.2775 5.6925 5.7039 5.7796 5.7851 6.2092 6.2152 6.4430 6.4527 6.5852 6.5930 6.6388 6.6483 6.7994 6.8058 6.8483 6.8892 6.9645 6.9978 7.0841 7.1308 7.2103 7.2390 7.5983 7.6022 7.9252 7.9259 10.6795 10.6831 10.7480 10.7502 11.7987 11.8013 13.4542 13.4595 13.7751 13.7781 14.0396 14.0457 k =-0.4688 0.3573-0.0000 ( 3852 PWs) bands (ev): -4.7396 -4.7396 -4.5170 -4.5169 2.0365 2.0377 2.6215 2.6287 3.0599 3.0848 3.4179 3.4365 4.0796 4.0851 4.2805 4.2996 4.3439 4.3575 4.4443 4.4633 4.4908 4.5190 4.7986 4.7998 5.0739 5.0764 5.2083 5.2143 5.2730 5.2850 5.6915 5.7057 5.7791 5.7860 6.2023 6.2098 6.4396 6.4515 6.5794 6.5885 6.6368 6.6477 6.7968 6.8052 6.8347 6.8810 6.9504 6.9904 7.0737 7.1164 7.2295 7.2528 7.6121 7.6166 7.8904 7.8908 10.6726 10.6752 10.8099 10.8108 11.8550 11.8580 13.4690 13.4758 13.7678 13.7715 14.0538 14.0648 k =-0.4625 0.3675-0.0000 ( 3852 PWs) bands (ev): -4.7376 -4.7375 -4.5142 -4.5141 2.0448 2.0462 2.6198 2.6286 3.0391 3.0667 3.4323 3.4521 4.0672 4.0741 4.2601 4.2816 4.3372 4.3521 4.4544 4.4748 4.5002 4.5319 4.7987 4.8001 5.0743 5.0772 5.2086 5.2150 5.2805 5.2938 5.6906 5.7075 5.7787 5.7871 6.1943 6.2032 6.4355 6.4494 6.5729 6.5832 6.6344 6.6464 6.7930 6.8041 6.8203 6.8670 6.9406 6.9834 7.0611 7.0990 7.2499 7.2679 7.6290 7.6336 7.8512 7.8515 10.6596 10.6619 10.8858 10.8861 11.9223 11.9257 13.4869 13.4953 13.7589 13.7635 14.0588 14.0830 k =-0.4563 0.3777-0.0000 ( 3844 PWs) bands (ev): -4.7352 -4.7352 -4.5110 -4.5109 2.0545 2.0562 2.6180 2.6284 3.0166 3.0464 3.4483 3.4688 4.0511 4.0593 4.2403 4.2635 4.3314 4.3467 4.4648 4.4864 4.5104 4.5450 4.7990 4.8005 5.0749 5.0782 5.2091 5.2156 5.2897 5.3037 5.6897 5.7092 5.7783 5.7884 6.1854 6.1958 6.4307 6.4462 6.5659 6.5772 6.6315 6.6445 6.7865 6.8027 6.8069 6.8478 6.9348 6.9769 7.0464 7.0796 7.2707 7.2840 7.6488 7.6523 7.8083 7.8104 10.6428 10.6449 10.9723 10.9724 11.9997 12.0033 13.5076 13.5176 13.7487 13.7541 14.0152 14.0356 k =-0.4500 0.3879-0.0000 ( 3844 PWs) bands (ev): -4.7326 -4.7325 -4.5073 -4.5072 2.0657 2.0676 2.6159 2.6279 2.9926 3.0243 3.4655 3.4862 4.0310 4.0399 4.2220 4.2460 4.3265 4.3416 4.4755 4.4982 4.5212 4.5582 4.7992 4.8009 5.0755 5.0792 5.2097 5.2160 5.3004 5.3148 5.6888 5.7108 5.7781 5.7899 6.1755 6.1873 6.4251 6.4419 6.5585 6.5707 6.6282 6.6418 6.7740 6.7975 6.8006 6.8253 6.9315 6.9709 7.0301 7.0590 7.2912 7.3006 7.6704 7.6714 7.7635 7.7707 10.6226 10.6246 11.0674 11.0677 12.0862 12.0899 13.5308 13.5426 13.7371 13.7434 13.9276 13.9370 k =-0.4438 0.3981-0.0000 ( 3844 PWs) bands (ev): -4.7297 -4.7296 -4.5033 -4.5031 2.0782 2.0804 2.6135 2.6274 2.9673 3.0007 3.4836 3.5042 4.0065 4.0157 4.2057 4.2296 4.3227 4.3369 4.4866 4.5101 4.5324 4.5714 4.7994 4.8013 5.0761 5.0803 5.2106 5.2163 5.3124 5.3268 5.6879 5.7123 5.7780 5.7915 6.1649 6.1782 6.4187 6.4362 6.5507 6.5637 6.6242 6.6384 6.7565 6.7917 6.7977 6.8016 6.9295 6.9654 7.0124 7.0375 7.3115 7.3175 7.6768 7.6957 7.7190 7.7447 10.5990 10.6010 11.1699 11.1703 12.1807 12.1843 13.5558 13.5694 13.7239 13.7315 13.8301 13.8346 k =-0.4375 0.4083-0.0000 ( 3840 PWs) bands (ev): -4.7266 -4.7265 -4.4988 -4.4987 2.0921 2.0945 2.6109 2.6267 2.9408 2.9759 3.5025 3.5226 3.9777 3.9866 4.1915 4.2145 4.3198 4.3327 4.4980 4.5222 4.5440 4.5847 4.7996 4.8019 5.0767 5.0814 5.2118 5.2167 5.3255 5.3396 5.6869 5.7135 5.7781 5.7935 6.1537 6.1683 6.4115 6.4291 6.5427 6.5563 6.6197 6.6344 6.7366 6.7760 6.7869 6.7953 6.9283 6.9604 6.9940 7.0157 7.3311 7.3344 7.6526 7.6721 7.7255 7.7522 10.5720 10.5741 11.2785 11.2790 12.2818 12.2852 13.5815 13.5958 13.7065 13.7168 13.7352 13.7362 k =-0.4313 0.4185-0.0000 ( 3844 PWs) bands (ev): -4.7233 -4.7232 -4.4941 -4.4940 2.1073 2.1100 2.6079 2.6259 2.9134 2.9501 3.5220 3.5414 3.9447 3.9530 4.1793 4.2006 4.3180 4.3292 4.5098 4.5345 4.5559 4.5980 4.7998 4.8025 5.0772 5.0826 5.2133 5.2172 5.3394 5.3530 5.6856 5.7144 5.7784 5.7957 6.1421 6.1579 6.4036 6.4205 6.5344 6.5484 6.6145 6.6298 6.7156 6.7508 6.7822 6.7917 6.9271 6.9553 6.9754 6.9944 7.3501 7.3511 7.6144 7.6287 7.7554 7.7772 10.5416 10.5437 11.3920 11.3926 12.3880 12.3910 13.5965 13.5983 13.6440 13.6585 13.6985 13.7068 k =-0.4250 0.4287-0.0000 ( 3844 PWs) bands (ev): -4.7199 -4.7198 -4.4891 -4.4890 2.1238 2.1267 2.6046 2.6249 2.8851 2.9235 3.5420 3.5606 3.9081 3.9155 4.1686 4.1879 4.3171 4.3264 4.5220 4.5468 4.5683 4.6112 4.8001 4.8034 5.0775 5.0837 5.2153 5.2178 5.3540 5.3669 5.6842 5.7147 5.7789 5.7982 6.1301 6.1470 6.3950 6.4106 6.5260 6.5399 6.6087 6.6246 6.6940 6.7257 6.7774 6.7876 6.9248 6.9485 6.9578 6.9754 7.3674 7.3682 7.5750 7.5874 7.7878 7.8080 10.5077 10.5098 11.5095 11.5101 12.4977 12.5001 13.5207 13.5255 13.6443 13.6725 13.6820 13.6944 k =-0.4188 0.4389-0.0000 ( 3840 PWs) bands (ev): -4.7164 -4.7163 -4.4839 -4.4837 2.1415 2.1447 2.6008 2.6237 2.8561 2.8965 3.5624 3.5800 3.8684 3.8749 4.1591 4.1764 4.3171 4.3242 4.5344 4.5593 4.5811 4.6245 4.8004 4.8045 5.0777 5.0849 5.2178 5.2188 5.3689 5.3811 5.6825 5.7145 5.7797 5.8012 6.1180 6.1357 6.3858 6.3993 6.5174 6.5309 6.6023 6.6189 6.6724 6.7012 6.7725 6.7832 6.9183 6.9359 6.9446 6.9630 7.3830 7.3853 7.5377 7.5493 7.8223 7.8417 10.4704 10.4725 11.6298 11.6305 12.6090 12.6106 13.4310 13.4343 13.6582 13.6647 13.6922 13.7027 k =-0.4125 0.4491-0.0000 ( 3848 PWs) bands (ev): -4.7129 -4.7128 -4.4785 -4.4783 2.1603 2.1638 2.5965 2.6224 2.8264 2.8690 3.5831 3.5996 3.8261 3.8318 4.1504 4.1657 4.3177 4.3228 4.5470 4.5715 4.5944 4.6378 4.8009 4.8060 5.0776 5.0860 5.2202 5.2208 5.3841 5.3952 5.6804 5.7135 5.7809 5.8045 6.1056 6.1241 6.3761 6.3868 6.5085 6.5211 6.5952 6.6127 6.6510 6.6774 6.7673 6.7784 6.9041 6.9172 6.9393 6.9575 7.3975 7.4007 7.5040 7.5149 7.8585 7.8776 10.4297 10.4319 11.7522 11.7529 12.7195 12.7200 13.3445 13.3467 13.6475 13.6510 13.7110 13.7331 k =-0.4063 0.4593-0.0000 ( 3848 PWs) bands (ev): -4.7094 -4.7093 -4.4730 -4.4727 2.1802 2.1839 2.5915 2.6210 2.7963 2.8416 3.6040 3.6193 3.7818 3.7867 4.1424 4.1559 4.3191 4.3221 4.5596 4.5835 4.6082 4.6512 4.8016 4.8079 5.0773 5.0870 5.2221 5.2246 5.3992 5.4092 5.6779 5.7117 5.7826 5.8084 6.0932 6.1121 6.3659 6.3733 6.4993 6.5107 6.5873 6.6061 6.6307 6.6548 6.7623 6.7736 6.8857 6.8964 6.9386 6.9551 7.4096 7.4127 7.4762 7.4858 7.8962 7.9151 10.3859 10.3880 11.8759 11.8767 12.8257 12.8264 13.2632 13.2646 13.6299 13.6366 13.7348 13.7619 k =-0.4000 0.4695-0.0000 ( 3844 PWs) bands (ev): -4.7059 -4.7058 -4.4674 -4.4671 2.2011 2.2051 2.5859 2.6193 2.7659 2.8145 3.6252 3.6391 3.7360 3.7403 4.1350 4.1468 4.3210 4.3219 4.5722 4.5951 4.6226 4.6646 4.8026 4.8103 5.0766 5.0879 5.2246 5.2291 5.4139 5.4228 5.6749 5.7088 5.7847 5.8128 6.0810 6.1000 6.3552 6.3589 6.4898 6.4998 6.5781 6.5988 6.6124 6.6340 6.7575 6.7687 6.8661 6.8751 6.9397 6.9542 7.4148 7.4159 7.4612 7.4658 7.9350 7.9538 10.3393 10.3413 12.0001 12.0010 12.9247 12.9266 13.1880 13.1885 13.6121 13.6207 13.7568 13.7873 k =-0.3938 0.4797-0.0000 ( 3840 PWs) bands (ev): -4.7026 -4.7025 -4.4617 -4.4615 2.2229 2.2271 2.5793 2.6175 2.7352 2.7879 3.6463 3.6582 3.6899 3.6930 4.1280 4.1384 4.3223 4.3233 4.5846 4.6061 4.6375 4.6782 4.8039 4.8133 5.0758 5.0887 5.2278 5.2344 5.4280 5.4358 5.6714 5.7048 5.7874 5.8178 6.0688 6.0875 6.3438 6.3438 6.4797 6.4885 6.5670 6.5904 6.5968 6.6158 6.7530 6.7640 6.8461 6.8539 6.9417 6.9544 7.4020 7.4094 7.4617 7.4641 7.9746 7.9932 10.2902 10.2922 12.1240 12.1251 13.0133 13.0164 13.1191 13.1194 13.5943 13.6044 13.7747 13.8076 k =-0.3875 0.4899-0.0000 ( 3846 PWs) bands (ev): -4.6996 -4.6994 -4.4562 -4.4559 2.2454 2.2499 2.5715 2.6156 2.7046 2.7623 3.6403 3.6448 3.6680 3.6802 4.1216 4.1308 4.3233 4.3260 4.5965 4.6165 4.6527 4.6917 4.8057 4.8169 5.0745 5.0893 5.2318 5.2404 5.4414 5.4479 5.6672 5.6995 5.7907 5.8233 6.0569 6.0749 6.3282 6.3316 6.4691 6.4771 6.5539 6.5803 6.5845 6.6011 6.7489 6.7595 6.8262 6.8330 6.9443 6.9553 7.3844 7.3945 7.4688 7.4745 8.0144 8.0330 10.2393 10.2411 12.2470 12.2484 13.0564 13.0575 13.0882 13.0921 13.5763 13.5879 13.7870 13.8216 k =-0.3813 0.5001-0.0000 ( 3846 PWs) bands (ev): -4.6968 -4.6966 -4.4507 -4.4504 2.2686 2.2733 2.5623 2.6135 2.6740 2.7381 3.5933 3.5972 3.6890 3.6994 4.1156 4.1239 4.3247 4.3290 4.6078 4.6262 4.6682 4.7053 4.8080 4.8213 5.0730 5.0898 5.2367 5.2472 5.4536 5.4591 5.6625 5.6928 5.7946 5.8294 6.0454 6.0621 6.3124 6.3187 6.4581 6.4660 6.5400 6.5688 6.5745 6.5900 6.7451 6.7550 6.8069 6.8128 6.9477 6.9571 7.3680 7.3792 7.4791 7.4863 8.0540 8.0725 10.1874 10.1889 12.3683 12.3703 13.0010 13.0032 13.1456 13.1499 13.5582 13.5711 13.7929 13.8280 k =-0.3750 0.5103-0.0000 ( 3854 PWs) bands (ev): -4.6943 -4.6941 -4.4454 -4.4451 2.2924 2.2972 2.5516 2.6111 2.6439 2.7157 3.5461 3.5498 3.7100 3.7188 4.1102 4.1177 4.3265 4.3323 4.6183 4.6350 4.6838 4.7189 4.8110 4.8264 5.0712 5.0901 5.2425 5.2547 5.4647 5.4692 5.6571 5.6847 5.7991 5.8362 6.0343 6.0492 6.2964 6.3049 6.4466 6.4554 6.5266 6.5574 6.5659 6.5810 6.7413 6.7499 6.7893 6.7938 6.9517 6.9598 7.3539 7.3657 7.4900 7.4982 8.0928 8.1110 10.1352 10.1365 12.4867 12.4898 12.9529 12.9567 13.1836 13.1877 13.5395 13.5533 13.7919 13.8263 k =-0.3688 0.5205-0.0000 ( 3850 PWs) bands (ev): -4.6922 -4.6920 -4.4404 -4.4401 2.3165 2.3215 2.5391 2.6078 2.6150 2.6955 3.4997 3.5032 3.7309 3.7382 4.1053 4.1122 4.3288 4.3358 4.6279 4.6429 4.6995 4.7326 4.8147 4.8324 5.0693 5.0902 5.2492 5.2630 5.4744 5.4781 5.6510 5.6752 5.8043 5.8435 6.0238 6.0362 6.2805 6.2903 6.4350 6.4458 6.5146 6.5476 6.5578 6.5728 6.7363 6.7424 6.7756 6.7776 6.9566 6.9633 7.3424 7.3546 7.5007 7.5096 8.1298 8.1480 10.0840 10.0849 12.6002 12.6054 12.9132 12.9196 13.2013 13.2047 13.5194 13.5337 13.7837 13.8166 k =-0.3625 0.5307-0.0000 ( 3844 PWs) bands (ev): -4.6905 -4.6904 -4.4356 -4.4353 2.3409 2.3458 2.5248 2.5843 2.6070 2.6777 3.4543 3.4579 3.7515 3.7573 4.1010 4.1075 4.3313 4.3395 4.6366 4.6497 4.7150 4.7461 4.8192 4.8391 5.0671 5.0903 5.2570 5.2719 5.4825 5.4857 5.6444 5.6644 5.8102 5.8512 6.0138 6.0232 6.2649 6.2750 6.4237 6.4371 6.5043 6.5397 6.5501 6.5646 6.7277 6.7302 6.7668 6.7682 6.9623 6.9679 7.3333 7.3457 7.5110 7.5206 8.1643 8.1823 10.0350 10.0355 12.7022 12.7126 12.8856 12.8978 13.1995 13.2018 13.4973 13.5116 13.7688 13.7996 k =-0.3563 0.5409-0.0000 ( 3832 PWs) bands (ev): -4.6894 -4.6893 -4.4313 -4.4309 2.3653 2.3699 2.5091 2.5561 2.6043 2.6623 3.4105 3.4142 3.7718 3.7761 4.0973 4.1035 4.3342 4.3433 4.6441 4.6553 4.7304 4.7594 4.8246 4.8467 5.0648 5.0902 5.2656 5.2814 5.4890 5.4919 5.6372 5.6522 5.8165 5.8593 6.0045 6.0105 6.2497 6.2594 6.4129 6.4292 6.4961 6.5339 6.5426 6.5562 6.7143 6.7146 6.7628 6.7665 6.9688 6.9734 7.3264 7.3390 7.5208 7.5309 8.1952 8.2131 9.9896 9.9897 12.7687 12.7860 12.8945 12.9141 13.1799 13.1810 13.4735 13.4874 13.7480 13.7764 k =-0.3500 0.5511-0.0000 ( 3838 PWs) bands (ev): -4.6889 -4.6888 -4.4273 -4.4270 2.3895 2.3932 2.4928 2.5288 2.6017 2.6493 3.3687 3.3725 3.7916 3.7945 4.0943 4.1003 4.3373 4.3472 4.6505 4.6598 4.7453 4.7723 4.8306 4.8549 5.0625 5.0901 5.2750 5.2912 5.4936 5.4968 5.6295 5.6389 5.8232 5.8671 5.9961 5.9983 6.2350 6.2434 6.4027 6.4219 6.4898 6.5297 6.5351 6.5471 6.6981 6.6983 6.7637 6.7682 6.9764 6.9800 7.3214 7.3340 7.5299 7.5405 8.2212 8.2391 9.9490 9.9495 12.7809 12.7931 12.9695 12.9849 13.1460 13.1463 13.4488 13.4621 13.7225 13.7484 k =-0.3438 0.5613-0.0000 ( 3836 PWs) bands (ev): -4.6890 -4.6889 -4.4239 -4.4235 2.4132 2.4141 2.4776 2.5026 2.5992 2.6382 3.3291 3.3332 3.8110 3.8124 4.0919 4.0979 4.3406 4.3513 4.6558 4.6630 4.7600 4.7846 4.8372 4.8638 5.0601 5.0901 5.2853 5.3013 5.4966 5.5005 5.6217 5.6247 5.8299 5.8741 5.9876 5.9889 6.2208 6.2275 6.3936 6.4151 6.4851 6.5266 6.5283 6.5379 6.6817 6.6821 6.7679 6.7725 6.9850 6.9877 7.3180 7.3307 7.5384 7.5494 8.2412 8.2590 9.9152 9.9162 12.7735 12.7817 13.0385 13.0489 13.1231 13.1255 13.4244 13.4370 13.6934 13.7169 k =-0.3438 0.5613-0.0000 ( 3836 PWs) bands (ev): -4.6890 -4.6889 -4.4239 -4.4235 2.4132 2.4141 2.4776 2.5026 2.5992 2.6382 3.3291 3.3332 3.8110 3.8124 4.0919 4.0979 4.3406 4.3513 4.6558 4.6630 4.7600 4.7846 4.8372 4.8638 5.0601 5.0901 5.2853 5.3013 5.4966 5.5005 5.6217 5.6247 5.8299 5.8741 5.9876 5.9889 6.2208 6.2275 6.3936 6.4151 6.4851 6.5266 6.5283 6.5379 6.6817 6.6821 6.7679 6.7725 6.9850 6.9877 7.3180 7.3307 7.5384 7.5494 8.2412 8.2590 9.9152 9.9162 12.7735 12.7817 13.0385 13.0489 13.1231 13.1255 13.4244 13.4370 13.6934 13.7169 k =-0.3438 0.5613 0.0122 ( 3842 PWs) bands (ev): -4.6886 -4.6885 -4.4244 -4.4240 2.4136 2.4145 2.4778 2.5025 2.6007 2.6393 3.3281 3.3321 3.8093 3.8108 4.0888 4.0950 4.3418 4.3521 4.6552 4.6619 4.7596 4.7838 4.8405 4.8670 5.0612 5.0911 5.2862 5.3021 5.4965 5.5004 5.6192 5.6219 5.8315 5.8754 5.9883 5.9897 6.2211 6.2277 6.3936 6.4153 6.4849 6.5258 6.5283 6.5386 6.6818 6.6822 6.7683 6.7729 6.9849 6.9877 7.3168 7.3294 7.5394 7.5504 8.2405 8.2582 9.9197 9.9207 12.7427 12.7490 13.0455 13.0524 13.1342 13.1387 13.4123 13.4241 13.7076 13.7296 k =-0.3438 0.5613 0.0244 ( 3840 PWs) bands (ev): -4.6874 -4.6873 -4.4257 -4.4253 2.4149 2.4158 2.4782 2.5021 2.6052 2.6428 3.3249 3.3288 3.8042 3.8059 4.0795 4.0863 4.3456 4.3548 4.6538 4.6592 4.7588 4.7820 4.8498 4.8758 5.0645 5.0941 5.2890 5.3046 5.4962 5.5001 5.6121 5.6141 5.8363 5.8793 5.9905 5.9923 6.2221 6.2282 6.3937 6.4159 6.4845 6.5239 6.5285 6.5403 6.6820 6.6825 6.7697 6.7744 6.9847 6.9875 7.3132 7.3255 7.5422 7.5532 8.2383 8.2557 9.9331 9.9341 12.6724 12.6763 13.0218 13.0260 13.1897 13.1955 13.3790 13.3893 13.7436 13.7628 k =-0.3438 0.5613 0.0366 ( 3835 PWs) bands (ev): -4.6855 -4.6854 -4.4278 -4.4274 2.4169 2.4179 2.4791 2.5017 2.6124 2.6486 3.3196 3.3235 3.7960 3.7980 4.0644 4.0720 4.3520 4.3596 4.6519 4.6553 4.7581 4.7800 4.8635 4.8888 5.0698 5.0988 5.2935 5.3086 5.4957 5.4995 5.6012 5.6020 5.8437 5.8855 5.9939 5.9964 6.2237 6.2293 6.3939 6.4169 6.4839 6.5216 6.5287 6.5423 6.6826 6.6831 6.7719 6.7768 6.9845 6.9872 7.3073 7.3191 7.5471 7.5580 8.2345 8.2515 9.9553 9.9564 12.5878 12.5903 12.9659 12.9704 13.2676 13.2732 13.3314 13.3409 13.7907 13.8072 k =-0.3438 0.5613 0.0488 ( 3836 PWs) bands (ev): -4.6828 -4.6827 -4.4308 -4.4304 2.4197 2.4208 2.4802 2.5013 2.6221 2.6567 3.3124 3.3163 3.7849 3.7873 4.0440 4.0522 4.3610 4.3667 4.6500 4.6511 4.7578 4.7783 4.8804 4.9044 5.0765 5.1047 5.2996 5.3142 5.4943 5.4979 5.5872 5.5876 5.8530 5.8933 5.9982 6.0016 6.2260 6.2307 6.3943 6.4183 6.4831 6.5191 6.5289 6.5443 6.6835 6.6842 6.7748 6.7800 6.9841 6.9869 7.2990 7.3102 7.5539 7.5648 8.2292 8.2457 9.9860 9.9872 12.4995 12.5010 12.8939 12.8992 13.2574 13.2633 13.3669 13.3687 13.8411 13.8554 k =-0.3438 0.5613 0.0611 ( 3838 PWs) bands (ev): -4.6794 -4.6793 -4.4346 -4.4342 2.4232 2.4245 2.4816 2.5010 2.6343 2.6669 3.3034 3.3071 3.7714 3.7743 4.0188 4.0276 4.3725 4.3761 4.6470 4.6484 4.7582 4.7773 4.8991 4.9214 5.0842 5.1115 5.3070 5.3210 5.4911 5.4941 5.5714 5.5732 5.8637 5.9025 6.0033 6.0077 6.2289 6.2326 6.3948 6.4200 6.4822 6.5164 6.5291 6.5460 6.6850 6.6860 6.7784 6.7838 6.9836 6.9865 7.2886 7.2990 7.5628 7.5734 8.2224 8.2381 10.0252 10.0264 12.4115 12.4125 12.8129 12.8191 13.1798 13.1864 13.4526 13.4548 13.8905 13.9029 k =-0.3438 0.5613 0.0733 ( 3840 PWs) bands (ev): -4.6753 -4.6752 -4.4392 -4.4388 2.4273 2.4288 2.4833 2.5011 2.6487 2.6793 3.2926 3.2962 3.7559 3.7594 3.9898 3.9989 4.3862 4.3876 4.6433 4.6473 4.7594 4.7772 4.9187 4.9391 5.0923 5.1186 5.3151 5.3289 5.4844 5.4862 5.5575 5.5607 5.8754 5.9126 6.0088 6.0142 6.2325 6.2352 6.3956 6.4219 6.4814 6.5139 6.5292 6.5474 6.6874 6.6888 6.7826 6.7883 6.9830 6.9860 7.2762 7.2855 7.5736 7.5840 8.2139 8.2288 10.0723 10.0737 12.3260 12.3266 12.7271 12.7342 13.0896 13.0965 13.5374 13.5393 13.9363 13.9471 k =-0.3438 0.5613 0.0855 ( 3844 PWs) bands (ev): -4.6704 -4.6703 -4.4445 -4.4441 2.4320 2.4337 2.4852 2.5014 2.6651 2.6938 3.2803 3.2837 3.7388 3.7431 3.9579 3.9669 4.4011 4.4018 4.6400 4.6467 4.7616 4.7784 4.9385 4.9566 5.1004 5.1255 5.3235 5.3376 5.4722 5.4724 5.5480 5.5526 5.8877 5.9231 6.0144 6.0209 6.2366 6.2382 6.3967 6.4240 6.4807 6.5113 6.5291 6.5484 6.6908 6.6929 6.7872 6.7933 6.9824 6.9854 7.2618 7.2701 7.5865 7.5966 8.2037 8.2178 10.1271 10.1286 12.2444 12.2448 12.6391 12.6469 12.9896 12.9966 13.6179 13.6193 13.9772 13.9867 k =-0.3438 0.5613 0.0977 ( 3838 PWs) bands (ev): -4.6649 -4.6648 -4.4505 -4.4502 2.4373 2.4391 2.4874 2.5020 2.6835 2.7103 3.2667 3.2698 3.7208 3.7257 3.9239 3.9326 4.4160 4.4190 4.6371 4.6466 4.7650 4.7810 4.9580 4.9737 5.1081 5.1319 5.3310 5.3468 5.4522 5.4555 5.5439 5.5494 5.9004 5.9337 6.0201 6.0274 6.2414 6.2419 6.3981 6.4261 6.4802 6.5087 6.5289 6.5489 6.6956 6.6983 6.7923 6.7988 6.9818 6.9848 7.2458 7.2528 7.6014 7.6112 8.1918 8.2049 10.1892 10.1908 12.1677 12.1680 12.5508 12.5594 12.8815 12.8888 13.6927 13.6937 14.0127 14.0211 k =-0.3438 0.5613 0.1099 ( 3833 PWs) bands (ev): -4.6587 -4.6586 -4.4573 -4.4569 2.4429 2.4450 2.4897 2.5029 2.7037 2.7286 3.2517 3.2546 3.7022 3.7079 3.8888 3.8969 4.4319 4.4372 4.6346 4.6466 4.7699 4.7853 4.9768 4.9900 5.1150 5.1372 5.3360 5.3559 5.4281 5.4367 5.5438 5.5498 5.9129 5.9441 6.0257 6.0337 6.2462 6.2466 6.4000 6.4281 6.4801 6.5061 6.5285 6.5489 6.7017 6.7051 6.7980 6.8049 6.9811 6.9842 7.2282 7.2340 7.6183 7.6277 8.1781 8.1901 10.2583 10.2600 12.0967 12.0969 12.4635 12.4728 12.7669 12.7748 13.7611 13.7616 14.0429 14.0503 k =-0.3438 0.5613 0.1221 ( 3835 PWs) bands (ev): -4.6519 -4.6519 -4.4646 -4.4643 2.4487 2.4511 2.4920 2.5040 2.7255 2.7488 3.2355 3.2380 3.6835 3.6900 3.8534 3.8606 4.4483 4.4560 4.6321 4.6467 4.7765 4.7916 4.9948 5.0055 5.1207 5.1412 5.3349 5.3627 5.4036 5.4211 5.5460 5.5523 5.9250 5.9538 6.0311 6.0395 6.2509 6.2521 6.4022 6.4299 6.4802 6.5034 6.5279 6.5485 6.7092 6.7132 6.8041 6.8116 6.9804 6.9835 7.2092 7.2137 7.6372 7.6461 8.1625 8.1735 10.3338 10.3357 12.0319 12.0321 12.3783 12.3884 12.6475 12.6560 13.8225 13.8227 14.0681 14.0746 k =-0.3438 0.5613 0.1343 ( 3835 PWs) bands (ev): -4.6445 -4.6445 -4.4725 -4.4722 2.4548 2.4573 2.4944 2.5052 2.7489 2.7705 3.2183 3.2203 3.6654 3.6726 3.8184 3.8245 4.4648 4.4748 4.6298 4.6465 4.7849 4.8000 5.0116 5.0199 5.1251 5.1435 5.3241 5.3563 5.3906 5.4135 5.5497 5.5560 5.9364 5.9626 6.0365 6.0449 6.2560 6.2577 6.4048 6.4312 6.4808 6.5007 6.5272 6.5476 6.7179 6.7224 6.8109 6.8190 6.9797 6.9828 7.1891 7.1921 7.6579 7.6662 8.1451 8.1550 10.4155 10.4174 11.9740 11.9743 12.2959 12.3069 12.5244 12.5339 13.8768 13.8770 14.0887 14.0944 k =-0.3438 0.5613 0.1465 ( 3831 PWs) bands (ev): -4.6366 -4.6366 -4.4810 -4.4807 2.4608 2.4636 2.4967 2.5065 2.7738 2.7938 3.1999 3.2013 3.6481 3.6560 3.7845 3.7895 4.4809 4.4933 4.6275 4.6461 4.7955 4.8108 5.0271 5.0333 5.1282 5.1441 5.3042 5.3311 5.3953 5.4140 5.5540 5.5602 5.9468 5.9701 6.0417 6.0499 6.2613 6.2634 6.4076 6.4322 6.4816 6.4980 6.5265 6.5465 6.7278 6.7324 6.8187 6.8276 6.9790 6.9821 7.1678 7.1695 7.6805 7.6882 8.1258 8.1347 10.5029 10.5050 11.9233 11.9237 12.2166 12.2290 12.3991 12.4101 13.9243 13.9247 14.1051 14.1101 k =-0.3438 0.5613 0.1588 ( 3828 PWs) bands (ev): -4.6282 -4.6282 -4.4899 -4.4896 2.4668 2.4698 2.4988 2.5077 2.7998 2.8183 3.1805 3.1811 3.6322 3.6406 3.7525 3.7560 4.4963 4.5107 4.6251 4.6451 4.8082 4.8241 5.0414 5.0456 5.1297 5.1425 5.2796 5.3013 5.4040 5.4188 5.5586 5.5645 5.9559 5.9762 6.0467 6.0543 6.2667 6.2689 6.4107 6.4326 6.4827 6.4954 6.5259 6.5450 6.7382 6.7426 6.8279 6.8377 6.9783 6.9814 7.1457 7.1460 7.7047 7.7117 8.1048 8.1125 10.5957 10.5978 11.8802 11.8807 12.1401 12.1548 12.2732 12.2866 13.9653 13.9661 14.1178 14.1223 k =-0.3438 0.5613 0.1710 ( 3824 PWs) bands (ev): -4.6194 -4.6194 -4.4992 -4.4990 2.4725 2.4757 2.5007 2.5087 2.8270 2.8440 3.1597 3.1600 3.6181 3.6269 3.7228 3.7249 4.5106 4.5268 4.6227 4.6435 4.8233 4.8396 5.0540 5.0569 5.1298 5.1385 5.2537 5.2709 5.4131 5.4253 5.5632 5.5687 5.9638 5.9810 6.0516 6.0583 6.2720 6.2741 6.4139 6.4327 6.4839 6.4929 6.5254 6.5433 6.7485 6.7524 6.8390 6.8497 6.9776 6.9806 7.1218 7.1229 7.7304 7.7366 8.0822 8.0887 10.6935 10.6957 11.8447 11.8452 12.0635 12.0819 12.1507 12.1682 14.0005 14.0014 14.1271 14.1312 k =-0.3438 0.5613 0.1832 ( 3822 PWs) bands (ev): -4.6102 -4.6102 -4.5089 -4.5086 2.4779 2.4812 2.5023 2.5095 2.8550 2.8705 3.1370 3.1384 3.6062 3.6151 3.6961 3.6967 4.5237 4.5408 4.6205 4.6414 4.8404 4.8570 5.0647 5.0667 5.1287 5.1318 5.2290 5.2414 5.4218 5.4319 5.5675 5.5724 5.9703 5.9844 6.0561 6.0617 6.2769 6.2787 6.4169 6.4324 6.4848 6.4907 6.5252 6.5414 6.7580 6.7610 6.8524 6.8639 6.9768 6.9798 7.0973 7.0996 7.7574 7.7628 8.0580 8.0634 10.7958 10.7981 11.8160 11.8163 11.9778 11.9946 12.0499 12.0663 14.0303 14.0314 14.1335 14.1371 k =-0.3438 0.5613 0.1954 ( 3822 PWs) bands (ev): -4.6007 -4.6006 -4.5188 -4.5186 2.4828 2.4861 2.5036 2.5099 2.8836 2.8977 3.1132 3.1157 3.5968 3.6055 3.6721 3.6729 4.5354 4.5525 4.6187 4.6386 4.8591 4.8755 5.0726 5.0744 5.1230 5.1267 5.2074 5.2142 5.4296 5.4378 5.5713 5.5755 5.9756 5.9866 6.0600 6.0645 6.2813 6.2828 6.4198 6.4318 6.4855 6.4889 6.5254 6.5393 6.7659 6.7682 6.8684 6.8804 6.9758 6.9790 7.0727 7.0761 7.7853 7.7898 8.0326 8.0368 10.9025 10.9047 11.7878 11.7886 11.8796 11.8859 11.9845 11.9918 14.0552 14.0565 14.1372 14.1403 k =-0.3438 0.5613 0.2076 ( 3817 PWs) bands (ev): -4.5908 -4.5908 -4.5289 -4.5287 2.4871 2.4902 2.5046 2.5100 2.9125 2.9250 3.0884 3.0921 3.5903 3.5982 3.6518 3.6536 4.5456 4.5612 4.6177 4.6353 4.8787 4.8940 5.0761 5.0777 5.1149 5.1249 5.1901 5.1910 5.4363 5.4425 5.5745 5.5778 5.9798 5.9879 6.0634 6.0667 6.2850 6.2861 6.4223 6.4310 6.4860 6.4875 6.5262 6.5372 6.7721 6.7737 6.8868 6.8989 6.9743 6.9778 7.0488 7.0530 7.8138 7.8172 8.0064 8.0095 11.0130 11.0151 11.7198 11.7227 11.8174 11.8182 11.9338 11.9364 14.0755 14.0770 14.1384 14.1411 k =-0.3438 0.5613 0.2198 ( 3817 PWs) bands (ev): -4.5808 -4.5807 -4.5392 -4.5390 2.4906 2.4932 2.5054 2.5095 2.9411 2.9519 3.0629 3.0678 3.5866 3.5930 3.6364 3.6387 4.5542 4.5663 4.6181 4.6315 4.8975 4.9102 5.0735 5.0740 5.1130 5.1243 5.1737 5.1770 5.4416 5.4458 5.5771 5.5794 5.9830 5.9883 6.0660 6.0682 6.2878 6.2885 6.4245 6.4301 6.4861 6.4866 6.5273 6.5350 6.7764 6.7774 6.9070 6.9187 6.9713 6.9758 7.0270 7.0312 7.8417 7.8442 7.9804 7.9824 11.1269 11.1288 11.6071 11.6082 11.8056 11.8071 11.8925 11.8930 14.0916 14.0930 14.1375 14.1398 k =-0.3438 0.5613 0.2320 ( 3823 PWs) bands (ev): -4.5706 -4.5705 -4.5495 -4.5494 2.4932 2.4948 2.5063 2.5086 2.9682 2.9764 3.0387 3.0440 3.5857 3.5894 3.6271 3.6287 4.5610 4.5677 4.6201 4.6274 4.9132 4.9207 5.0664 5.0682 5.1164 5.1237 5.1640 5.1677 5.4453 5.4474 5.5789 5.5801 5.9854 5.9880 6.0678 6.0689 6.2895 6.2899 6.4262 6.4289 6.4861 6.4861 6.5288 6.5327 6.7790 6.7795 6.9275 6.9380 6.9648 6.9710 7.0110 7.0136 7.8666 7.8680 7.9571 7.9580 11.2436 11.2452 11.4869 11.4871 11.8099 11.8112 11.8602 11.8606 14.1029 14.1040 14.1356 14.1371 k =-0.3438 0.5613 0.2442 ( 3826 PWs) bands (ev): -4.5618 -4.5618 -4.5582 -4.5582 2.4947 2.4947 2.5075 2.5075 2.9868 2.9868 3.0275 3.0275 3.5869 3.5869 3.6246 3.6246 4.5657 4.5657 4.6235 4.6235 4.9219 4.9220 5.0641 5.0641 5.1210 5.1210 5.1626 5.1626 5.4472 5.4472 5.5799 5.5799 5.9870 5.9871 6.0687 6.0688 6.2902 6.2903 6.4277 6.4277 6.4860 6.4860 6.5306 6.5307 6.7800 6.7801 6.9448 6.9448 6.9614 6.9614 7.0058 7.0059 7.8792 7.8793 7.9457 7.9458 11.3496 11.3496 11.3802 11.3802 11.8173 11.8173 11.8445 11.8445 14.1078 14.1078 14.1349 14.1349 k =-0.3438 0.5613 0.2442 ( 3826 PWs) bands (ev): -4.5618 -4.5618 -4.5582 -4.5582 2.4947 2.4947 2.5075 2.5075 2.9868 2.9868 3.0275 3.0275 3.5869 3.5869 3.6246 3.6246 4.5657 4.5657 4.6235 4.6235 4.9219 4.9220 5.0641 5.0641 5.1210 5.1210 5.1626 5.1626 5.4472 5.4472 5.5799 5.5799 5.9870 5.9871 6.0687 6.0688 6.2902 6.2903 6.4277 6.4277 6.4860 6.4860 6.5306 6.5307 6.7800 6.7801 6.9448 6.9448 6.9614 6.9614 7.0058 7.0059 7.8792 7.8793 7.9457 7.9458 11.3496 11.3496 11.3802 11.3802 11.8173 11.8173 11.8445 11.8445 14.1078 14.1078 14.1349 14.1349 k =-0.3500 0.5511 0.2442 ( 3832 PWs) bands (ev): -4.5634 -4.5634 -4.5597 -4.5597 2.4920 2.4921 2.5042 2.5042 3.0058 3.0058 3.0495 3.0495 3.5715 3.5715 3.6132 3.6132 4.5600 4.5600 4.6171 4.6171 4.9283 4.9283 5.0656 5.0656 5.1189 5.1190 5.1662 5.1662 5.4448 5.4449 5.5795 5.5795 5.9977 5.9977 6.0820 6.0820 6.3002 6.3002 6.4317 6.4318 6.4824 6.4824 6.5304 6.5304 6.7802 6.7803 6.9519 6.9519 6.9680 6.9680 7.0132 7.0132 7.8569 7.8570 7.9268 7.9268 11.3763 11.3763 11.3899 11.3899 11.8307 11.8307 11.8763 11.8763 14.0023 14.0023 14.0292 14.0292 k =-0.3563 0.5409 0.2442 ( 3816 PWs) bands (ev): -4.5655 -4.5655 -4.5618 -4.5618 2.4884 2.4884 2.4999 2.4999 3.0264 3.0264 3.0732 3.0732 3.5570 3.5570 3.6028 3.6028 4.5536 4.5537 4.6098 4.6098 4.9352 4.9352 5.0670 5.0670 5.1173 5.1173 5.1707 5.1707 5.4420 5.4420 5.5786 5.5786 6.0089 6.0090 6.0954 6.0954 6.3101 6.3102 6.4345 6.4345 6.4809 6.4810 6.5309 6.5310 6.7821 6.7822 6.9524 6.9525 6.9810 6.9811 7.0253 7.0253 7.8331 7.8331 7.9061 7.9061 11.3820 11.3820 11.3852 11.3852 11.8687 11.8688 11.9299 11.9299 13.8880 13.8881 13.9149 13.9149 k =-0.3625 0.5307 0.2442 ( 3820 PWs) bands (ev): -4.5681 -4.5681 -4.5644 -4.5644 2.4837 2.4837 2.4944 2.4945 3.0483 3.0483 3.0984 3.0984 3.5436 3.5436 3.5936 3.5936 4.5467 4.5467 4.6015 4.6015 4.9425 4.9425 5.0682 5.0682 5.1160 5.1160 5.1759 5.1759 5.4387 5.4387 5.5772 5.5772 6.0206 6.0207 6.1085 6.1085 6.3195 6.3196 6.4352 6.4353 6.4821 6.4822 6.5323 6.5323 6.7854 6.7854 6.9504 6.9504 6.9975 6.9975 7.0406 7.0406 7.8077 7.8077 7.8836 7.8836 11.3648 11.3648 11.3751 11.3751 11.9283 11.9283 12.0003 12.0003 13.7668 13.7668 13.7940 13.7940 k =-0.3688 0.5205 0.2442 ( 3822 PWs) bands (ev): -4.5711 -4.5711 -4.5675 -4.5675 2.4782 2.4782 2.4881 2.4881 3.0710 3.0710 3.1245 3.1245 3.5313 3.5313 3.5856 3.5857 4.5391 4.5391 4.5923 4.5923 4.9504 4.9504 5.0695 5.0695 5.1151 5.1151 5.1815 5.1815 5.4353 5.4353 5.5754 5.5754 6.0327 6.0327 6.1212 6.1212 6.3283 6.3283 6.4342 6.4343 6.4860 6.4860 6.5347 6.5347 6.7900 6.7900 6.9478 6.9479 7.0163 7.0163 7.0586 7.0586 7.7810 7.7811 7.8597 7.8598 11.3394 11.3394 11.3545 11.3545 12.0033 12.0033 12.0823 12.0823 13.6406 13.6406 13.6683 13.6683 k =-0.3750 0.5103 0.2442 ( 3826 PWs) bands (ev): -4.5746 -4.5746 -4.5710 -4.5710 2.4718 2.4718 2.4810 2.4810 3.0941 3.0941 3.1511 3.1511 3.5205 3.5205 3.5791 3.5791 4.5311 4.5311 4.5824 4.5824 4.9589 4.9589 5.0711 5.0711 5.1147 5.1147 5.1874 5.1874 5.4317 5.4317 5.5732 5.5732 6.0451 6.0451 6.1335 6.1335 6.3361 6.3362 6.4322 6.4323 6.4918 6.4918 6.5381 6.5382 6.7957 6.7957 6.9454 6.9454 7.0370 7.0371 7.0788 7.0788 7.7533 7.7533 7.8346 7.8346 11.3098 11.3098 11.3274 11.3274 12.0881 12.0881 12.1718 12.1718 13.5115 13.5115 13.5399 13.5399 k =-0.3813 0.5001 0.2442 ( 3826 PWs) bands (ev): -4.5783 -4.5783 -4.5748 -4.5748 2.4648 2.4648 2.4733 2.4733 3.1171 3.1171 3.1777 3.1777 3.5113 3.5113 3.5741 3.5741 4.5227 4.5227 4.5717 4.5717 4.9679 4.9679 5.0729 5.0729 5.1148 5.1148 5.1934 5.1934 5.4282 5.4282 5.5707 5.5707 6.0578 6.0578 6.1451 6.1451 6.3430 6.3431 6.4300 6.4301 6.4988 6.4988 6.5426 6.5426 6.8023 6.8024 6.9432 6.9433 7.0598 7.0599 7.1013 7.1013 7.7247 7.7248 7.8084 7.8085 11.2782 11.2782 11.2967 11.2967 12.1782 12.1782 12.2651 12.2651 13.3821 13.3821 13.4112 13.4112 k =-0.3875 0.4899 0.2442 ( 3822 PWs) bands (ev): -4.5823 -4.5823 -4.5789 -4.5789 2.4573 2.4574 2.4651 2.4651 3.1396 3.1396 3.2036 3.2036 3.5039 3.5039 3.5707 3.5707 4.5139 4.5139 4.5606 4.5606 4.9774 4.9774 5.0751 5.0751 5.1154 5.1155 5.1994 5.1994 5.4249 5.4249 5.5678 5.5678 6.0706 6.0706 6.1561 6.1561 6.3490 6.3490 6.4283 6.4283 6.5064 6.5065 6.5480 6.5480 6.8097 6.8098 6.9414 6.9415 7.0845 7.0845 7.1260 7.1260 7.6955 7.6955 7.7816 7.7816 11.2458 11.2458 11.2643 11.2643 12.2695 12.2695 12.3583 12.3583 13.2562 13.2563 13.2855 13.2855 k =-0.3938 0.4797 0.2442 ( 3826 PWs) bands (ev): -4.5865 -4.5865 -4.5832 -4.5832 2.4495 2.4495 2.4565 2.4565 3.1612 3.1612 3.2283 3.2283 3.4988 3.4988 3.5690 3.5690 4.5049 4.5050 4.5490 4.5490 4.9873 4.9873 5.0775 5.0775 5.1165 5.1165 5.2051 5.2051 5.4218 5.4218 5.5647 5.5647 6.0834 6.0835 6.1662 6.1662 6.3540 6.3541 6.4273 6.4273 6.5141 6.5142 6.5541 6.5542 6.8177 6.8177 6.9399 6.9400 7.1110 7.1110 7.1527 7.1527 7.6658 7.6658 7.7542 7.7543 11.2133 11.2133 11.2314 11.2314 12.3563 12.3563 12.4450 12.4450 13.1403 13.1403 13.1684 13.1684 k =-0.4000 0.4695 0.2442 ( 3826 PWs) bands (ev): -4.5908 -4.5908 -4.5876 -4.5876 2.4413 2.4413 2.4477 2.4477 3.1815 3.1815 3.2509 3.2509 3.4964 3.4964 3.5691 3.5691 4.4958 4.4958 4.5371 4.5372 4.9978 4.9978 5.0803 5.0803 5.1180 5.1180 5.2105 5.2105 5.4191 5.4191 5.5613 5.5613 6.0963 6.0963 6.1754 6.1754 6.3584 6.3585 6.4275 6.4276 6.5216 6.5217 6.5609 6.5610 6.8259 6.8260 6.9387 6.9388 7.1391 7.1391 7.1815 7.1815 7.6359 7.6360 7.7267 7.7268 11.1812 11.1812 11.1985 11.1985 12.4289 12.4289 12.5116 12.5116 13.0476 13.0476 13.0700 13.0700 k =-0.4063 0.4593 0.2442 ( 3830 PWs) bands (ev): -4.5952 -4.5952 -4.5922 -4.5921 2.4330 2.4331 2.4388 2.4388 3.2002 3.2002 3.2707 3.2707 3.4970 3.4970 3.5711 3.5711 4.4865 4.4866 4.5251 4.5251 5.0086 5.0086 5.0834 5.0834 5.1198 5.1198 5.2155 5.2155 5.4170 5.4170 5.5576 5.5576 6.1091 6.1091 6.1838 6.1838 6.3624 6.3625 6.4291 6.4291 6.5286 6.5286 6.5681 6.5681 6.8344 6.8345 6.9377 6.9377 7.1685 7.1686 7.2122 7.2122 7.6060 7.6061 7.6994 7.6995 11.1498 11.1498 11.1661 11.1661 12.4688 12.4688 12.5330 12.5330 12.9991 12.9992 13.0136 13.0136 k =-0.4125 0.4491 0.2442 ( 3834 PWs) bands (ev): -4.5996 -4.5996 -4.5967 -4.5967 2.4248 2.4248 2.4299 2.4299 3.2170 3.2170 3.2872 3.2872 3.5010 3.5010 3.5748 3.5748 4.4773 4.4773 4.5130 4.5130 5.0198 5.0198 5.0867 5.0867 5.1219 5.1219 5.2199 5.2199 5.4155 5.4155 5.5537 5.5537 6.1217 6.1217 6.1911 6.1911 6.3663 6.3663 6.4321 6.4322 6.5348 6.5349 6.5754 6.5754 6.8429 6.8429 6.9368 6.9369 7.1989 7.1989 7.2445 7.2445 7.5765 7.5765 7.6728 7.6728 11.1193 11.1193 11.1345 11.1345 12.4555 12.4555 12.4918 12.4918 12.9993 12.9993 13.0333 13.0333 k =-0.4188 0.4389 0.2442 ( 3838 PWs) bands (ev): -4.6039 -4.6039 -4.6012 -4.6012 2.4166 2.4166 2.4212 2.4212 3.2319 3.2319 3.3000 3.3000 3.5085 3.5085 3.5801 3.5801 4.4683 4.4683 4.5011 4.5011 5.0312 5.0312 5.0903 5.0903 5.1243 5.1243 5.2237 5.2237 5.4146 5.4146 5.5495 5.5495 6.1339 6.1339 6.1975 6.1975 6.3703 6.3704 6.4367 6.4368 6.5402 6.5403 6.5826 6.5826 6.8513 6.8513 6.9361 6.9362 7.2294 7.2294 7.2779 7.2780 7.5476 7.5476 7.6474 7.6474 11.0899 11.0899 11.1038 11.1038 12.3924 12.3924 12.4075 12.4075 13.0500 13.0500 13.1052 13.1052 k =-0.4250 0.4287 0.2442 ( 3842 PWs) bands (ev): -4.6082 -4.6082 -4.6056 -4.6055 2.4086 2.4086 2.4127 2.4128 3.2448 3.2448 3.3091 3.3091 3.5190 3.5190 3.5867 3.5867 4.4595 4.4595 4.4894 4.4894 5.0427 5.0427 5.0940 5.0940 5.1268 5.1269 5.2266 5.2266 5.4146 5.4146 5.5450 5.5450 6.1456 6.1457 6.2029 6.2029 6.3748 6.3749 6.4429 6.4429 6.5448 6.5448 6.5895 6.5896 6.8594 6.8594 6.9355 6.9356 7.2592 7.2592 7.3119 7.3119 7.5201 7.5201 7.6241 7.6241 11.0615 11.0615 11.0742 11.0742 12.3019 12.3019 12.3057 12.3057 13.1323 13.1323 13.2005 13.2005 k =-0.4313 0.4185 0.2442 ( 3842 PWs) bands (ev): -4.6122 -4.6122 -4.6098 -4.6098 2.4009 2.4009 2.4046 2.4046 3.2558 3.2558 3.3151 3.3151 3.5320 3.5320 3.5944 3.5944 4.4510 4.4510 4.4781 4.4781 5.0544 5.0544 5.0979 5.0979 5.1295 5.1296 5.2287 5.2287 5.4154 5.4154 5.5403 5.5403 6.1567 6.1567 6.2073 6.2073 6.3801 6.3802 6.4506 6.4506 6.5483 6.5484 6.5960 6.5960 6.8672 6.8673 6.9350 6.9350 7.2869 7.2869 7.3449 7.3449 7.4952 7.4953 7.6039 7.6039 11.0343 11.0343 11.0457 11.0457 12.1981 12.1981 12.2026 12.2027 13.2300 13.2300 13.3057 13.3057 k =-0.4375 0.4083 0.2442 ( 3838 PWs) bands (ev): -4.6161 -4.6161 -4.6139 -4.6138 2.3936 2.3936 2.3969 2.3969 3.2651 3.2651 3.3185 3.3185 3.5465 3.5465 3.6029 3.6029 4.4429 4.4430 4.4673 4.4673 5.0659 5.0659 5.1018 5.1018 5.1324 5.1324 5.2298 5.2298 5.4172 5.4172 5.5353 5.5353 6.1669 6.1669 6.2108 6.2108 6.3864 6.3865 6.4596 6.4596 6.5510 6.5510 6.6017 6.6018 6.8747 6.8747 6.9345 6.9345 7.3108 7.3108 7.3734 7.3734 7.4763 7.4763 7.5885 7.5885 11.0082 11.0082 11.0183 11.0184 12.0933 12.0933 12.1011 12.1012 13.3345 13.3345 13.4149 13.4149 k =-0.4438 0.3981 0.2442 ( 3838 PWs) bands (ev): -4.6197 -4.6197 -4.6177 -4.6177 2.3868 2.3868 2.3897 2.3897 3.2729 3.2729 3.3201 3.3201 3.5617 3.5617 3.6116 3.6116 4.4354 4.4354 4.4570 4.4570 5.0771 5.0771 5.1058 5.1058 5.1353 5.1353 5.2298 5.2298 5.4198 5.4198 5.5300 5.5300 6.1761 6.1761 6.2135 6.2135 6.3938 6.3938 6.4696 6.4696 6.5528 6.5529 6.6066 6.6067 6.8817 6.8818 6.9339 6.9340 7.3287 7.3287 7.3882 7.3882 7.4723 7.4723 7.5795 7.5795 10.9834 10.9834 10.9923 10.9923 11.9933 11.9933 12.0031 12.0031 13.4415 13.4415 13.5244 13.5244 k =-0.4500 0.3879 0.2442 ( 3838 PWs) bands (ev): -4.6231 -4.6230 -4.6212 -4.6212 2.3805 2.3805 2.3830 2.3830 3.2793 3.2793 3.3204 3.3204 3.5769 3.5769 3.6203 3.6203 4.4285 4.4285 4.4474 4.4475 5.0878 5.0878 5.1098 5.1098 5.1384 5.1384 5.2287 5.2287 5.4233 5.4233 5.5244 5.5244 6.1842 6.1843 6.2155 6.2155 6.4023 6.4024 6.4802 6.4802 6.5540 6.5540 6.6106 6.6106 6.8883 6.8884 6.9334 6.9335 7.3389 7.3389 7.3827 7.3827 7.4893 7.4893 7.5783 7.5783 10.9598 10.9598 10.9675 10.9675 11.9005 11.9005 11.9110 11.9111 13.5481 13.5481 13.6320 13.6320 k =-0.4563 0.3777 0.2442 ( 3842 PWs) bands (ev): -4.6261 -4.6261 -4.6244 -4.6244 2.3748 2.3748 2.3769 2.3770 3.2847 3.2847 3.3198 3.3198 3.5915 3.5915 3.6285 3.6286 4.4223 4.4223 4.4386 4.4386 5.0977 5.0977 5.1137 5.1137 5.1418 5.1418 5.2266 5.2266 5.4276 5.4276 5.5186 5.5186 6.1912 6.1912 6.2168 6.2168 6.4119 6.4120 6.4907 6.4907 6.5548 6.5548 6.6134 6.6135 6.8944 6.8944 6.9328 6.9329 7.3412 7.3413 7.3673 7.3673 7.5167 7.5167 7.5846 7.5847 10.9376 10.9376 10.9442 10.9442 11.8162 11.8162 11.8269 11.8269 13.6523 13.6523 13.7355 13.7355 k =-0.4625 0.3675 0.2442 ( 3854 PWs) bands (ev): -4.6287 -4.6287 -4.6273 -4.6273 2.3698 2.3698 2.3716 2.3716 3.2892 3.2892 3.3185 3.3185 3.6051 3.6051 3.6361 3.6361 4.4168 4.4168 4.4306 4.4306 5.1063 5.1063 5.1176 5.1176 5.1457 5.1457 5.2235 5.2235 5.4326 5.4327 5.5125 5.5125 6.1971 6.1971 6.2176 6.2176 6.4225 6.4225 6.5002 6.5002 6.5559 6.5559 6.6151 6.6151 6.8998 6.8999 6.9320 6.9320 7.3373 7.3373 7.3501 7.3502 7.5460 7.5460 7.5966 7.5967 10.9170 10.9170 10.9225 10.9225 11.7417 11.7418 11.7519 11.7520 13.7522 13.7522 13.8327 13.8327 k =-0.4688 0.3573 0.2442 ( 3860 PWs) bands (ev): -4.6310 -4.6310 -4.6298 -4.6298 2.3654 2.3654 2.3669 2.3669 3.2931 3.2931 3.3169 3.3170 3.6173 3.6173 3.6425 3.6425 4.4122 4.4122 4.4235 4.4236 5.1132 5.1132 5.1212 5.1213 5.1506 5.1507 5.2194 5.2194 5.4383 5.4383 5.5061 5.5061 6.2020 6.2020 6.2180 6.2180 6.4337 6.4338 6.5071 6.5072 6.5583 6.5583 6.6154 6.6154 6.9049 6.9049 6.9311 6.9312 7.3294 7.3294 7.3341 7.3341 7.5738 7.5739 7.6114 7.6114 10.8983 10.8983 10.9029 10.9029 11.6780 11.6780 11.6872 11.6872 13.8456 13.8456 13.9210 13.9210 k =-0.4750 0.3470 0.2442 ( 3852 PWs) bands (ev): -4.6329 -4.6329 -4.6319 -4.6319 2.3619 2.3619 2.3631 2.3631 3.2964 3.2964 3.3151 3.3152 3.6279 3.6279 3.6478 3.6478 4.4085 4.4085 4.4175 4.4175 5.1183 5.1184 5.1245 5.1245 5.1568 5.1568 5.2145 5.2145 5.4444 5.4445 5.4996 5.4996 6.2059 6.2060 6.2181 6.2181 6.4455 6.4455 6.5104 6.5104 6.5631 6.5632 6.6143 6.6144 6.9095 6.9095 6.9301 6.9301 7.3196 7.3196 7.3207 7.3207 7.5988 7.5989 7.6263 7.6263 10.8820 10.8820 10.8856 10.8856 11.6255 11.6255 11.6334 11.6334 13.9304 13.9304 13.9975 13.9975 k =-0.4813 0.3368 0.2442 ( 3848 PWs) bands (ev): -4.6344 -4.6343 -4.6336 -4.6336 2.3591 2.3591 2.3600 2.3600 3.2994 3.2994 3.3132 3.3132 3.6369 3.6369 3.6515 3.6515 4.4058 4.4058 4.4125 4.4125 5.1221 5.1221 5.1269 5.1269 5.1640 5.1640 5.2088 5.2088 5.4510 5.4510 5.4929 5.4929 6.2091 6.2092 6.2178 6.2179 6.4573 6.4573 6.5095 6.5095 6.5702 6.5703 6.6118 6.6118 6.9136 6.9136 6.9288 6.9289 7.3090 7.3090 7.3112 7.3113 7.6199 7.6199 7.6391 7.6392 10.8686 10.8686 10.8713 10.8713 11.5848 11.5848 11.5910 11.5910 14.0038 14.0038 14.0592 14.0592 k =-0.4875 0.3266 0.2442 ( 3844 PWs) bands (ev): -4.6354 -4.6354 -4.6349 -4.6349 2.3572 2.3572 2.3577 2.3577 3.3020 3.3021 3.3111 3.3111 3.6440 3.6440 3.6536 3.6536 4.4042 4.4042 4.4086 4.4086 5.1248 5.1248 5.1282 5.1282 5.1718 5.1718 5.2023 5.2024 5.4578 5.4578 5.4860 5.4860 6.2117 6.2117 6.2173 6.2173 6.4688 6.4689 6.5052 6.5052 6.5787 6.5787 6.6077 6.6078 6.9172 6.9172 6.9273 6.9273 7.3012 7.3013 7.3036 7.3036 7.6362 7.6362 7.6485 7.6485 10.8586 10.8586 10.8604 10.8604 11.5560 11.5560 11.5602 11.5602 14.0629 14.0629 14.1028 14.1028 k =-0.4938 0.3164 0.2442 ( 3840 PWs) bands (ev): -4.6359 -4.6359 -4.6357 -4.6357 2.3560 2.3560 2.3563 2.3563 3.3045 3.3045 3.3090 3.3090 3.6492 3.6492 3.6540 3.6540 4.4036 4.4037 4.4058 4.4059 5.1268 5.1268 5.1286 5.1286 5.1798 5.1798 5.1953 5.1953 5.4648 5.4648 5.4790 5.4790 6.2137 6.2137 6.2164 6.2164 6.4798 6.4798 6.4984 6.4984 6.5873 6.5873 6.6022 6.6022 6.9203 6.9204 6.9253 6.9254 7.2969 7.2969 7.2983 7.2983 7.6474 7.6474 7.6534 7.6534 10.8526 10.8526 10.8535 10.8535 11.5391 11.5391 11.5413 11.5413 14.1046 14.1046 14.1256 14.1256 k =-0.5000 0.3062 0.2442 ( 3840 PWs) bands (ev): -4.6360 -4.6360 -4.6360 -4.6360 2.3557 2.3557 2.3558 2.3558 3.3068 3.3068 3.3068 3.3068 3.6526 3.6526 3.6526 3.6526 4.4042 4.4042 4.4042 4.4042 5.1281 5.1281 5.1281 5.1281 5.1877 5.1877 5.1877 5.1877 5.4719 5.4719 5.4719 5.4719 6.2152 6.2152 6.2153 6.2153 6.4898 6.4898 6.4898 6.4898 6.5953 6.5953 6.5953 6.5953 6.9231 6.9231 6.9231 6.9231 7.2959 7.2959 7.2959 7.2959 7.6531 7.6531 7.6531 7.6531 10.8509 10.8509 10.8509 10.8509 11.5342 11.5342 11.5343 11.5343 14.1261 14.1261 14.1261 14.1261 k =-0.5000 0.3062 0.2442 ( 3840 PWs) bands (ev): -4.6360 -4.6360 -4.6360 -4.6360 2.3557 2.3557 2.3558 2.3558 3.3068 3.3068 3.3068 3.3068 3.6526 3.6526 3.6526 3.6526 4.4042 4.4042 4.4042 4.4042 5.1281 5.1281 5.1281 5.1281 5.1877 5.1877 5.1877 5.1877 5.4719 5.4719 5.4719 5.4719 6.2152 6.2152 6.2153 6.2153 6.4898 6.4898 6.4898 6.4898 6.5953 6.5953 6.5953 6.5953 6.9231 6.9231 6.9231 6.9231 7.2959 7.2959 7.2959 7.2959 7.6531 7.6531 7.6531 7.6531 10.8509 10.8509 10.8509 10.8509 11.5342 11.5342 11.5343 11.5343 14.1261 14.1261 14.1261 14.1261 k =-0.5000 0.3062 0.2320 ( 3838 PWs) bands (ev): -4.6447 -4.6447 -4.6273 -4.6273 2.3265 2.3265 2.3854 2.3854 3.2674 3.2674 3.3481 3.3481 3.6299 3.6299 3.6769 3.6769 4.3945 4.3945 4.4138 4.4138 5.1018 5.1018 5.1459 5.1459 5.1762 5.1762 5.2047 5.2047 5.4507 5.4507 5.4936 5.4936 6.1730 6.1730 6.2534 6.2534 6.4794 6.4794 6.4990 6.4990 6.5842 6.5842 6.6088 6.6088 6.9190 6.9190 6.9269 6.9270 7.2789 7.2789 7.3139 7.3139 7.6259 7.6259 7.6802 7.6802 10.7727 10.7727 10.9361 10.9361 11.5057 11.5057 11.5608 11.5608 14.0902 14.0902 14.1657 14.1657 k =-0.5000 0.3062 0.2198 ( 3842 PWs) bands (ev): -4.6532 -4.6532 -4.6187 -4.6187 2.2979 2.2979 2.4151 2.4151 3.2304 3.2304 3.3906 3.3906 3.6095 3.6095 3.7026 3.7026 4.3848 4.3848 4.4233 4.4233 5.0700 5.0700 5.1540 5.1540 5.1695 5.1695 5.2254 5.2254 5.4315 5.4316 5.5150 5.5150 6.1273 6.1273 6.2873 6.2874 6.4675 6.4675 6.5075 6.5076 6.5758 6.5759 6.6242 6.6242 6.9146 6.9146 6.9305 6.9306 7.2629 7.2629 7.3325 7.3325 7.5986 7.5986 7.7070 7.7070 10.7019 10.7019 11.0279 11.0279 11.4749 11.4749 11.5856 11.5856 14.0582 14.0582 14.2086 14.2086 k =-0.5000 0.3062 0.2076 ( 3844 PWs) bands (ev): -4.6617 -4.6617 -4.6101 -4.6101 2.2700 2.2700 2.4445 2.4445 3.1961 3.1961 3.4328 3.4328 3.5926 3.5926 3.7297 3.7297 4.3752 4.3752 4.4324 4.4324 5.0353 5.0353 5.1513 5.1513 5.1695 5.1695 5.2450 5.2450 5.4167 5.4167 5.5353 5.5353 6.0787 6.0787 6.3167 6.3167 6.4540 6.4540 6.5160 6.5160 6.5703 6.5703 6.6409 6.6410 6.9099 6.9100 6.9339 6.9339 7.2482 7.2482 7.3513 7.3513 7.5717 7.5717 7.7333 7.7333 10.6388 10.6388 11.1255 11.1255 11.4418 11.4418 11.6091 11.6091 14.0304 14.0304 14.2542 14.2542 k =-0.5000 0.3062 0.1954 ( 3844 PWs) bands (ev): -4.6700 -4.6700 -4.6017 -4.6017 2.2431 2.2431 2.4733 2.4733 3.1650 3.1650 3.4704 3.4704 3.5832 3.5832 3.7580 3.7580 4.3658 4.3658 4.4412 4.4412 4.9988 4.9988 5.1426 5.1427 5.1718 5.1718 5.2587 5.2587 5.4094 5.4094 5.5539 5.5539 6.0280 6.0280 6.3416 6.3416 6.4392 6.4392 6.5246 6.5247 6.5672 6.5673 6.6587 6.6587 6.9050 6.9050 6.9369 6.9369 7.2347 7.2347 7.3696 7.3696 7.5456 7.5456 7.7590 7.7590 10.5836 10.5836 11.2279 11.2279 11.4064 11.4064 11.6322 11.6322 14.0069 14.0069 14.3020 14.3020 k =-0.5000 0.3062 0.1832 ( 3852 PWs) bands (ev): -4.6780 -4.6780 -4.5935 -4.5935 2.2174 2.2174 2.5010 2.5010 3.1374 3.1374 3.4929 3.4929 3.5916 3.5916 3.7875 3.7875 4.3567 4.3567 4.4494 4.4494 4.9612 4.9612 5.1311 5.1311 5.1735 5.1735 5.2641 5.2641 5.4118 5.4118 5.5704 5.5704 5.9762 5.9762 6.3618 6.3618 6.4235 6.4235 6.5336 6.5337 6.5664 6.5664 6.6769 6.6769 6.8998 6.8998 6.9397 6.9398 7.2224 7.2225 7.3863 7.3863 7.5212 7.5212 7.7841 7.7841 10.5365 10.5365 11.3326 11.3327 11.3692 11.3692 11.6569 11.6569 13.9876 13.9876 14.3511 14.3511 k =-0.5000 0.3062 0.1710 ( 3856 PWs) bands (ev): -4.6857 -4.6857 -4.5855 -4.5855 2.1929 2.1929 2.5270 2.5270 3.1137 3.1137 3.4943 3.4943 3.6235 3.6235 3.8184 3.8184 4.3479 4.3479 4.4570 4.4570 4.9227 4.9227 5.1166 5.1166 5.1739 5.1739 5.2623 5.2623 5.4226 5.4226 5.5840 5.5840 5.9249 5.9249 6.3768 6.3768 6.4086 6.4086 6.5427 6.5427 6.5675 6.5676 6.6956 6.6956 6.8943 6.8943 6.9424 6.9424 7.2114 7.2114 7.3991 7.3991 7.5005 7.5005 7.8082 7.8082 10.4974 10.4974 11.3287 11.3287 11.4364 11.4364 11.6875 11.6875 13.9726 13.9726 14.4006 14.4006 k =-0.5000 0.3062 0.1588 ( 3868 PWs) bands (ev): -4.6932 -4.6932 -4.5778 -4.5778 2.1697 2.1697 2.5509 2.5509 3.0943 3.0943 3.4852 3.4852 3.6680 3.6680 3.8505 3.8505 4.3397 4.3397 4.4639 4.4639 4.8837 4.8837 5.0988 5.0988 5.1732 5.1732 5.2572 5.2572 5.4377 5.4377 5.5939 5.5939 5.8761 5.8761 6.3794 6.3794 6.4022 6.4022 6.5513 6.5514 6.5706 6.5707 6.7143 6.7143 6.8885 6.8886 6.9449 6.9449 7.2015 7.2015 7.4033 7.4033 7.4880 7.4880 7.8314 7.8314 10.4663 10.4663 11.2870 11.2870 11.5267 11.5267 11.7347 11.7347 13.9616 13.9616 14.4493 14.4493 k =-0.5000 0.3062 0.1465 ( 3868 PWs) bands (ev): -4.7002 -4.7002 -4.5704 -4.5704 2.1479 2.1479 2.5721 2.5721 3.0795 3.0795 3.4731 3.4731 3.7172 3.7172 3.8843 3.8843 4.3320 4.3320 4.4699 4.4699 4.8443 4.8443 5.0777 5.0777 5.1714 5.1714 5.2520 5.2520 5.4522 5.4523 5.5994 5.5994 5.8332 5.8332 6.3662 6.3662 6.4089 6.4089 6.5589 6.5589 6.5759 6.5759 6.7329 6.7329 6.8826 6.8826 6.9474 6.9474 7.1927 7.1928 7.3949 7.3950 7.4874 7.4875 7.8536 7.8536 10.4432 10.4432 11.2433 11.2433 11.5893 11.5893 11.8134 11.8134 13.9544 13.9544 14.4954 14.4954 k =-0.5000 0.3062 0.1343 ( 3880 PWs) bands (ev): -4.7069 -4.7069 -4.5634 -4.5634 2.1277 2.1277 2.5900 2.5900 3.0696 3.0696 3.4604 3.4604 3.7678 3.7678 3.9198 3.9198 4.3251 4.3251 4.4749 4.4749 4.8047 4.8047 5.0538 5.0538 5.1686 5.1686 5.2478 5.2478 5.4609 5.4609 5.6008 5.6008 5.7994 5.7994 6.3496 6.3496 6.4167 6.4167 6.5651 6.5651 6.5829 6.5829 6.7512 6.7512 6.8764 6.8765 6.9499 6.9499 7.1849 7.1849 7.3771 7.3771 7.4956 7.4956 7.8744 7.8744 10.4279 10.4279 11.1981 11.1981 11.6247 11.6247 11.9226 11.9226 13.9507 13.9507 14.5364 14.5364 k =-0.5000 0.3062 0.1221 ( 3866 PWs) bands (ev): -4.7131 -4.7131 -4.5569 -4.5569 2.1090 2.1090 2.6044 2.6044 3.0646 3.0646 3.4482 3.4482 3.8182 3.8182 3.9577 3.9577 4.3191 4.3191 4.4788 4.4788 4.7652 4.7652 5.0279 5.0279 5.1651 5.1651 5.2450 5.2450 5.4574 5.4574 5.6019 5.6019 5.7775 5.7775 6.3326 6.3326 6.4238 6.4238 6.5703 6.5703 6.5911 6.5911 6.7688 6.7689 6.8704 6.8704 6.9527 6.9527 7.1779 7.1780 7.3551 7.3551 7.5071 7.5071 7.8940 7.8940 10.4200 10.4200 11.1514 11.1514 11.6456 11.6456 12.0494 12.0494 13.9499 13.9499 14.5686 14.5686 k =-0.5000 0.3062 0.1099 ( 3862 PWs) bands (ev): -4.7188 -4.7188 -4.5508 -4.5508 2.0920 2.0920 2.6151 2.6151 3.0642 3.0642 3.4369 3.4369 3.8668 3.8668 3.9983 3.9983 4.3141 4.3141 4.4814 4.4814 4.7257 4.7257 5.0007 5.0007 5.1608 5.1608 5.2432 5.2432 5.4379 5.4379 5.6076 5.6076 5.7663 5.7663 6.3158 6.3158 6.4296 6.4296 6.5751 6.5751 6.5994 6.5994 6.7854 6.7854 6.8647 6.8647 6.9559 6.9559 7.1717 7.1717 7.3317 7.3317 7.5192 7.5192 7.9122 7.9122 10.4192 10.4192 11.1036 11.1036 11.6594 11.6594 12.1862 12.1862 13.9517 13.9517 14.5861 14.5861 k =-0.5000 0.3062 0.0977 ( 3852 PWs) bands (ev): -4.7240 -4.7240 -4.5453 -4.5453 2.0767 2.0767 2.6225 2.6225 3.0678 3.0678 3.4265 3.4265 3.9125 3.9125 4.0422 4.0422 4.3104 4.3104 4.4827 4.4827 4.6867 4.6867 4.9729 4.9729 5.1556 5.1556 5.2419 5.2419 5.4057 5.4057 5.6187 5.6187 5.7625 5.7625 6.2996 6.2996 6.4346 6.4346 6.5796 6.5796 6.6074 6.6074 6.8000 6.8000 6.8599 6.8600 6.9597 6.9597 7.1659 7.1659 7.3082 7.3082 7.5307 7.5307 7.9288 7.9288 10.4251 10.4251 11.0550 11.0550 11.6694 11.6694 12.3293 12.3293 13.9555 13.9555 14.5820 14.5820 k =-0.5000 0.3062 0.0855 ( 3856 PWs) bands (ev): -4.7287 -4.7287 -4.5403 -4.5403 2.0630 2.0630 2.6270 2.6270 3.0745 3.0745 3.4172 3.4172 3.9543 3.9543 4.0892 4.0892 4.3084 4.3084 4.4825 4.4825 4.6483 4.6483 4.9450 4.9450 5.1491 5.1491 5.2407 5.2407 5.3678 5.3678 5.6329 5.6329 5.7630 5.7630 6.2841 6.2841 6.4387 6.4387 6.5837 6.5838 6.6150 6.6150 6.8111 6.8111 6.8575 6.8575 6.9644 6.9644 7.1603 7.1603 7.2854 7.2854 7.5410 7.5410 7.9437 7.9438 10.4372 10.4372 11.0058 11.0058 11.6770 11.6770 12.4771 12.4771 13.9607 13.9607 14.5528 14.5528 k =-0.5000 0.3062 0.0733 ( 3864 PWs) bands (ev): -4.7328 -4.7328 -4.5359 -4.5359 2.0511 2.0511 2.6292 2.6292 3.0833 3.0833 3.4090 3.4090 3.9916 3.9916 4.1386 4.1386 4.3085 4.3085 4.4804 4.4804 4.6109 4.6109 4.9173 4.9173 5.1406 5.1406 5.2388 5.2388 5.3306 5.3306 5.6476 5.6476 5.7657 5.7657 6.2697 6.2697 6.4422 6.4422 6.5875 6.5875 6.6221 6.6221 6.8167 6.8167 6.8591 6.8591 6.9703 6.9703 7.1547 7.1547 7.2638 7.2638 7.5500 7.5500 7.9569 7.9569 10.4550 10.4550 10.9565 10.9565 11.6829 11.6829 12.6282 12.6282 13.9666 13.9666 14.4930 14.4930 k =-0.5000 0.3062 0.0611 ( 3868 PWs) bands (ev): -4.7363 -4.7363 -4.5322 -4.5322 2.0410 2.0410 2.6298 2.6298 3.0930 3.0930 3.4021 3.4021 4.0243 4.0243 4.1889 4.1889 4.3112 4.3112 4.4761 4.4762 4.5752 4.5752 4.8901 4.8901 5.1294 5.1294 5.2353 5.2354 5.2997 5.2997 5.6617 5.6617 5.7693 5.7693 6.2567 6.2567 6.4450 6.4450 6.5909 6.5909 6.6284 6.6284 6.8169 6.8169 6.8645 6.8645 6.9775 6.9775 7.1488 7.1488 7.2442 7.2442 7.5576 7.5576 7.9682 7.9682 10.4778 10.4778 10.9075 10.9075 11.6874 11.6874 12.7816 12.7816 13.9723 13.9723 14.3960 14.3960 k =-0.5000 0.3062 0.0488 ( 3870 PWs) bands (ev): -4.7392 -4.7392 -4.5291 -4.5291 2.0327 2.0327 2.6295 2.6295 3.1025 3.1025 3.3965 3.3965 4.0521 4.0521 4.2382 4.2382 4.3176 4.3176 4.4688 4.4688 4.5423 4.5423 4.8637 4.8637 5.1154 5.1154 5.2292 5.2292 5.2789 5.2789 5.6740 5.6740 5.7732 5.7732 6.2454 6.2454 6.4473 6.4473 6.5938 6.5938 6.6341 6.6341 6.8142 6.8142 6.8712 6.8712 6.9860 6.9861 7.1420 7.1420 7.2275 7.2275 7.5637 7.5637 7.9775 7.9775 10.5049 10.5049 10.8593 10.8593 11.6909 11.6909 12.9361 12.9361 13.9766 13.9766 14.2728 14.2728 k =-0.5000 0.3062 0.0366 ( 3864 PWs) bands (ev): -4.7415 -4.7415 -4.5266 -4.5266 2.0262 2.0262 2.6287 2.6287 3.1110 3.1110 3.3921 3.3921 4.0744 4.0744 4.2835 4.2835 4.3287 4.3287 4.4567 4.4567 4.5141 4.5141 4.8391 4.8391 5.1001 5.1001 5.2213 5.2213 5.2681 5.2681 5.6840 5.6840 5.7767 5.7767 6.2362 6.2362 6.4491 6.4491 6.5961 6.5961 6.6388 6.6388 6.8107 6.8107 6.8772 6.8772 6.9955 6.9955 7.1343 7.1343 7.2143 7.2143 7.5685 7.5685 7.9849 7.9849 10.5354 10.5354 10.8126 10.8126 11.6934 11.6934 13.0895 13.0895 13.9758 13.9758 14.1409 14.1409 k =-0.5000 0.3062 0.0244 ( 3864 PWs) bands (ev): -4.7431 -4.7431 -4.5249 -4.5249 2.0216 2.0216 2.6278 2.6278 3.1177 3.1177 3.3889 3.3889 4.0908 4.0908 4.3199 4.3199 4.3466 4.3466 4.4389 4.4389 4.4926 4.4926 4.8182 4.8182 5.0862 5.0862 5.2146 5.2146 5.2634 5.2634 5.6914 5.6914 5.7795 5.7795 6.2293 6.2293 6.4504 6.4504 6.5977 6.5977 6.6424 6.6424 6.8077 6.8077 6.8816 6.8816 7.0045 7.0046 7.1264 7.1264 7.2051 7.2051 7.5718 7.5718 7.9902 7.9902 10.5676 10.5676 10.7688 10.7688 11.6952 11.6952 13.2374 13.2374 13.9444 13.9444 14.0366 14.0366 k =-0.5000 0.3062 0.0122 ( 3852 PWs) bands (ev): -4.7441 -4.7441 -4.5238 -4.5238 2.0188 2.0188 2.6272 2.6272 3.1219 3.1219 3.3870 3.3870 4.1007 4.1007 4.3433 4.3433 4.3688 4.3688 4.4192 4.4192 4.4776 4.4776 4.8037 4.8037 5.0768 5.0768 5.2106 5.2106 5.2615 5.2615 5.6959 5.6959 5.7813 5.7813 6.2251 6.2251 6.4512 6.4512 6.5988 6.5988 6.6447 6.6447 6.8057 6.8057 6.8843 6.8843 7.0115 7.0115 7.1201 7.1201 7.1999 7.1999 7.5738 7.5738 7.9934 7.9934 10.5976 10.5976 10.7320 10.7320 11.6962 11.6962 13.3664 13.3664 13.8467 13.8467 14.0118 14.0118 k =-0.5000 0.3062 0.0000 ( 3850 PWs) bands (ev): -4.7444 -4.7444 -4.5234 -4.5234 2.0179 2.0179 2.6270 2.6270 3.1233 3.1233 3.3864 3.3864 4.1040 4.1040 4.3533 4.3533 4.3797 4.3797 4.4086 4.4086 4.4715 4.4715 4.7985 4.7985 5.0734 5.0734 5.2092 5.2092 5.2609 5.2609 5.6975 5.6975 5.7820 5.7820 6.2237 6.2237 6.4514 6.4514 6.5991 6.5991 6.6455 6.6455 6.8050 6.8050 6.8851 6.8851 7.0142 7.0142 7.1175 7.1175 7.1982 7.1982 7.5745 7.5745 7.9945 7.9945 10.6124 10.6124 10.7149 10.7149 11.6965 11.6965 13.4286 13.4286 13.7891 13.7891 14.0092 14.0092 k = 0.0000 0.0000 0.2442 ( 3824 PWs) bands (ev): -5.2019 -5.2019 -5.2019 -5.2019 3.1174 3.1174 3.1174 3.1174 3.5492 3.5492 3.5492 3.5492 3.7241 3.7241 3.7241 3.7241 4.4831 4.4831 4.4831 4.4831 4.6728 4.6728 4.6729 4.6729 5.0717 5.0717 5.0717 5.0717 5.2678 5.2678 5.2678 5.2678 5.5102 5.5102 5.5102 5.5102 6.5464 6.5464 6.5465 6.5465 6.7137 6.7137 6.7137 6.7137 6.8119 6.8119 6.8119 6.8119 8.7198 8.7198 8.7199 8.7199 8.9633 8.9633 8.9634 8.9634 10.4197 10.4197 10.4197 10.4197 12.6675 12.6675 12.6675 12.6675 14.5825 14.5825 14.5825 14.5825 k =-0.0104 0.0064 0.2442 ( 3818 PWs) bands (ev): -5.2014 -5.2014 -5.2013 -5.2013 3.1154 3.1154 3.1167 3.1167 3.5493 3.5494 3.5506 3.5507 3.7239 3.7239 3.7243 3.7244 4.4819 4.4819 4.4838 4.4838 4.6724 4.6725 4.6737 4.6738 5.0702 5.0702 5.0734 5.0734 5.2681 5.2681 5.2682 5.2683 5.5086 5.5086 5.5116 5.5116 6.5460 6.5461 6.5469 6.5470 6.7134 6.7134 6.7139 6.7140 6.8116 6.8117 6.8128 6.8129 8.7180 8.7181 8.7184 8.7184 8.9575 8.9576 8.9578 8.9578 10.4267 10.4268 10.4271 10.4272 12.6662 12.6662 12.6667 12.6667 14.5850 14.5850 14.5852 14.5853 k =-0.0208 0.0128 0.2442 ( 3822 PWs) bands (ev): -5.1998 -5.1998 -5.1997 -5.1997 3.1109 3.1110 3.1134 3.1135 3.5511 3.5512 3.5536 3.5537 3.7236 3.7237 3.7245 3.7245 4.4802 4.4802 4.4839 4.4839 4.6725 4.6725 4.6750 4.6751 5.0689 5.0689 5.0753 5.0753 5.2691 5.2692 5.2694 5.2695 5.5068 5.5069 5.5129 5.5129 6.5456 6.5457 6.5473 6.5474 6.7128 6.7129 6.7139 6.7140 6.8120 6.8121 6.8143 6.8144 8.7130 8.7130 8.7136 8.7137 8.9407 8.9407 8.9412 8.9412 10.4479 10.4479 10.4487 10.4487 12.6628 12.6628 12.6638 12.6638 14.5927 14.5927 14.5932 14.5932 k =-0.0312 0.0191 0.2442 ( 3822 PWs) bands (ev): -5.1971 -5.1971 -5.1970 -5.1970 3.1040 3.1040 3.1077 3.1077 3.5544 3.5545 3.5581 3.5581 3.7234 3.7234 3.7247 3.7247 4.4780 4.4781 4.4835 4.4835 4.6730 4.6731 4.6767 4.6768 5.0678 5.0679 5.0774 5.0775 5.2709 5.2710 5.2713 5.2714 5.5050 5.5050 5.5140 5.5141 6.5451 6.5452 6.5477 6.5478 6.7122 6.7123 6.7138 6.7139 6.8131 6.8131 6.8165 6.8166 8.7046 8.7047 8.7056 8.7057 8.9140 8.9140 8.9147 8.9147 10.4822 10.4822 10.4833 10.4833 12.6573 12.6573 12.6589 12.6589 14.6055 14.6055 14.6063 14.6063 k =-0.0417 0.0255 0.2442 ( 3822 PWs) bands (ev): -5.1933 -5.1933 -5.1932 -5.1932 3.0948 3.0949 3.0995 3.0995 3.5591 3.5591 3.5637 3.5637 3.7231 3.7232 3.7248 3.7248 4.4754 4.4755 4.4826 4.4827 4.6741 4.6741 4.6788 4.6789 5.0670 5.0670 5.0798 5.0798 5.2735 5.2735 5.2740 5.2740 5.5032 5.5032 5.5151 5.5152 6.5446 6.5447 6.5480 6.5481 6.7114 6.7115 6.7135 6.7136 6.8148 6.8148 6.8192 6.8193 8.6929 8.6929 8.6942 8.6942 8.8789 8.8790 8.8797 8.8798 10.5280 10.5280 10.5295 10.5295 12.6498 12.6498 12.6519 12.6519 14.6228 14.6228 14.6243 14.6243 k =-0.0521 0.0319 0.2442 ( 3820 PWs) bands (ev): -5.1885 -5.1885 -5.1883 -5.1883 3.0836 3.0836 3.0892 3.0892 3.5648 3.5648 3.5703 3.5703 3.7229 3.7229 3.7250 3.7250 4.4725 4.4725 4.4812 4.4813 4.6756 4.6756 4.6813 4.6813 5.0664 5.0664 5.0823 5.0823 5.2767 5.2767 5.2773 5.2773 5.5014 5.5014 5.5162 5.5163 6.5441 6.5442 6.5483 6.5484 6.7106 6.7107 6.7132 6.7133 6.8171 6.8172 6.8226 6.8226 8.6774 8.6775 8.6791 8.6791 8.8374 8.8375 8.8382 8.8383 10.5837 10.5837 10.5854 10.5854 12.6402 12.6402 12.6428 12.6428 14.6435 14.6436 14.6462 14.6462 k =-0.0625 0.0383 0.2442 ( 3812 PWs) bands (ev): -5.1826 -5.1826 -5.1824 -5.1824 3.0706 3.0706 3.0769 3.0770 3.5714 3.5714 3.5776 3.5776 3.7226 3.7226 3.7251 3.7251 4.4692 4.4692 4.4794 4.4794 4.6775 4.6776 4.6841 4.6841 5.0660 5.0660 5.0850 5.0850 5.2806 5.2807 5.2813 5.2813 5.4998 5.4999 5.5175 5.5175 6.5437 6.5438 6.5487 6.5488 6.7098 6.7098 6.7128 6.7128 6.8200 6.8201 6.8265 6.8265 8.6576 8.6577 8.6597 8.6597 8.7916 8.7917 8.7924 8.7925 10.6474 10.6474 10.6494 10.6494 12.6286 12.6286 12.6317 12.6317 14.6601 14.6601 14.6672 14.6672 k =-0.0729 0.0447 0.2442 ( 3810 PWs) bands (ev): -5.1757 -5.1757 -5.1755 -5.1755 3.0560 3.0560 3.0629 3.0630 3.5785 3.5785 3.5853 3.5853 3.7222 3.7222 3.7252 3.7252 4.4656 4.4657 4.4771 4.4772 4.6800 4.6800 4.6871 4.6872 5.0658 5.0659 5.0879 5.0879 5.2852 5.2852 5.2859 5.2859 5.4987 5.4987 5.5190 5.5191 6.5433 6.5433 6.5490 6.5491 6.7089 6.7089 6.7123 6.7124 6.8235 6.8236 6.8308 6.8309 8.6323 8.6324 8.6347 8.6348 8.7441 8.7442 8.7449 8.7450 10.7175 10.7175 10.7198 10.7198 12.6151 12.6151 12.6186 12.6186 14.6321 14.6321 14.6429 14.6429 k =-0.0833 0.0510 0.2442 ( 3806 PWs) bands (ev): -5.1678 -5.1678 -5.1676 -5.1675 3.0399 3.0399 3.0474 3.0474 3.5859 3.5859 3.5931 3.5931 3.7218 3.7219 3.7252 3.7253 4.4618 4.4619 4.4745 4.4745 4.6828 4.6829 4.6905 4.6905 5.0660 5.0660 5.0910 5.0911 5.2904 5.2904 5.2911 5.2912 5.4979 5.4979 5.5209 5.5209 6.5428 6.5429 6.5493 6.5494 6.7079 6.7080 6.7118 6.7119 6.8276 6.8276 6.8357 6.8358 8.5995 8.5995 8.6021 8.6021 8.6984 8.6984 8.6992 8.6992 10.7924 10.7925 10.7949 10.7950 12.5996 12.5996 12.6036 12.6036 14.5682 14.5682 14.5779 14.5779 k =-0.0938 0.0574 0.2442 ( 3814 PWs) bands (ev): -5.1589 -5.1589 -5.1586 -5.1586 3.0226 3.0226 3.0305 3.0306 3.5933 3.5933 3.6008 3.6008 3.7214 3.7214 3.7253 3.7253 4.4578 4.4579 4.4715 4.4715 4.6861 4.6861 4.6940 4.6940 5.0663 5.0664 5.0943 5.0943 5.2961 5.2961 5.2968 5.2968 5.4978 5.4978 5.5233 5.5233 6.5424 6.5424 6.5495 6.5496 6.7070 6.7071 6.7112 6.7113 6.8322 6.8322 6.8410 6.8411 8.5571 8.5571 8.5596 8.5597 8.6573 8.6573 8.6583 8.6583 10.8708 10.8708 10.8735 10.8736 12.5821 12.5821 12.5867 12.5867 14.4980 14.4980 14.5073 14.5073 k =-0.1042 0.0638 0.2442 ( 3822 PWs) bands (ev): -5.1491 -5.1491 -5.1488 -5.1488 3.0043 3.0043 3.0125 3.0126 3.6004 3.6004 3.6080 3.6080 3.7208 3.7209 3.7252 3.7252 4.4537 4.4537 4.4682 4.4682 4.6898 4.6898 4.6978 4.6978 5.0670 5.0671 5.0979 5.0979 5.3023 5.3023 5.3030 5.3030 5.4985 5.4985 5.5263 5.5263 6.5420 6.5420 6.5497 6.5498 6.7061 6.7062 6.7108 6.7108 6.8373 6.8373 6.8468 6.8469 8.5058 8.5058 8.5081 8.5081 8.6211 8.6211 8.6225 8.6225 10.9513 10.9513 10.9543 10.9543 12.5629 12.5629 12.5679 12.5679 14.4270 14.4270 14.4361 14.4361 k =-0.1146 0.0702 0.2442 ( 3826 PWs) bands (ev): -5.1383 -5.1383 -5.1380 -5.1380 2.9851 2.9851 2.9936 2.9936 3.6069 3.6069 3.6145 3.6146 3.7203 3.7203 3.7251 3.7252 4.4496 4.4496 4.4647 4.4648 4.6938 4.6939 4.7018 4.7018 5.0681 5.0681 5.1016 5.1016 5.3090 5.3090 5.3096 5.3096 5.5002 5.5002 5.5302 5.5302 6.5416 6.5416 6.5499 6.5500 6.7053 6.7054 6.7103 6.7104 6.8429 6.8429 6.8530 6.8531 8.4485 8.4485 8.4504 8.4505 8.5878 8.5879 8.5896 8.5897 11.0325 11.0326 11.0358 11.0358 12.5418 12.5418 12.5472 12.5472 14.3574 14.3574 14.3665 14.3665 k =-0.1250 0.0766 0.2442 ( 3826 PWs) bands (ev): -5.1267 -5.1267 -5.1263 -5.1263 2.9651 2.9651 2.9737 2.9738 3.6127 3.6127 3.6202 3.6202 3.7197 3.7197 3.7251 3.7251 4.4454 4.4455 4.4612 4.4612 4.6983 4.6983 4.7060 4.7060 5.0695 5.0696 5.1056 5.1057 5.3161 5.3161 5.3165 5.3166 5.5031 5.5031 5.5351 5.5351 6.5412 6.5413 6.5501 6.5501 6.7046 6.7046 6.7099 6.7100 6.8490 6.8491 6.8597 6.8598 8.3876 8.3876 8.3891 8.3892 8.5555 8.5556 8.5577 8.5578 11.1134 11.1134 11.1170 11.1170 12.5189 12.5189 12.5248 12.5248 14.2912 14.2912 14.3000 14.3001 k =-0.1354 0.0829 0.2442 ( 3826 PWs) bands (ev): -5.1142 -5.1142 -5.1138 -5.1138 2.9445 2.9445 2.9532 2.9532 3.6174 3.6174 3.6248 3.6248 3.7191 3.7191 3.7249 3.7250 4.4414 4.4414 4.4576 4.4576 4.7031 4.7032 4.7104 4.7104 5.0714 5.0715 5.1099 5.1100 5.3235 5.3235 5.3238 5.3238 5.5074 5.5074 5.5411 5.5411 6.5409 6.5410 6.5502 6.5503 6.7039 6.7039 6.7096 6.7096 6.8557 6.8558 6.8669 6.8670 8.3247 8.3248 8.3259 8.3260 8.5232 8.5232 8.5257 8.5258 11.1926 11.1926 11.1965 11.1965 12.4944 12.4944 12.5006 12.5006 14.2298 14.2298 14.2384 14.2384 k =-0.1458 0.0893 0.2442 ( 3822 PWs) bands (ev): -5.1009 -5.1009 -5.1005 -5.1005 2.9233 2.9233 2.9321 2.9321 3.6210 3.6210 3.6281 3.6281 3.7184 3.7184 3.7248 3.7248 4.4375 4.4376 4.4540 4.4540 4.7084 4.7084 4.7150 4.7151 5.0738 5.0738 5.1145 5.1145 5.3311 5.3312 5.3312 5.3312 5.5131 5.5131 5.5484 5.5484 6.5406 6.5407 6.5503 6.5504 6.7033 6.7033 6.7093 6.7094 6.8629 6.8629 6.8745 6.8745 8.2608 8.2609 8.2616 8.2617 8.4904 8.4904 8.4932 8.4933 11.2689 11.2689 11.2731 11.2732 12.4681 12.4681 12.4747 12.4747 14.1747 14.1748 14.1830 14.1830 k =-0.1562 0.0957 0.2442 ( 3826 PWs) bands (ev): -5.0868 -5.0868 -5.0864 -5.0864 2.9016 2.9016 2.9104 2.9104 3.6232 3.6232 3.6299 3.6299 3.7177 3.7177 3.7245 3.7246 4.4338 4.4339 4.4505 4.4505 4.7139 4.7140 4.7199 4.7199 5.0767 5.0768 5.1194 5.1195 5.3388 5.3388 5.3390 5.3390 5.5205 5.5205 5.5571 5.5571 6.5404 6.5404 6.5503 6.5504 6.7027 6.7028 6.7091 6.7091 6.8705 6.8706 6.8825 6.8825 8.1965 8.1965 8.1968 8.1969 8.4569 8.4569 8.4600 8.4601 11.3410 11.3411 11.3456 11.3457 12.4401 12.4401 12.4470 12.4470 14.1274 14.1275 14.1353 14.1353 k =-0.1667 0.1021 0.2442 ( 3826 PWs) bands (ev): -5.0721 -5.0720 -5.0716 -5.0716 2.8796 2.8796 2.8883 2.8883 3.6239 3.6239 3.6302 3.6302 3.7168 3.7169 3.7242 3.7242 4.4304 4.4304 4.4472 4.4472 4.7199 4.7199 4.7250 4.7251 5.0803 5.0803 5.1247 5.1247 5.3464 5.3464 5.3469 5.3469 5.5296 5.5297 5.5672 5.5673 6.5401 6.5402 6.5503 6.5504 6.7022 6.7023 6.7089 6.7089 6.8787 6.8788 6.8909 6.8910 8.1319 8.1319 8.1320 8.1321 8.4227 8.4228 8.4261 8.4262 11.4077 11.4077 11.4127 11.4127 12.4104 12.4104 12.4176 12.4176 14.0893 14.0893 14.0966 14.0966 k =-0.1771 0.1085 0.2442 ( 3828 PWs) bands (ev): -5.0566 -5.0566 -5.0562 -5.0562 2.8572 2.8572 2.8659 2.8659 3.6230 3.6230 3.6290 3.6290 3.7159 3.7159 3.7236 3.7237 4.4272 4.4273 4.4441 4.4441 4.7263 4.7263 4.7305 4.7305 5.0844 5.0844 5.1304 5.1304 5.3540 5.3540 5.3548 5.3548 5.5406 5.5406 5.5790 5.5790 6.5398 6.5399 6.5502 6.5503 6.7018 6.7019 6.7087 6.7088 6.8874 6.8874 6.8998 6.8999 8.0671 8.0672 8.0678 8.0678 8.3880 8.3880 8.3916 8.3917 11.4678 11.4678 11.4732 11.4732 12.3790 12.3790 12.3864 12.3864 14.0614 14.0614 14.0681 14.0681 k =-0.1875 0.1148 0.2442 ( 3824 PWs) bands (ev): -5.0406 -5.0406 -5.0401 -5.0401 2.8346 2.8347 2.8432 2.8432 3.6204 3.6205 3.6261 3.6261 3.7148 3.7149 3.7229 3.7229 4.4244 4.4245 4.4412 4.4412 4.7330 4.7330 4.7363 4.7363 5.0893 5.0893 5.1364 5.1365 5.3615 5.3615 5.3626 5.3626 5.5534 5.5535 5.5923 5.5923 6.5396 6.5397 6.5500 6.5501 6.7015 6.7015 6.7086 6.7087 6.8966 6.8967 6.9092 6.9093 8.0027 8.0028 8.0040 8.0040 8.3528 8.3528 8.3566 8.3567 11.5201 11.5201 11.5259 11.5259 12.3458 12.3458 12.3533 12.3533 14.0450 14.0450 14.0510 14.0510 k =-0.1979 0.1212 0.2442 ( 3828 PWs) bands (ev): -5.0240 -5.0240 -5.0235 -5.0235 2.8119 2.8119 2.8203 2.8203 3.6163 3.6163 3.6216 3.6216 3.7135 3.7136 3.7219 3.7219 4.4220 4.4220 4.4387 4.4387 4.7402 4.7402 4.7425 4.7425 5.0948 5.0948 5.1429 5.1429 5.3688 5.3688 5.3703 5.3703 5.5682 5.5682 5.6072 5.6072 6.5393 6.5394 6.5497 6.5498 6.7012 6.7012 6.7085 6.7085 6.9062 6.9063 6.9190 6.9190 7.9390 7.9390 7.9409 7.9409 8.3172 8.3172 8.3212 8.3213 11.5640 11.5640 11.5701 11.5701 12.3107 12.3107 12.3183 12.3183 14.0407 14.0407 14.0459 14.0460 k =-0.2083 0.1276 0.2442 ( 3822 PWs) bands (ev): -5.0069 -5.0069 -5.0065 -5.0064 2.7890 2.7890 2.7973 2.7973 3.6106 3.6106 3.6156 3.6156 3.7121 3.7121 3.7206 3.7206 4.4199 4.4199 4.4364 4.4365 4.7478 4.7478 4.7491 4.7492 5.1011 5.1011 5.1499 5.1499 5.3760 5.3760 5.3779 5.3779 5.5848 5.5848 5.6238 5.6239 6.5390 6.5391 6.5494 6.5494 6.7009 6.7009 6.7083 6.7083 6.9163 6.9164 6.9292 6.9292 7.8759 7.8760 7.8786 7.8786 8.2813 8.2814 8.2856 8.2856 11.5987 11.5987 11.6052 11.6052 12.2736 12.2737 12.2813 12.2813 14.0489 14.0489 14.0534 14.0534 k =-0.2188 0.1340 0.2442 ( 3828 PWs) bands (ev): -4.9894 -4.9894 -4.9890 -4.9889 2.7661 2.7661 2.7742 2.7742 3.6032 3.6033 3.6080 3.6080 3.7103 3.7103 3.7189 3.7189 4.4181 4.4182 4.4345 4.4345 4.7558 4.7558 4.7562 4.7563 5.1081 5.1081 5.1572 5.1572 5.3829 5.3829 5.3851 5.3851 5.6033 5.6033 5.6421 5.6421 6.5386 6.5387 6.5489 6.5490 6.7006 6.7006 6.7080 6.7081 6.9269 6.9269 6.9398 6.9399 7.8137 7.8138 7.8172 7.8173 8.2454 8.2454 8.2498 8.2499 11.6241 11.6241 11.6309 11.6309 12.2347 12.2347 12.2423 12.2423 14.0695 14.0695 14.0732 14.0732 k =-0.2292 0.1404 0.2442 ( 3828 PWs) bands (ev): -4.9716 -4.9716 -4.9711 -4.9711 2.7431 2.7431 2.7511 2.7511 3.5945 3.5945 3.5990 3.5990 3.7083 3.7084 3.7170 3.7170 4.4167 4.4167 4.4328 4.4328 4.7639 4.7639 4.7644 4.7644 5.1158 5.1158 5.1649 5.1650 5.3896 5.3896 5.3921 5.3922 5.6236 5.6236 5.6618 5.6619 6.5382 6.5383 6.5483 6.5484 6.7002 6.7002 6.7076 6.7076 6.9378 6.9378 6.9508 6.9509 7.7527 7.7527 7.7571 7.7572 8.2095 8.2096 8.2141 8.2142 11.6403 11.6404 11.6473 11.6473 12.1939 12.1939 12.2014 12.2014 14.1017 14.1017 14.1047 14.1047 k =-0.2396 0.1467 0.2442 ( 3830 PWs) bands (ev): -4.9535 -4.9535 -4.9530 -4.9530 2.7203 2.7203 2.7280 2.7280 3.5843 3.5843 3.5886 3.5886 3.7061 3.7061 3.7147 3.7147 4.4156 4.4156 4.4314 4.4315 4.7722 4.7722 4.7735 4.7735 5.1241 5.1241 5.1730 5.1730 5.3959 5.3959 5.3988 5.3989 5.6456 5.6456 5.6831 5.6831 6.5377 6.5378 6.5476 6.5477 6.6998 6.6998 6.7071 6.7071 6.9491 6.9491 6.9622 6.9623 7.6928 7.6928 7.6983 7.6984 8.1738 8.1739 8.1786 8.1786 11.6477 11.6477 11.6548 11.6548 12.1514 12.1515 12.1589 12.1589 14.1444 14.1444 14.1467 14.1467 k =-0.2500 0.1531 0.2442 ( 3834 PWs) bands (ev): -4.9351 -4.9351 -4.9346 -4.9346 2.6975 2.6975 2.7050 2.7050 3.5729 3.5729 3.5770 3.5770 3.7037 3.7037 3.7121 3.7122 4.4147 4.4147 4.4302 4.4303 4.7812 4.7812 4.7831 4.7831 5.1329 5.1330 5.1813 5.1813 5.4018 5.4018 5.4052 5.4052 5.6692 5.6692 5.7058 5.7059 6.5372 6.5373 6.5468 6.5469 6.6993 6.6993 6.7063 6.7064 6.9606 6.9607 6.9740 6.9740 7.6343 7.6343 7.6410 7.6411 8.1384 8.1385 8.1433 8.1434 11.6468 11.6468 11.6539 11.6539 12.1077 12.1077 12.1150 12.1150 14.1957 14.1957 14.1974 14.1974 k =-0.2604 0.1595 0.2442 ( 3836 PWs) bands (ev): -4.9167 -4.9167 -4.9162 -4.9161 2.6749 2.6749 2.6822 2.6822 3.5603 3.5603 3.5643 3.5644 3.7010 3.7011 3.7093 3.7094 4.4140 4.4140 4.4292 4.4293 4.7908 4.7908 4.7934 4.7934 5.1423 5.1423 5.1898 5.1898 5.4074 5.4074 5.4112 5.4112 5.6942 5.6942 5.7299 5.7299 6.5366 6.5367 6.5459 6.5459 6.6986 6.6987 6.7054 6.7054 6.9725 6.9725 6.9861 6.9861 7.5773 7.5774 7.5855 7.5856 8.1035 8.1036 8.1085 8.1086 11.6382 11.6383 11.6453 11.6453 12.0631 12.0631 12.0703 12.0703 14.2531 14.2531 14.2543 14.2543 k =-0.2708 0.1659 0.2442 ( 3836 PWs) bands (ev): -4.8981 -4.8981 -4.8976 -4.8976 2.6526 2.6526 2.6596 2.6596 3.5468 3.5468 3.5507 3.5507 3.6983 3.6983 3.7064 3.7064 4.4134 4.4135 4.4284 4.4284 4.8012 4.8012 4.8043 4.8043 5.1520 5.1520 5.1983 5.1983 5.4126 5.4126 5.4168 5.4168 5.7206 5.7206 5.7551 5.7551 6.5359 6.5360 6.5449 6.5449 6.6978 6.6978 6.7041 6.7041 6.9844 6.9844 6.9984 6.9985 7.5222 7.5222 7.5320 7.5321 8.0692 8.0693 8.0743 8.0744 11.6227 11.6227 11.6296 11.6296 12.0183 12.0183 12.0252 12.0253 14.3138 14.3138 14.3145 14.3145 k =-0.2812 0.1723 0.2442 ( 3840 PWs) bands (ev): -4.8796 -4.8796 -4.8791 -4.8791 2.6305 2.6305 2.6373 2.6373 3.5325 3.5325 3.5362 3.5362 3.6953 3.6954 3.7032 3.7032 4.4129 4.4130 4.4275 4.4276 4.8123 4.8123 4.8159 4.8159 5.1619 5.1619 5.2068 5.2068 5.4173 5.4173 5.4220 5.4220 5.7481 5.7481 5.7813 5.7813 6.5352 6.5352 6.5437 6.5438 6.6967 6.6968 6.7025 6.7025 6.9963 6.9963 7.0110 7.0110 7.4690 7.4690 7.4808 7.4808 8.0356 8.0357 8.0408 8.0408 11.6007 11.6007 11.6073 11.6074 11.9738 11.9739 11.9806 11.9806 14.3739 14.3739 14.3742 14.3743 k =-0.2917 0.1786 0.2442 ( 3836 PWs) bands (ev): -4.8612 -4.8612 -4.8607 -4.8607 2.6089 2.6089 2.6154 2.6154 3.5175 3.5175 3.5211 3.5212 3.6924 3.6924 3.6999 3.6999 4.4125 4.4126 4.4267 4.4268 4.8242 4.8243 4.8282 4.8282 5.1719 5.1719 5.2151 5.2152 5.4216 5.4217 5.4269 5.4269 5.7765 5.7765 5.8085 5.8085 6.5344 6.5344 6.5425 6.5425 6.6954 6.6954 6.7005 6.7005 7.0080 7.0080 7.0236 7.0236 7.4181 7.4182 7.4322 7.4323 8.0028 8.0029 8.0081 8.0081 11.5729 11.5729 11.5791 11.5791 11.9306 11.9306 11.9371 11.9371 14.4291 14.4291 14.4292 14.4292 k =-0.3021 0.1850 0.2442 ( 3836 PWs) bands (ev): -4.8430 -4.8430 -4.8425 -4.8425 2.5876 2.5876 2.5939 2.5939 3.5021 3.5021 3.5056 3.5056 3.6893 3.6893 3.6966 3.6966 4.4121 4.4122 4.4259 4.4259 4.8369 4.8369 4.8411 4.8411 5.1819 5.1819 5.2232 5.2232 5.4255 5.4256 5.4313 5.4314 5.8057 5.8057 5.8364 5.8364 6.5335 6.5335 6.5411 6.5412 6.6936 6.6937 6.6979 6.6979 7.0191 7.0192 7.0361 7.0361 7.3699 7.3699 7.3867 7.3868 7.9710 7.9710 7.9763 7.9763 11.5397 11.5397 11.5455 11.5455 11.8891 11.8891 11.8952 11.8952 14.4744 14.4744 14.4746 14.4746 k =-0.3125 0.1914 0.2442 ( 3838 PWs) bands (ev): -4.8250 -4.8250 -4.8245 -4.8245 2.5668 2.5668 2.5728 2.5728 3.4864 3.4864 3.4898 3.4898 3.6862 3.6862 3.6931 3.6932 4.4117 4.4117 4.4250 4.4250 4.8503 4.8504 4.8548 4.8548 5.1916 5.1916 5.2307 5.2307 5.4290 5.4291 5.4355 5.4355 5.8354 5.8355 5.8648 5.8648 6.5325 6.5326 6.5396 6.5397 6.6914 6.6915 6.6948 6.6948 7.0293 7.0293 7.0481 7.0481 7.3247 7.3248 7.3450 7.3450 7.9402 7.9403 7.9455 7.9456 11.5017 11.5018 11.5069 11.5069 11.8498 11.8498 11.8556 11.8556 14.5053 14.5054 14.5058 14.5058 k =-0.3229 0.1978 0.2442 ( 3842 PWs) bands (ev): -4.8074 -4.8074 -4.8070 -4.8070 2.5466 2.5466 2.5523 2.5523 3.4706 3.4706 3.4738 3.4738 3.6831 3.6831 3.6897 3.6897 4.4111 4.4112 4.4240 4.4240 4.8645 4.8645 4.8691 4.8691 5.2009 5.2009 5.2377 5.2377 5.4322 5.4322 5.4392 5.4393 5.8655 5.8655 5.8935 5.8935 6.5315 6.5315 6.5380 6.5381 6.6887 6.6887 6.6911 6.6911 7.0377 7.0377 7.0590 7.0591 7.2834 7.2835 7.3077 7.3077 7.9106 7.9106 7.9159 7.9159 11.4596 11.4597 11.4641 11.4641 11.8132 11.8132 11.8184 11.8185 14.5193 14.5193 14.5199 14.5199 k =-0.3333 0.2042 0.2442 ( 3840 PWs) bands (ev): -4.7903 -4.7903 -4.7898 -4.7898 2.5271 2.5271 2.5324 2.5324 3.4548 3.4548 3.4579 3.4579 3.6800 3.6800 3.6863 3.6863 4.4106 4.4107 4.4229 4.4230 4.8794 4.8794 4.8840 4.8840 5.2095 5.2096 5.2438 5.2439 5.4349 5.4350 5.4427 5.4428 5.8957 5.8957 5.9223 5.9224 6.5303 6.5304 6.5363 6.5364 6.6854 6.6854 6.6866 6.6867 7.0435 7.0435 7.0679 7.0679 7.2473 7.2473 7.2761 7.2761 7.8822 7.8822 7.8874 7.8875 11.4142 11.4142 11.4180 11.4180 11.7793 11.7793 11.7840 11.7840 14.5163 14.5164 14.5171 14.5171 k =-0.3438 0.2105 0.2442 ( 3840 PWs) bands (ev): -4.7736 -4.7736 -4.7732 -4.7732 2.5082 2.5082 2.5133 2.5133 3.4393 3.4393 3.4422 3.4423 3.6770 3.6770 3.6829 3.6829 4.4100 4.4101 4.4218 4.4218 4.8949 4.8949 4.8996 4.8996 5.2175 5.2175 5.2491 5.2491 5.4375 5.4375 5.4460 5.4460 5.9258 5.9258 5.9511 5.9511 6.5291 6.5291 6.5344 6.5345 6.6813 6.6814 6.6815 6.6815 7.0455 7.0455 7.0726 7.0726 7.2183 7.2183 7.2513 7.2514 7.8552 7.8552 7.8604 7.8604 11.3662 11.3662 11.3693 11.3693 11.7480 11.7480 11.7522 11.7522 14.4993 14.4993 14.5001 14.5001 k =-0.3542 0.2169 0.2442 ( 3844 PWs) bands (ev): -4.7576 -4.7576 -4.7572 -4.7571 2.4901 2.4901 2.4948 2.4948 3.4241 3.4241 3.4269 3.4269 3.6741 3.6741 3.6796 3.6796 4.4093 4.4094 4.4205 4.4205 4.9110 4.9110 4.9157 4.9157 5.2244 5.2244 5.2533 5.2533 5.4398 5.4398 5.4490 5.4491 5.9554 5.9554 5.9795 5.9796 6.5277 6.5278 6.5323 6.5324 6.6755 6.6755 6.6765 6.6766 7.0425 7.0426 7.0704 7.0704 7.1993 7.1993 7.2345 7.2346 7.8296 7.8296 7.8347 7.8348 11.3166 11.3166 11.3190 11.3190 11.7193 11.7193 11.7230 11.7230 14.4721 14.4721 14.4729 14.4729 k =-0.3646 0.2233 0.2442 ( 3848 PWs) bands (ev): -4.7422 -4.7422 -4.7418 -4.7418 2.4728 2.4728 2.4773 2.4773 3.4094 3.4094 3.4120 3.4121 3.6712 3.6713 3.6764 3.6764 4.4086 4.4087 4.4192 4.4192 4.9276 4.9276 4.9322 4.9322 5.2301 5.2301 5.2562 5.2562 5.4420 5.4421 5.4519 5.4520 5.9845 5.9845 6.0074 6.0074 6.5262 6.5263 6.5301 6.5301 6.6687 6.6687 6.6709 6.6710 7.0345 7.0346 7.0600 7.0600 7.1919 7.1919 7.2260 7.2260 7.8055 7.8056 7.8105 7.8105 11.2662 11.2662 11.2679 11.2680 11.6930 11.6930 11.6963 11.6963 14.4385 14.4385 14.4394 14.4394 k =-0.3750 0.2297 0.2442 ( 3846 PWs) bands (ev): -4.7276 -4.7276 -4.7272 -4.7272 2.4565 2.4565 2.4606 2.4606 3.3954 3.3954 3.3978 3.3978 3.6686 3.6686 3.6734 3.6734 4.4079 4.4080 4.4178 4.4178 4.9446 4.9446 4.9492 4.9492 5.2345 5.2345 5.2578 5.2579 5.4442 5.4443 5.4547 5.4547 6.0128 6.0128 6.0345 6.0345 6.5246 6.5246 6.5276 6.5276 6.6613 6.6613 6.6646 6.6646 7.0227 7.0227 7.0434 7.0435 7.1938 7.1938 7.2244 7.2244 7.7830 7.7831 7.7879 7.7879 11.2158 11.2158 11.2170 11.2171 11.6690 11.6690 11.6718 11.6718 14.4017 14.4017 14.4025 14.4025 k =-0.3854 0.2361 0.2442 ( 3842 PWs) bands (ev): -4.7139 -4.7139 -4.7135 -4.7135 2.4412 2.4412 2.4449 2.4449 3.3821 3.3821 3.3844 3.3844 3.6660 3.6661 3.6704 3.6705 4.4072 4.4072 4.4164 4.4164 4.9620 4.9620 4.9665 4.9665 5.2374 5.2375 5.2580 5.2581 5.4465 5.4465 5.4574 5.4574 6.0400 6.0400 6.0606 6.0606 6.5227 6.5228 6.5248 6.5248 6.6533 6.6534 6.6575 6.6575 7.0087 7.0087 7.0245 7.0245 7.2014 7.2014 7.2279 7.2280 7.7622 7.7622 7.7668 7.7669 11.1663 11.1663 11.1671 11.1671 11.6471 11.6471 11.6496 11.6496 14.3638 14.3638 14.3646 14.3646 k =-0.3958 0.2424 0.2442 ( 3848 PWs) bands (ev): -4.7011 -4.7011 -4.7007 -4.7007 2.4269 2.4269 2.4303 2.4303 3.3696 3.3696 3.3717 3.3717 3.6637 3.6637 3.6677 3.6677 4.4065 4.4065 4.4149 4.4149 4.9796 4.9797 4.9841 4.9841 5.2387 5.2388 5.2568 5.2568 5.4488 5.4489 5.4600 5.4600 6.0658 6.0658 6.0854 6.0854 6.5206 6.5206 6.5216 6.5216 6.6449 6.6450 6.6497 6.6498 6.9941 6.9942 7.0057 7.0057 7.2117 7.2117 7.2346 7.2347 7.7431 7.7432 7.7475 7.7476 11.1183 11.1183 11.1187 11.1187 11.6272 11.6273 11.6294 11.6294 14.3266 14.3266 14.3273 14.3273 k =-0.4062 0.2488 0.2442 ( 3844 PWs) bands (ev): -4.6892 -4.6892 -4.6889 -4.6889 2.4137 2.4137 2.4168 2.4169 3.3581 3.3581 3.3600 3.3600 3.6615 3.6615 3.6651 3.6651 4.4058 4.4058 4.4135 4.4135 4.9974 4.9975 5.0018 5.0018 5.2384 5.2384 5.2540 5.2541 5.4513 5.4514 5.4625 5.4625 6.0904 6.0904 6.1088 6.1088 6.5181 6.5181 6.5182 6.5182 6.6365 6.6365 6.6416 6.6417 6.9803 6.9804 6.9884 6.9885 7.2234 7.2234 7.2432 7.2432 7.7258 7.7258 7.7299 7.7300 11.0726 11.0726 11.0727 11.0727 11.6094 11.6094 11.6112 11.6113 14.2910 14.2910 14.2917 14.2917 k =-0.4167 0.2552 0.2442 ( 3848 PWs) bands (ev): -4.6784 -4.6784 -4.6781 -4.6781 2.4018 2.4018 2.4046 2.4046 3.3475 3.3476 3.3492 3.3493 3.6595 3.6595 3.6627 3.6628 4.4052 4.4052 4.4120 4.4121 5.0152 5.0153 5.0195 5.0195 5.2363 5.2363 5.2498 5.2498 5.4540 5.4540 5.4648 5.4649 6.1131 6.1132 6.1304 6.1304 6.5141 6.5142 6.5153 6.5154 6.6283 6.6283 6.6334 6.6334 6.9677 6.9678 6.9732 6.9733 7.2353 7.2354 7.2524 7.2525 7.7102 7.7103 7.7141 7.7141 11.0296 11.0296 11.0298 11.0298 11.5935 11.5935 11.5951 11.5951 14.2580 14.2580 14.2586 14.2586 k =-0.4271 0.2616 0.2442 ( 3840 PWs) bands (ev): -4.6687 -4.6687 -4.6685 -4.6685 2.3911 2.3911 2.3935 2.3935 3.3381 3.3382 3.3396 3.3397 3.6578 3.6578 3.6606 3.6606 4.4046 4.4047 4.4107 4.4107 5.0330 5.0330 5.0371 5.0371 5.2326 5.2326 5.2441 5.2442 5.4567 5.4568 5.4670 5.4671 6.1342 6.1342 6.1502 6.1502 6.5099 6.5099 6.5122 6.5122 6.6206 6.6206 6.6254 6.6254 6.9568 6.9568 6.9603 6.9604 7.2471 7.2471 7.2618 7.2618 7.6966 7.6966 7.7000 7.7001 10.9901 10.9901 10.9904 10.9904 11.5795 11.5795 11.5808 11.5809 14.2281 14.2281 14.2286 14.2286 k =-0.4375 0.2680 0.2442 ( 3848 PWs) bands (ev): -4.6602 -4.6602 -4.6600 -4.6600 2.3817 2.3817 2.3838 2.3838 3.3299 3.3299 3.3312 3.3312 3.6562 3.6562 3.6587 3.6587 4.4041 4.4042 4.4094 4.4094 5.0504 5.0504 5.0544 5.0545 5.2272 5.2272 5.2371 5.2371 5.4594 5.4595 5.4689 5.4689 6.1532 6.1533 6.1678 6.1678 6.5054 6.5055 6.5086 6.5086 6.6137 6.6137 6.6179 6.6179 6.9474 6.9475 6.9495 6.9496 7.2582 7.2582 7.2707 7.2707 7.6847 7.6848 7.6878 7.6878 10.9547 10.9547 10.9551 10.9551 11.5674 11.5674 11.5685 11.5685 14.2015 14.2016 14.2020 14.2020 k =-0.4479 0.2743 0.2442 ( 3848 PWs) bands (ev): -4.6530 -4.6529 -4.6528 -4.6528 2.3737 2.3738 2.3755 2.3755 3.3228 3.3228 3.3239 3.3239 3.6550 3.6550 3.6570 3.6570 4.4038 4.4038 4.4082 4.4082 5.0675 5.0675 5.0714 5.0714 5.2205 5.2205 5.2289 5.2290 5.4622 5.4622 5.4705 5.4705 6.1701 6.1701 6.1829 6.1830 6.5010 6.5010 6.5047 6.5048 6.6078 6.6078 6.6113 6.6113 6.9397 6.9398 6.9409 6.9409 7.2683 7.2683 7.2786 7.2787 7.6748 7.6748 7.6774 7.6775 10.9239 10.9239 10.9243 10.9243 11.5572 11.5572 11.5581 11.5581 14.1788 14.1788 14.1792 14.1792 k =-0.4583 0.2807 0.2442 ( 3844 PWs) bands (ev): -4.6469 -4.6469 -4.6468 -4.6468 2.3672 2.3672 2.3686 2.3686 3.3170 3.3170 3.3179 3.3179 3.6539 3.6540 3.6556 3.6556 4.4036 4.4036 4.4071 4.4072 5.0838 5.0838 5.0876 5.0876 5.2126 5.2126 5.2198 5.2198 5.4647 5.4648 5.4717 5.4717 6.1846 6.1847 6.1955 6.1955 6.4968 6.4969 6.5008 6.5008 6.6030 6.6030 6.6057 6.6057 6.9336 6.9336 6.9342 6.9342 7.2771 7.2771 7.2854 7.2854 7.6667 7.6668 7.6689 7.6689 10.8980 10.8981 10.8985 10.8985 11.5489 11.5489 11.5496 11.5496 14.1599 14.1599 14.1602 14.1602 k =-0.4688 0.2871 0.2442 ( 3844 PWs) bands (ev): -4.6422 -4.6422 -4.6421 -4.6421 2.3621 2.3621 2.3631 2.3631 3.3125 3.3125 3.3131 3.3132 3.6532 3.6532 3.6544 3.6544 4.4035 4.4036 4.4062 4.4062 5.0991 5.0991 5.1027 5.1027 5.2041 5.2041 5.2100 5.2101 5.4671 5.4671 5.4724 5.4725 6.1966 6.1966 6.2051 6.2052 6.4934 6.4934 6.4970 6.4970 6.5994 6.5994 6.6013 6.6013 6.9290 6.9290 6.9292 6.9292 7.2844 7.2844 7.2906 7.2907 7.6605 7.6606 7.6622 7.6622 10.8776 10.8776 10.8779 10.8779 11.5424 11.5424 11.5429 11.5429 14.1452 14.1452 14.1454 14.1454 k =-0.4792 0.2935 0.2442 ( 3844 PWs) bands (ev): -4.6388 -4.6388 -4.6387 -4.6387 2.3584 2.3585 2.3591 2.3592 3.3093 3.3093 3.3097 3.3097 3.6527 3.6527 3.6535 3.6535 4.4036 4.4036 4.4054 4.4054 5.1127 5.1127 5.1158 5.1158 5.1958 5.1958 5.2004 5.2004 5.4691 5.4691 5.4727 5.4728 6.2058 6.2058 6.2117 6.2118 6.4909 6.4909 6.4936 6.4937 6.5969 6.5969 6.5981 6.5982 6.9257 6.9257 6.9257 6.9258 7.2901 7.2901 7.2942 7.2943 7.6562 7.6562 7.6573 7.6573 10.8628 10.8628 10.8630 10.8630 11.5378 11.5378 11.5382 11.5382 14.1346 14.1346 14.1347 14.1347 k =-0.4896 0.2999 0.2442 ( 3840 PWs) bands (ev): -4.6367 -4.6367 -4.6367 -4.6367 2.3563 2.3563 2.3567 2.3567 3.3074 3.3074 3.3076 3.3076 3.6525 3.6525 3.6529 3.6529 4.4038 4.4039 4.4047 4.4048 5.1232 5.1232 5.1252 5.1252 5.1894 5.1894 5.1921 5.1921 5.4707 5.4707 5.4726 5.4726 6.2121 6.2121 6.2151 6.2151 6.4896 6.4897 6.4911 6.4912 6.5955 6.5956 6.5961 6.5962 6.9237 6.9237 6.9238 6.9238 7.2940 7.2940 7.2960 7.2961 7.6537 7.6538 7.6543 7.6543 10.8538 10.8538 10.8539 10.8539 11.5351 11.5351 11.5353 11.5353 14.1282 14.1282 14.1283 14.1283 k =-0.5000 0.3062 0.2442 ( 3840 PWs) bands (ev): -4.6360 -4.6360 -4.6360 -4.6360 2.3557 2.3557 2.3558 2.3558 3.3068 3.3068 3.3068 3.3068 3.6526 3.6526 3.6526 3.6526 4.4042 4.4042 4.4042 4.4042 5.1281 5.1281 5.1281 5.1281 5.1877 5.1877 5.1877 5.1877 5.4719 5.4719 5.4719 5.4719 6.2152 6.2152 6.2153 6.2153 6.4898 6.4898 6.4898 6.4898 6.5953 6.5953 6.5953 6.5953 6.9231 6.9231 6.9231 6.9231 7.2959 7.2959 7.2959 7.2959 7.6531 7.6531 7.6531 7.6531 10.8509 10.8509 10.8509 10.8509 11.5342 11.5342 11.5343 11.5343 14.1261 14.1261 14.1261 14.1261 Writing output data file CuAgS.save init_run : 2.79s CPU 12.69s WALL ( 1 calls) electrons : 1001.15s CPU 1011.49s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.31s CPU 2.17s WALL ( 1 calls) Called by electrons: c_bands : 1001.12s CPU 1010.85s WALL ( 1 calls) v_of_rho : 0.10s CPU 0.87s WALL ( 1 calls) v_h : 0.07s CPU 0.07s WALL ( 1 calls) v_xc : 0.03s CPU 0.60s WALL ( 1 calls) newd : 0.54s CPU 0.59s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.13s WALL ( 402 calls) cegterg : 918.52s CPU 924.24s WALL ( 739 calls) Called by sum_band: Called by *egterg: h_psi : 343.99s CPU 351.84s WALL ( 10895 calls) s_psi : 65.18s CPU 65.47s WALL ( 10895 calls) g_psi : 0.84s CPU 0.89s WALL ( 9754 calls) cdiaghg : 387.02s CPU 385.08s WALL ( 10156 calls) cegterg:over : 85.18s CPU 83.21s WALL ( 9754 calls) cegterg:upda : 19.80s CPU 22.37s WALL ( 9754 calls) cegterg:last : 16.12s CPU 16.76s WALL ( 1945 calls) Called by h_psi: h_psi:vloc : 228.93s CPU 234.73s WALL ( 10895 calls) h_psi:vnl : 114.63s CPU 116.15s WALL ( 10895 calls) add_vuspsi : 46.16s CPU 49.08s WALL ( 10895 calls) General routines calbec : 68.43s CPU 67.01s WALL ( 10895 calls) fft : 0.24s CPU 1.31s WALL ( 19 calls) ffts : 0.00s CPU 0.65s WALL ( 4 calls) fftw : 220.00s CPU 221.94s WALL ( 1667684 calls) interpolate : 0.08s CPU 0.78s WALL ( 4 calls) davcio : 0.04s CPU 3.02s WALL ( 804 calls) Parallel routines fft_scatter : 173.89s CPU 172.37s WALL ( 1667707 calls) PWSCF : 18m 4.59s CPU 20m 1.81s WALL This run was terminated on: 2:47:36 15Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=