Program PWSCF v.5.4.0 starts on 3Aug2017 at 18:50: 0 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Al9Fe2.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 75 58 16 4045 2737 409 Max 76 59 17 4053 2761 415 Sum 2721 2093 593 145715 98965 14809 bravais-lattice index = 14 lattice parameter (alat) = 11.9998 a.u. unit-cell volume = 2349.3189 (a.u.)^3 number of atoms/cell = 22 number of atomic types = 2 number of electrons = 86.00 number of Kohn-Sham states= 104 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.999760 celldm(2)= 0.995276 celldm(3)= 1.368504 celldm(4)= 0.059306 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 0.995276 0.000000 ) a(3) = ( 0.000000 0.081161 1.366095 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.004747 -0.059693 ) b(3) = ( 0.000000 0.000000 0.732013 ) PseudoPot. # 1 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 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 Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Fe 8.00 55.84500 Fe( 1.00) Al 3.00 26.98150 Al( 1.00) 2 Sym. Ops., with inversion, found (note: 2 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 210 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0000000 0.0000000 0.0192635), wk = 0.0047619 k( 3) = ( 0.0000000 0.0000000 0.0385270), wk = 0.0047619 k( 4) = ( 0.0000000 0.0000000 0.0577905), wk = 0.0047619 k( 5) = ( 0.0000000 0.0000000 0.0770540), wk = 0.0047619 k( 6) = ( 0.0000000 0.0000000 0.0963176), wk = 0.0047619 k( 7) = ( 0.0000000 0.0000000 0.1155811), wk = 0.0047619 k( 8) = ( 0.0000000 0.0000000 0.1348446), wk = 0.0047619 k( 9) = ( 0.0000000 0.0000000 0.1541081), wk = 0.0047619 k( 10) = ( 0.0000000 0.0000000 0.1733716), wk = 0.0047619 k( 11) = ( 0.0000000 0.0000000 0.1926351), wk = 0.0047619 k( 12) = ( 0.0000000 0.0000000 0.2118986), wk = 0.0047619 k( 13) = ( 0.0000000 0.0000000 0.2311621), wk = 0.0047619 k( 14) = ( 0.0000000 0.0000000 0.2504256), wk = 0.0047619 k( 15) = ( 0.0000000 0.0000000 0.2696892), wk = 0.0047619 k( 16) = ( 0.0000000 0.0000000 0.2889527), wk = 0.0047619 k( 17) = ( 0.0000000 0.0000000 0.3082162), wk = 0.0047619 k( 18) = ( 0.0000000 0.0000000 0.3274797), wk = 0.0047619 k( 19) = ( 0.0000000 0.0000000 0.3467432), wk = 0.0047619 k( 20) = ( 0.0000000 0.0000000 0.3660067), wk = 0.0047619 k( 21) = ( 0.0000000 0.0000000 0.3660067), wk = 0.0047619 k( 22) = ( 0.0000000 0.0201001 0.3660067), wk = 0.0047619 k( 23) = ( 0.0000000 0.0402002 0.3660067), wk = 0.0047619 k( 24) = ( 0.0000000 0.0603002 0.3660067), wk = 0.0047619 k( 25) = ( 0.0000000 0.0804003 0.3660067), wk = 0.0047619 k( 26) = ( 0.0000000 0.1005004 0.3660067), wk = 0.0047619 k( 27) = ( 0.0000000 0.1206005 0.3660067), wk = 0.0047619 k( 28) = ( 0.0000000 0.1407005 0.3660067), wk = 0.0047619 k( 29) = ( 0.0000000 0.1608006 0.3660067), wk = 0.0047619 k( 30) = ( 0.0000000 0.1809007 0.3660067), wk = 0.0047619 k( 31) = ( 0.0000000 0.2010008 0.3660067), wk = 0.0047619 k( 32) = ( 0.0000000 0.2211008 0.3660067), wk = 0.0047619 k( 33) = ( 0.0000000 0.2412009 0.3660067), wk = 0.0047619 k( 34) = ( 0.0000000 0.2613010 0.3660067), wk = 0.0047619 k( 35) = ( 0.0000000 0.2814011 0.3660067), wk = 0.0047619 k( 36) = ( 0.0000000 0.3015011 0.3660067), wk = 0.0047619 k( 37) = ( 0.0000000 0.3216012 0.3660067), wk = 0.0047619 k( 38) = ( 0.0000000 0.3417013 0.3660067), wk = 0.0047619 k( 39) = ( 0.0000000 0.3618014 0.3660067), wk = 0.0047619 k( 40) = ( 0.0000000 0.3819014 0.3660067), wk = 0.0047619 k( 41) = ( 0.0000000 0.4020015 0.3660067), wk = 0.0047619 k( 42) = ( 0.0000000 0.4221016 0.3660067), wk = 0.0047619 k( 43) = ( 0.0000000 0.4422017 0.3660067), wk = 0.0047619 k( 44) = ( 0.0000000 0.4623017 0.3660067), wk = 0.0047619 k( 45) = ( 0.0000000 0.4824018 0.3660067), wk = 0.0047619 k( 46) = ( 0.0000000 0.4824018 0.3660067), wk = 0.0047619 k( 47) = ( 0.0000000 0.4923876 0.3510835), wk = 0.0047619 k( 48) = ( 0.0000000 0.5023734 0.3361602), wk = 0.0047619 k( 49) = ( 0.0000000 0.5023734 0.3361602), wk = 0.0047619 k( 50) = ( 0.0200000 0.5023734 0.3361602), wk = 0.0047619 k( 51) = ( 0.0400000 0.5023734 0.3361602), wk = 0.0047619 k( 52) = ( 0.0600000 0.5023734 0.3361602), wk = 0.0047619 k( 53) = ( 0.0800000 0.5023734 0.3361602), wk = 0.0047619 k( 54) = ( 0.1000000 0.5023734 0.3361602), wk = 0.0047619 k( 55) = ( 0.1200000 0.5023734 0.3361602), wk = 0.0047619 k( 56) = ( 0.1400000 0.5023734 0.3361602), wk = 0.0047619 k( 57) = ( 0.1600000 0.5023734 0.3361602), wk = 0.0047619 k( 58) = ( 0.1800000 0.5023734 0.3361602), wk = 0.0047619 k( 59) = ( 0.2000000 0.5023734 0.3361602), wk = 0.0047619 k( 60) = ( 0.2200000 0.5023734 0.3361602), wk = 0.0047619 k( 61) = ( 0.2400000 0.5023734 0.3361602), wk = 0.0047619 k( 62) = ( 0.2600000 0.5023734 0.3361602), wk = 0.0047619 k( 63) = ( 0.2800000 0.5023734 0.3361602), wk = 0.0047619 k( 64) = ( 0.3000000 0.5023734 0.3361602), wk = 0.0047619 k( 65) = ( 0.3200000 0.5023734 0.3361602), wk = 0.0047619 k( 66) = ( 0.3400000 0.5023734 0.3361602), wk = 0.0047619 k( 67) = ( 0.3600000 0.5023734 0.3361602), wk = 0.0047619 k( 68) = ( 0.3800000 0.5023734 0.3361602), wk = 0.0047619 k( 69) = ( 0.4000000 0.5023734 0.3361602), wk = 0.0047619 k( 70) = ( 0.4200000 0.5023734 0.3361602), wk = 0.0047619 k( 71) = ( 0.4400000 0.5023734 0.3361602), wk = 0.0047619 k( 72) = ( 0.4600000 0.5023734 0.3361602), wk = 0.0047619 k( 73) = ( 0.4800000 0.5023734 0.3361602), wk = 0.0047619 k( 74) = ( 0.5000000 0.5023734 0.3361602), wk = 0.0047619 k( 75) = ( 0.5000000 0.5023734 0.3361602), wk = 0.0047619 k( 76) = ( 0.5000000 0.5123592 0.3212370), wk = 0.0047619 k( 77) = ( 0.5000000 0.5223450 0.3063138), wk = 0.0047619 k( 78) = ( 0.5000000 0.5223450 0.3063138), wk = 0.0047619 k( 79) = ( 0.5000000 0.5211702 0.2865396), wk = 0.0047619 k( 80) = ( 0.5000000 0.5199954 0.2667655), wk = 0.0047619 k( 81) = ( 0.5000000 0.5188206 0.2469914), wk = 0.0047619 k( 82) = ( 0.5000000 0.5176458 0.2272172), wk = 0.0047619 k( 83) = ( 0.5000000 0.5164710 0.2074431), wk = 0.0047619 k( 84) = ( 0.5000000 0.5152962 0.1876690), wk = 0.0047619 k( 85) = ( 0.5000000 0.5141214 0.1678948), wk = 0.0047619 k( 86) = ( 0.5000000 0.5129466 0.1481207), wk = 0.0047619 k( 87) = ( 0.5000000 0.5117718 0.1283466), wk = 0.0047619 k( 88) = ( 0.5000000 0.5105970 0.1085724), wk = 0.0047619 k( 89) = ( 0.5000000 0.5094222 0.0887983), wk = 0.0047619 k( 90) = ( 0.5000000 0.5082474 0.0690242), wk = 0.0047619 k( 91) = ( 0.5000000 0.5070726 0.0492500), wk = 0.0047619 k( 92) = ( 0.5000000 0.5058978 0.0294759), wk = 0.0047619 k( 93) = ( 0.5000000 0.5047230 0.0097018), wk = 0.0047619 k( 94) = ( 0.5000000 0.5035482 -0.0100724), wk = 0.0047619 k( 95) = ( 0.5000000 0.5023734 -0.0298465), wk = 0.0047619 k( 96) = ( 0.5000000 0.5023734 -0.0298465), wk = 0.0047619 k( 97) = ( 0.4800000 0.5023734 -0.0298465), wk = 0.0047619 k( 98) = ( 0.4600000 0.5023734 -0.0298465), wk = 0.0047619 k( 99) = ( 0.4400000 0.5023734 -0.0298465), wk = 0.0047619 k( 100) = ( 0.4200000 0.5023734 -0.0298465), wk = 0.0047619 k( 101) = ( 0.4000000 0.5023734 -0.0298465), wk = 0.0047619 k( 102) = ( 0.3800000 0.5023734 -0.0298465), wk = 0.0047619 k( 103) = ( 0.3600000 0.5023734 -0.0298465), wk = 0.0047619 k( 104) = ( 0.3400000 0.5023734 -0.0298465), wk = 0.0047619 k( 105) = ( 0.3200000 0.5023734 -0.0298465), wk = 0.0047619 k( 106) = ( 0.3000000 0.5023734 -0.0298465), wk = 0.0047619 k( 107) = ( 0.2800000 0.5023734 -0.0298465), wk = 0.0047619 k( 108) = ( 0.2600000 0.5023734 -0.0298465), wk = 0.0047619 k( 109) = ( 0.2400000 0.5023734 -0.0298465), wk = 0.0047619 k( 110) = ( 0.2200000 0.5023734 -0.0298465), wk = 0.0047619 k( 111) = ( 0.2000000 0.5023734 -0.0298465), wk = 0.0047619 k( 112) = ( 0.1800000 0.5023734 -0.0298465), wk = 0.0047619 k( 113) = ( 0.1600000 0.5023734 -0.0298465), wk = 0.0047619 k( 114) = ( 0.1400000 0.5023734 -0.0298465), wk = 0.0047619 k( 115) = ( 0.1200000 0.5023734 -0.0298465), wk = 0.0047619 k( 116) = ( 0.1000000 0.5023734 -0.0298465), wk = 0.0047619 k( 117) = ( 0.0800000 0.5023734 -0.0298465), wk = 0.0047619 k( 118) = ( 0.0600000 0.5023734 -0.0298465), wk = 0.0047619 k( 119) = ( 0.0400000 0.5023734 -0.0298465), wk = 0.0047619 k( 120) = ( 0.0200000 0.5023734 -0.0298465), wk = 0.0047619 k( 121) = ( 0.0000000 0.5023734 -0.0298465), wk = 0.0047619 k( 122) = ( 0.0000000 0.5023734 -0.0298465), wk = 0.0047619 k( 123) = ( 0.0000000 0.5035482 -0.0100724), wk = 0.0047619 k( 124) = ( 0.0000000 0.5047230 0.0097018), wk = 0.0047619 k( 125) = ( 0.0000000 0.5058978 0.0294759), wk = 0.0047619 k( 126) = ( 0.0000000 0.5070726 0.0492500), wk = 0.0047619 k( 127) = ( 0.0000000 0.5082474 0.0690242), wk = 0.0047619 k( 128) = ( 0.0000000 0.5094222 0.0887983), wk = 0.0047619 k( 129) = ( 0.0000000 0.5105970 0.1085724), wk = 0.0047619 k( 130) = ( 0.0000000 0.5117718 0.1283466), wk = 0.0047619 k( 131) = ( 0.0000000 0.5129466 0.1481207), wk = 0.0047619 k( 132) = ( 0.0000000 0.5141214 0.1678948), wk = 0.0047619 k( 133) = ( 0.0000000 0.5152962 0.1876690), wk = 0.0047619 k( 134) = ( 0.0000000 0.5164710 0.2074431), wk = 0.0047619 k( 135) = ( 0.0000000 0.5176458 0.2272172), wk = 0.0047619 k( 136) = ( 0.0000000 0.5188206 0.2469914), wk = 0.0047619 k( 137) = ( 0.0000000 0.5199954 0.2667655), wk = 0.0047619 k( 138) = ( 0.0000000 0.5211702 0.2865396), wk = 0.0047619 k( 139) = ( 0.0000000 0.5223450 0.3063138), wk = 0.0047619 k( 140) = ( 0.5000000 0.4824018 0.3660067), wk = 0.0047619 k( 141) = ( 0.5000000 0.4623017 0.3660067), wk = 0.0047619 k( 142) = ( 0.5000000 0.4422017 0.3660067), wk = 0.0047619 k( 143) = ( 0.5000000 0.4221016 0.3660067), wk = 0.0047619 k( 144) = ( 0.5000000 0.4020015 0.3660067), wk = 0.0047619 k( 145) = ( 0.5000000 0.3819014 0.3660067), wk = 0.0047619 k( 146) = ( 0.5000000 0.3618014 0.3660067), wk = 0.0047619 k( 147) = ( 0.5000000 0.3417013 0.3660067), wk = 0.0047619 k( 148) = ( 0.5000000 0.3216012 0.3660067), wk = 0.0047619 k( 149) = ( 0.5000000 0.3015011 0.3660067), wk = 0.0047619 k( 150) = ( 0.5000000 0.2814011 0.3660067), wk = 0.0047619 k( 151) = ( 0.5000000 0.2613010 0.3660067), wk = 0.0047619 k( 152) = ( 0.5000000 0.2412009 0.3660067), wk = 0.0047619 k( 153) = ( 0.5000000 0.2211008 0.3660067), wk = 0.0047619 k( 154) = ( 0.5000000 0.2010008 0.3660067), wk = 0.0047619 k( 155) = ( 0.5000000 0.1809007 0.3660067), wk = 0.0047619 k( 156) = ( 0.5000000 0.1608006 0.3660067), wk = 0.0047619 k( 157) = ( 0.5000000 0.1407005 0.3660067), wk = 0.0047619 k( 158) = ( 0.5000000 0.1206005 0.3660067), wk = 0.0047619 k( 159) = ( 0.5000000 0.1005004 0.3660067), wk = 0.0047619 k( 160) = ( 0.5000000 0.0804003 0.3660067), wk = 0.0047619 k( 161) = ( 0.5000000 0.0603002 0.3660067), wk = 0.0047619 k( 162) = ( 0.5000000 0.0402002 0.3660067), wk = 0.0047619 k( 163) = ( 0.5000000 0.0201001 0.3660067), wk = 0.0047619 k( 164) = ( 0.5000000 -0.0000000 0.3660067), wk = 0.0047619 k( 165) = ( 0.5000000 -0.0000000 0.3660067), wk = 0.0047619 k( 166) = ( 0.5000000 -0.0000000 0.3467432), wk = 0.0047619 k( 167) = ( 0.5000000 -0.0000000 0.3274797), wk = 0.0047619 k( 168) = ( 0.5000000 -0.0000000 0.3082162), wk = 0.0047619 k( 169) = ( 0.5000000 -0.0000000 0.2889527), wk = 0.0047619 k( 170) = ( 0.5000000 -0.0000000 0.2696892), wk = 0.0047619 k( 171) = ( 0.5000000 -0.0000000 0.2504256), wk = 0.0047619 k( 172) = ( 0.5000000 -0.0000000 0.2311621), wk = 0.0047619 k( 173) = ( 0.5000000 -0.0000000 0.2118986), wk = 0.0047619 k( 174) = ( 0.5000000 -0.0000000 0.1926351), wk = 0.0047619 k( 175) = ( 0.5000000 -0.0000000 0.1733716), wk = 0.0047619 k( 176) = ( 0.5000000 -0.0000000 0.1541081), wk = 0.0047619 k( 177) = ( 0.5000000 -0.0000000 0.1348446), wk = 0.0047619 k( 178) = ( 0.5000000 -0.0000000 0.1155811), wk = 0.0047619 k( 179) = ( 0.5000000 -0.0000000 0.0963176), wk = 0.0047619 k( 180) = ( 0.5000000 -0.0000000 0.0770540), wk = 0.0047619 k( 181) = ( 0.5000000 -0.0000000 0.0577905), wk = 0.0047619 k( 182) = ( 0.5000000 -0.0000000 0.0385270), wk = 0.0047619 k( 183) = ( 0.5000000 -0.0000000 0.0192635), wk = 0.0047619 k( 184) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0047619 k( 185) = ( 0.0000000 0.0000000 0.3660067), wk = 0.0047619 k( 186) = ( 0.0200000 -0.0000000 0.3660067), wk = 0.0047619 k( 187) = ( 0.0400000 -0.0000000 0.3660067), wk = 0.0047619 k( 188) = ( 0.0600000 -0.0000000 0.3660067), wk = 0.0047619 k( 189) = ( 0.0800000 -0.0000000 0.3660067), wk = 0.0047619 k( 190) = ( 0.1000000 -0.0000000 0.3660067), wk = 0.0047619 k( 191) = ( 0.1200000 -0.0000000 0.3660067), wk = 0.0047619 k( 192) = ( 0.1400000 -0.0000000 0.3660067), wk = 0.0047619 k( 193) = ( 0.1600000 -0.0000000 0.3660067), wk = 0.0047619 k( 194) = ( 0.1800000 -0.0000000 0.3660067), wk = 0.0047619 k( 195) = ( 0.2000000 -0.0000000 0.3660067), wk = 0.0047619 k( 196) = ( 0.2200000 -0.0000000 0.3660067), wk = 0.0047619 k( 197) = ( 0.2400000 -0.0000000 0.3660067), wk = 0.0047619 k( 198) = ( 0.2600000 -0.0000000 0.3660067), wk = 0.0047619 k( 199) = ( 0.2800000 -0.0000000 0.3660067), wk = 0.0047619 k( 200) = ( 0.3000000 -0.0000000 0.3660067), wk = 0.0047619 k( 201) = ( 0.3200000 -0.0000000 0.3660067), wk = 0.0047619 k( 202) = ( 0.3400000 -0.0000000 0.3660067), wk = 0.0047619 k( 203) = ( 0.3600000 -0.0000000 0.3660067), wk = 0.0047619 k( 204) = ( 0.3800000 -0.0000000 0.3660067), wk = 0.0047619 k( 205) = ( 0.4000000 -0.0000000 0.3660067), wk = 0.0047619 k( 206) = ( 0.4200000 -0.0000000 0.3660067), wk = 0.0047619 k( 207) = ( 0.4400000 -0.0000000 0.3660067), wk = 0.0047619 k( 208) = ( 0.4600000 -0.0000000 0.3660067), wk = 0.0047619 k( 209) = ( 0.4800000 -0.0000000 0.3660067), wk = 0.0047619 k( 210) = ( 0.5000000 -0.0000000 0.3660067), wk = 0.0047619 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0047619 k( 3) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0047619 k( 4) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0047619 k( 5) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0047619 k( 6) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0047619 k( 7) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0047619 k( 8) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0047619 k( 9) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0047619 k( 10) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0047619 k( 11) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0047619 k( 12) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0047619 k( 13) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0047619 k( 14) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0047619 k( 15) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0047619 k( 16) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0047619 k( 17) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0047619 k( 18) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0047619 k( 19) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0047619 k( 20) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 21) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 22) = ( 0.0000000 0.0200051 0.5016313), wk = 0.0047619 k( 23) = ( 0.0000000 0.0400102 0.5032627), wk = 0.0047619 k( 24) = ( 0.0000000 0.0600153 0.5048940), wk = 0.0047619 k( 25) = ( 0.0000000 0.0800205 0.5065254), wk = 0.0047619 k( 26) = ( 0.0000000 0.1000256 0.5081567), wk = 0.0047619 k( 27) = ( 0.0000000 0.1200307 0.5097881), wk = 0.0047619 k( 28) = ( 0.0000000 0.1400358 0.5114194), wk = 0.0047619 k( 29) = ( 0.0000000 0.1600409 0.5130507), wk = 0.0047619 k( 30) = ( 0.0000000 0.1800460 0.5146821), wk = 0.0047619 k( 31) = ( 0.0000000 0.2000512 0.5163134), wk = 0.0047619 k( 32) = ( 0.0000000 0.2200563 0.5179448), wk = 0.0047619 k( 33) = ( 0.0000000 0.2400614 0.5195761), wk = 0.0047619 k( 34) = ( 0.0000000 0.2600665 0.5212075), wk = 0.0047619 k( 35) = ( 0.0000000 0.2800716 0.5228388), wk = 0.0047619 k( 36) = ( 0.0000000 0.3000767 0.5244701), wk = 0.0047619 k( 37) = ( 0.0000000 0.3200818 0.5261015), wk = 0.0047619 k( 38) = ( 0.0000000 0.3400869 0.5277328), wk = 0.0047619 k( 39) = ( 0.0000000 0.3600921 0.5293642), wk = 0.0047619 k( 40) = ( 0.0000000 0.3800972 0.5309955), wk = 0.0047619 k( 41) = ( 0.0000000 0.4001023 0.5326268), wk = 0.0047619 k( 42) = ( 0.0000000 0.4201074 0.5342582), wk = 0.0047619 k( 43) = ( 0.0000000 0.4401125 0.5358895), wk = 0.0047619 k( 44) = ( 0.0000000 0.4601176 0.5375209), wk = 0.0047619 k( 45) = ( 0.0000000 0.4801228 0.5391522), wk = 0.0047619 k( 46) = ( 0.0000000 0.4801228 0.5391522), wk = 0.0047619 k( 47) = ( 0.0000000 0.4900614 0.5195761), wk = 0.0047619 k( 48) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0047619 k( 49) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0047619 k( 50) = ( 0.0200000 0.5000000 0.5000000), wk = 0.0047619 k( 51) = ( 0.0400000 0.5000000 0.5000000), wk = 0.0047619 k( 52) = ( 0.0600000 0.5000000 0.5000000), wk = 0.0047619 k( 53) = ( 0.0800000 0.5000000 0.5000000), wk = 0.0047619 k( 54) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0047619 k( 55) = ( 0.1200000 0.5000000 0.5000000), wk = 0.0047619 k( 56) = ( 0.1400000 0.5000000 0.5000000), wk = 0.0047619 k( 57) = ( 0.1600000 0.5000000 0.5000000), wk = 0.0047619 k( 58) = ( 0.1800000 0.5000000 0.5000000), wk = 0.0047619 k( 59) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0047619 k( 60) = ( 0.2200000 0.5000000 0.5000000), wk = 0.0047619 k( 61) = ( 0.2400000 0.5000000 0.5000000), wk = 0.0047619 k( 62) = ( 0.2600000 0.5000000 0.5000000), wk = 0.0047619 k( 63) = ( 0.2800000 0.5000000 0.5000000), wk = 0.0047619 k( 64) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0047619 k( 65) = ( 0.3200000 0.5000000 0.5000000), wk = 0.0047619 k( 66) = ( 0.3400000 0.5000000 0.5000000), wk = 0.0047619 k( 67) = ( 0.3600000 0.5000000 0.5000000), wk = 0.0047619 k( 68) = ( 0.3800000 0.5000000 0.5000000), wk = 0.0047619 k( 69) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0047619 k( 70) = ( 0.4200000 0.5000000 0.5000000), wk = 0.0047619 k( 71) = ( 0.4400000 0.5000000 0.5000000), wk = 0.0047619 k( 72) = ( 0.4600000 0.5000000 0.5000000), wk = 0.0047619 k( 73) = ( 0.4800000 0.5000000 0.5000000), wk = 0.0047619 k( 74) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 75) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0047619 k( 76) = ( 0.5000000 0.5099386 0.4804239), wk = 0.0047619 k( 77) = ( 0.5000000 0.5198772 0.4608478), wk = 0.0047619 k( 78) = ( 0.5000000 0.5198772 0.4608478), wk = 0.0047619 k( 79) = ( 0.5000000 0.5187080 0.4337391), wk = 0.0047619 k( 80) = ( 0.5000000 0.5175387 0.4066304), wk = 0.0047619 k( 81) = ( 0.5000000 0.5163695 0.3795217), wk = 0.0047619 k( 82) = ( 0.5000000 0.5152003 0.3524130), wk = 0.0047619 k( 83) = ( 0.5000000 0.5140310 0.3253043), wk = 0.0047619 k( 84) = ( 0.5000000 0.5128618 0.2981956), wk = 0.0047619 k( 85) = ( 0.5000000 0.5116925 0.2710869), wk = 0.0047619 k( 86) = ( 0.5000000 0.5105232 0.2439782), wk = 0.0047619 k( 87) = ( 0.5000000 0.5093540 0.2168695), wk = 0.0047619 k( 88) = ( 0.5000000 0.5081847 0.1897609), wk = 0.0047619 k( 89) = ( 0.5000000 0.5070155 0.1626522), wk = 0.0047619 k( 90) = ( 0.5000000 0.5058463 0.1355435), wk = 0.0047619 k( 91) = ( 0.5000000 0.5046770 0.1084348), wk = 0.0047619 k( 92) = ( 0.5000000 0.5035078 0.0813261), wk = 0.0047619 k( 93) = ( 0.5000000 0.5023385 0.0542174), wk = 0.0047619 k( 94) = ( 0.5000000 0.5011693 0.0271087), wk = 0.0047619 k( 95) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 96) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0047619 k( 97) = ( 0.4800000 0.5000000 -0.0000000), wk = 0.0047619 k( 98) = ( 0.4600000 0.5000000 0.0000000), wk = 0.0047619 k( 99) = ( 0.4400000 0.5000000 0.0000000), wk = 0.0047619 k( 100) = ( 0.4200000 0.5000000 0.0000000), wk = 0.0047619 k( 101) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0047619 k( 102) = ( 0.3800000 0.5000000 -0.0000000), wk = 0.0047619 k( 103) = ( 0.3600000 0.5000000 -0.0000000), wk = 0.0047619 k( 104) = ( 0.3400000 0.5000000 0.0000000), wk = 0.0047619 k( 105) = ( 0.3200000 0.5000000 -0.0000000), wk = 0.0047619 k( 106) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0047619 k( 107) = ( 0.2800000 0.5000000 0.0000000), wk = 0.0047619 k( 108) = ( 0.2600000 0.5000000 0.0000000), wk = 0.0047619 k( 109) = ( 0.2400000 0.5000000 0.0000000), wk = 0.0047619 k( 110) = ( 0.2200000 0.5000000 -0.0000000), wk = 0.0047619 k( 111) = ( 0.2000000 0.5000000 0.0000000), wk = 0.0047619 k( 112) = ( 0.1800000 0.5000000 0.0000000), wk = 0.0047619 k( 113) = ( 0.1600000 0.5000000 0.0000000), wk = 0.0047619 k( 114) = ( 0.1400000 0.5000000 0.0000000), wk = 0.0047619 k( 115) = ( 0.1200000 0.5000000 -0.0000000), wk = 0.0047619 k( 116) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0047619 k( 117) = ( 0.0800000 0.5000000 0.0000000), wk = 0.0047619 k( 118) = ( 0.0600000 0.5000000 -0.0000000), wk = 0.0047619 k( 119) = ( 0.0400000 0.5000000 0.0000000), wk = 0.0047619 k( 120) = ( 0.0200000 0.5000000 -0.0000000), wk = 0.0047619 k( 121) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 122) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0047619 k( 123) = ( 0.0000000 0.5011693 0.0271087), wk = 0.0047619 k( 124) = ( 0.0000000 0.5023385 0.0542174), wk = 0.0047619 k( 125) = ( 0.0000000 0.5035078 0.0813261), wk = 0.0047619 k( 126) = ( 0.0000000 0.5046770 0.1084348), wk = 0.0047619 k( 127) = ( 0.0000000 0.5058463 0.1355435), wk = 0.0047619 k( 128) = ( 0.0000000 0.5070155 0.1626522), wk = 0.0047619 k( 129) = ( 0.0000000 0.5081847 0.1897609), wk = 0.0047619 k( 130) = ( 0.0000000 0.5093540 0.2168696), wk = 0.0047619 k( 131) = ( 0.0000000 0.5105232 0.2439782), wk = 0.0047619 k( 132) = ( 0.0000000 0.5116925 0.2710869), wk = 0.0047619 k( 133) = ( 0.0000000 0.5128618 0.2981956), wk = 0.0047619 k( 134) = ( 0.0000000 0.5140310 0.3253043), wk = 0.0047619 k( 135) = ( 0.0000000 0.5152003 0.3524130), wk = 0.0047619 k( 136) = ( 0.0000000 0.5163695 0.3795217), wk = 0.0047619 k( 137) = ( 0.0000000 0.5175387 0.4066304), wk = 0.0047619 k( 138) = ( 0.0000000 0.5187080 0.4337391), wk = 0.0047619 k( 139) = ( 0.0000000 0.5198772 0.4608478), wk = 0.0047619 k( 140) = ( 0.5000000 0.4801228 0.5391522), wk = 0.0047619 k( 141) = ( 0.5000000 0.4601176 0.5375209), wk = 0.0047619 k( 142) = ( 0.5000000 0.4401125 0.5358895), wk = 0.0047619 k( 143) = ( 0.5000000 0.4201074 0.5342582), wk = 0.0047619 k( 144) = ( 0.5000000 0.4001023 0.5326268), wk = 0.0047619 k( 145) = ( 0.5000000 0.3800972 0.5309955), wk = 0.0047619 k( 146) = ( 0.5000000 0.3600921 0.5293642), wk = 0.0047619 k( 147) = ( 0.5000000 0.3400869 0.5277328), wk = 0.0047619 k( 148) = ( 0.5000000 0.3200818 0.5261015), wk = 0.0047619 k( 149) = ( 0.5000000 0.3000767 0.5244701), wk = 0.0047619 k( 150) = ( 0.5000000 0.2800716 0.5228388), wk = 0.0047619 k( 151) = ( 0.5000000 0.2600665 0.5212075), wk = 0.0047619 k( 152) = ( 0.5000000 0.2400614 0.5195761), wk = 0.0047619 k( 153) = ( 0.5000000 0.2200563 0.5179448), wk = 0.0047619 k( 154) = ( 0.5000000 0.2000512 0.5163134), wk = 0.0047619 k( 155) = ( 0.5000000 0.1800460 0.5146821), wk = 0.0047619 k( 156) = ( 0.5000000 0.1600409 0.5130507), wk = 0.0047619 k( 157) = ( 0.5000000 0.1400358 0.5114194), wk = 0.0047619 k( 158) = ( 0.5000000 0.1200307 0.5097881), wk = 0.0047619 k( 159) = ( 0.5000000 0.1000256 0.5081567), wk = 0.0047619 k( 160) = ( 0.5000000 0.0800205 0.5065254), wk = 0.0047619 k( 161) = ( 0.5000000 0.0600153 0.5048940), wk = 0.0047619 k( 162) = ( 0.5000000 0.0400102 0.5032627), wk = 0.0047619 k( 163) = ( 0.5000000 0.0200051 0.5016313), wk = 0.0047619 k( 164) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0047619 k( 165) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0047619 k( 166) = ( 0.5000000 -0.0000000 0.4736842), wk = 0.0047619 k( 167) = ( 0.5000000 -0.0000000 0.4473684), wk = 0.0047619 k( 168) = ( 0.5000000 -0.0000000 0.4210526), wk = 0.0047619 k( 169) = ( 0.5000000 -0.0000000 0.3947368), wk = 0.0047619 k( 170) = ( 0.5000000 -0.0000000 0.3684211), wk = 0.0047619 k( 171) = ( 0.5000000 -0.0000000 0.3421053), wk = 0.0047619 k( 172) = ( 0.5000000 -0.0000000 0.3157895), wk = 0.0047619 k( 173) = ( 0.5000000 -0.0000000 0.2894737), wk = 0.0047619 k( 174) = ( 0.5000000 -0.0000000 0.2631579), wk = 0.0047619 k( 175) = ( 0.5000000 -0.0000000 0.2368421), wk = 0.0047619 k( 176) = ( 0.5000000 -0.0000000 0.2105263), wk = 0.0047619 k( 177) = ( 0.5000000 -0.0000000 0.1842105), wk = 0.0047619 k( 178) = ( 0.5000000 -0.0000000 0.1578947), wk = 0.0047619 k( 179) = ( 0.5000000 -0.0000000 0.1315790), wk = 0.0047619 k( 180) = ( 0.5000000 -0.0000000 0.1052632), wk = 0.0047619 k( 181) = ( 0.5000000 -0.0000000 0.0789474), wk = 0.0047619 k( 182) = ( 0.5000000 -0.0000000 0.0526316), wk = 0.0047619 k( 183) = ( 0.5000000 -0.0000000 0.0263158), wk = 0.0047619 k( 184) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0047619 k( 185) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 186) = ( 0.0200000 -0.0000000 0.5000000), wk = 0.0047619 k( 187) = ( 0.0400000 -0.0000000 0.5000000), wk = 0.0047619 k( 188) = ( 0.0600000 -0.0000000 0.5000000), wk = 0.0047619 k( 189) = ( 0.0800000 -0.0000000 0.5000000), wk = 0.0047619 k( 190) = ( 0.1000000 -0.0000000 0.5000000), wk = 0.0047619 k( 191) = ( 0.1200000 -0.0000000 0.5000000), wk = 0.0047619 k( 192) = ( 0.1400000 -0.0000000 0.5000000), wk = 0.0047619 k( 193) = ( 0.1600000 -0.0000000 0.5000000), wk = 0.0047619 k( 194) = ( 0.1800000 -0.0000000 0.5000000), wk = 0.0047619 k( 195) = ( 0.2000000 -0.0000000 0.5000000), wk = 0.0047619 k( 196) = ( 0.2200000 -0.0000000 0.5000000), wk = 0.0047619 k( 197) = ( 0.2400000 -0.0000000 0.5000000), wk = 0.0047619 k( 198) = ( 0.2600000 -0.0000000 0.5000000), wk = 0.0047619 k( 199) = ( 0.2800000 -0.0000000 0.5000000), wk = 0.0047619 k( 200) = ( 0.3000000 -0.0000000 0.5000000), wk = 0.0047619 k( 201) = ( 0.3200000 -0.0000000 0.5000000), wk = 0.0047619 k( 202) = ( 0.3400000 -0.0000000 0.5000000), wk = 0.0047619 k( 203) = ( 0.3600000 -0.0000000 0.5000000), wk = 0.0047619 k( 204) = ( 0.3800000 -0.0000000 0.5000000), wk = 0.0047619 k( 205) = ( 0.4000000 -0.0000000 0.5000000), wk = 0.0047619 k( 206) = ( 0.4200000 -0.0000000 0.5000000), wk = 0.0047619 k( 207) = ( 0.4400000 -0.0000000 0.5000000), wk = 0.0047619 k( 208) = ( 0.4600000 -0.0000000 0.5000000), wk = 0.0047619 k( 209) = ( 0.4800000 -0.0000000 0.5000000), wk = 0.0047619 k( 210) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0047619 Dense grid: 145715 G-vectors FFT dimensions: ( 60, 60, 81) Smooth grid: 98965 G-vectors FFT dimensions: ( 54, 54, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.15 Mb ( 722, 104) NL pseudopotentials 4.12 Mb ( 361, 748) Each V/rho on FFT grid 0.16 Mb ( 10800) Each G-vector array 0.03 Mb ( 4046) G-vector shells 0.03 Mb ( 3846) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 4.58 Mb ( 722, 416) Each subspace H/S matrix 0.17 Mb ( 104, 104) Each matrix 2.37 Mb ( 748, 2, 104) The potential is recalculated from file : ./Al9Fe2.save/charge-density.dat Starting wfc are 216 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.9 secs Computing kpt #: 2 total cpu time spent up to now is 10.7 secs Computing kpt #: 3 total cpu time spent up to now is 14.6 secs Computing kpt #: 4 total cpu time spent up to now is 18.3 secs Computing kpt #: 5 total cpu time spent up to now is 21.7 secs Computing kpt #: 6 total cpu time spent up to now is 25.2 secs Computing kpt #: 7 total cpu time spent up to now is 28.5 secs Computing kpt #: 8 total cpu time spent up to now is 31.8 secs Computing kpt #: 9 total cpu time spent up to now is 35.2 secs Computing kpt #: 10 total cpu time spent up to now is 38.6 secs Computing kpt #: 11 total cpu time spent up to now is 41.8 secs Computing kpt #: 12 total cpu time spent up to now is 45.1 secs Computing kpt #: 13 total cpu time spent up to now is 48.3 secs Computing kpt #: 14 total cpu time spent up to now is 51.6 secs Computing kpt #: 15 total cpu time spent up to now is 54.9 secs Computing kpt #: 16 total cpu time spent up to now is 58.7 secs Computing kpt #: 17 total cpu time spent up to now is 62.4 secs Computing kpt #: 18 total cpu time spent up to now is 66.3 secs Computing kpt #: 19 total cpu time spent up to now is 69.8 secs Computing kpt #: 20 total cpu time spent up to now is 73.2 secs Computing kpt #: 21 total cpu time spent up to now is 76.6 secs Computing kpt #: 22 total cpu time spent up to now is 80.1 secs Computing kpt #: 23 total cpu time spent up to now is 83.5 secs Computing kpt #: 24 total cpu time spent up to now is 86.9 secs Computing kpt #: 25 total cpu time spent up to now is 90.4 secs Computing kpt #: 26 total cpu time spent up to now is 93.7 secs Computing kpt #: 27 total cpu time spent up to now is 97.1 secs Computing kpt #: 28 total cpu time spent up to now is 100.4 secs Computing kpt #: 29 total cpu time spent up to now is 103.7 secs Computing kpt #: 30 total cpu time spent up to now is 107.1 secs Computing kpt #: 31 total cpu time spent up to now is 110.5 secs Computing kpt #: 32 total cpu time spent up to now is 113.9 secs Computing kpt #: 33 total cpu time spent up to now is 117.2 secs Computing kpt #: 34 total cpu time spent up to now is 120.7 secs Computing kpt #: 35 total cpu time spent up to now is 124.1 secs Computing kpt #: 36 total cpu time spent up to now is 127.5 secs Computing kpt #: 37 total cpu time spent up to now is 131.0 secs Computing kpt #: 38 total cpu time spent up to now is 134.6 secs Computing kpt #: 39 total cpu time spent up to now is 138.0 secs Computing kpt #: 40 total cpu time spent up to now is 141.5 secs Computing kpt #: 41 total cpu time spent up to now is 145.1 secs Computing kpt #: 42 total cpu time spent up to now is 149.0 secs Computing kpt #: 43 total cpu time spent up to now is 152.9 secs Computing kpt #: 44 total cpu time spent up to now is 156.7 secs Computing kpt #: 45 total cpu time spent up to now is 160.6 secs Computing kpt #: 46 total cpu time spent up to now is 164.5 secs Computing kpt #: 47 total cpu time spent up to now is 168.5 secs Computing kpt #: 48 total cpu time spent up to now is 172.3 secs Computing kpt #: 49 total cpu time spent up to now is 176.2 secs Computing kpt #: 50 total cpu time spent up to now is 180.9 secs Computing kpt #: 51 total cpu time spent up to now is 184.8 secs Computing kpt #: 52 total cpu time spent up to now is 188.8 secs Computing kpt #: 53 total cpu time spent up to now is 192.7 secs Computing kpt #: 54 total cpu time spent up to now is 196.6 secs Computing kpt #: 55 total cpu time spent up to now is 200.5 secs Computing kpt #: 56 total cpu time spent up to now is 204.4 secs Computing kpt #: 57 total cpu time spent up to now is 208.2 secs Computing kpt #: 58 total cpu time spent up to now is 212.1 secs Computing kpt #: 59 total cpu time spent up to now is 215.6 secs Computing kpt #: 60 total cpu time spent up to now is 219.2 secs Computing kpt #: 61 total cpu time spent up to now is 222.8 secs Computing kpt #: 62 total cpu time spent up to now is 226.5 secs Computing kpt #: 63 total cpu time spent up to now is 230.2 secs Computing kpt #: 64 total cpu time spent up to now is 233.8 secs Computing kpt #: 65 total cpu time spent up to now is 237.7 secs Computing kpt #: 66 total cpu time spent up to now is 241.9 secs Computing kpt #: 67 total cpu time spent up to now is 245.9 secs Computing kpt #: 68 total cpu time spent up to now is 249.6 secs Computing kpt #: 69 total cpu time spent up to now is 253.1 secs Computing kpt #: 70 total cpu time spent up to now is 256.6 secs Computing kpt #: 71 total cpu time spent up to now is 260.1 secs Computing kpt #: 72 total cpu time spent up to now is 263.6 secs Computing kpt #: 73 total cpu time spent up to now is 267.1 secs Computing kpt #: 74 total cpu time spent up to now is 270.5 secs Computing kpt #: 75 total cpu time spent up to now is 273.9 secs Computing kpt #: 76 total cpu time spent up to now is 277.3 secs Computing kpt #: 77 total cpu time spent up to now is 280.8 secs Computing kpt #: 78 total cpu time spent up to now is 284.2 secs Computing kpt #: 79 total cpu time spent up to now is 287.6 secs Computing kpt #: 80 total cpu time spent up to now is 291.0 secs Computing kpt #: 81 total cpu time spent up to now is 294.5 secs Computing kpt #: 82 total cpu time spent up to now is 298.0 secs Computing kpt #: 83 total cpu time spent up to now is 301.6 secs Computing kpt #: 84 total cpu time spent up to now is 305.6 secs Computing kpt #: 85 total cpu time spent up to now is 310.1 secs Computing kpt #: 86 total cpu time spent up to now is 314.9 secs Computing kpt #: 87 total cpu time spent up to now is 319.7 secs Computing kpt #: 88 total cpu time spent up to now is 324.7 secs Computing kpt #: 89 total cpu time spent up to now is 329.4 secs Computing kpt #: 90 total cpu time spent up to now is 334.3 secs Computing kpt #: 91 total cpu time spent up to now is 339.3 secs Computing kpt #: 92 total cpu time spent up to now is 344.3 secs Computing kpt #: 93 total cpu time spent up to now is 349.4 secs Computing kpt #: 94 total cpu time spent up to now is 354.3 secs Computing kpt #: 95 total cpu time spent up to now is 359.3 secs Computing kpt #: 96 total cpu time spent up to now is 364.3 secs Computing kpt #: 97 total cpu time spent up to now is 369.4 secs Computing kpt #: 98 total cpu time spent up to now is 374.5 secs Computing kpt #: 99 total cpu time spent up to now is 379.5 secs Computing kpt #: 100 total cpu time spent up to now is 384.6 secs Computing kpt #: 101 total cpu time spent up to now is 389.9 secs Computing kpt #: 102 total cpu time spent up to now is 394.6 secs Computing kpt #: 103 total cpu time spent up to now is 399.4 secs Computing kpt #: 104 total cpu time spent up to now is 404.5 secs Computing kpt #: 105 total cpu time spent up to now is 409.7 secs Computing kpt #: 106 total cpu time spent up to now is 414.7 secs Computing kpt #: 107 total cpu time spent up to now is 419.7 secs Computing kpt #: 108 total cpu time spent up to now is 424.6 secs Computing kpt #: 109 total cpu time spent up to now is 428.7 secs Computing kpt #: 110 total cpu time spent up to now is 432.7 secs Computing kpt #: 111 total cpu time spent up to now is 436.8 secs Computing kpt #: 112 total cpu time spent up to now is 440.8 secs Computing kpt #: 113 total cpu time spent up to now is 444.8 secs Computing kpt #: 114 total cpu time spent up to now is 448.8 secs Computing kpt #: 115 total cpu time spent up to now is 452.8 secs Computing kpt #: 116 total cpu time spent up to now is 456.7 secs Computing kpt #: 117 total cpu time spent up to now is 460.7 secs Computing kpt #: 118 total cpu time spent up to now is 464.6 secs Computing kpt #: 119 total cpu time spent up to now is 468.5 secs Computing kpt #: 120 total cpu time spent up to now is 472.5 secs Computing kpt #: 121 total cpu time spent up to now is 476.3 secs Computing kpt #: 122 total cpu time spent up to now is 480.9 secs Computing kpt #: 123 total cpu time spent up to now is 484.8 secs Computing kpt #: 124 total cpu time spent up to now is 488.7 secs Computing kpt #: 125 total cpu time spent up to now is 492.5 secs Computing kpt #: 126 total cpu time spent up to now is 496.5 secs Computing kpt #: 127 total cpu time spent up to now is 500.4 secs Computing kpt #: 128 total cpu time spent up to now is 504.2 secs Computing kpt #: 129 total cpu time spent up to now is 508.1 secs Computing kpt #: 130 total cpu time spent up to now is 511.6 secs Computing kpt #: 131 total cpu time spent up to now is 515.1 secs Computing kpt #: 132 total cpu time spent up to now is 518.6 secs Computing kpt #: 133 total cpu time spent up to now is 522.5 secs Computing kpt #: 134 total cpu time spent up to now is 526.4 secs Computing kpt #: 135 total cpu time spent up to now is 530.3 secs Computing kpt #: 136 total cpu time spent up to now is 534.2 secs Computing kpt #: 137 total cpu time spent up to now is 538.2 secs Computing kpt #: 138 total cpu time spent up to now is 542.1 secs Computing kpt #: 139 total cpu time spent up to now is 545.9 secs Computing kpt #: 140 total cpu time spent up to now is 549.3 secs Computing kpt #: 141 total cpu time spent up to now is 552.7 secs Computing kpt #: 142 total cpu time spent up to now is 556.1 secs Computing kpt #: 143 total cpu time spent up to now is 559.6 secs Computing kpt #: 144 total cpu time spent up to now is 563.2 secs Computing kpt #: 145 total cpu time spent up to now is 566.9 secs Computing kpt #: 146 total cpu time spent up to now is 570.5 secs Computing kpt #: 147 total cpu time spent up to now is 574.1 secs Computing kpt #: 148 total cpu time spent up to now is 577.8 secs Computing kpt #: 149 total cpu time spent up to now is 581.4 secs Computing kpt #: 150 total cpu time spent up to now is 585.0 secs Computing kpt #: 151 total cpu time spent up to now is 588.5 secs Computing kpt #: 152 total cpu time spent up to now is 591.9 secs Computing kpt #: 153 total cpu time spent up to now is 595.4 secs Computing kpt #: 154 total cpu time spent up to now is 598.8 secs Computing kpt #: 155 total cpu time spent up to now is 602.2 secs Computing kpt #: 156 total cpu time spent up to now is 605.7 secs Computing kpt #: 157 total cpu time spent up to now is 609.2 secs Computing kpt #: 158 total cpu time spent up to now is 612.7 secs Computing kpt #: 159 total cpu time spent up to now is 616.5 secs Computing kpt #: 160 total cpu time spent up to now is 620.4 secs Computing kpt #: 161 total cpu time spent up to now is 624.5 secs Computing kpt #: 162 total cpu time spent up to now is 628.4 secs Computing kpt #: 163 total cpu time spent up to now is 632.7 secs Computing kpt #: 164 total cpu time spent up to now is 636.7 secs Computing kpt #: 165 total cpu time spent up to now is 640.7 secs Computing kpt #: 166 total cpu time spent up to now is 644.6 secs Computing kpt #: 167 total cpu time spent up to now is 648.6 secs Computing kpt #: 168 total cpu time spent up to now is 652.6 secs Computing kpt #: 169 total cpu time spent up to now is 656.6 secs Computing kpt #: 170 total cpu time spent up to now is 660.5 secs Computing kpt #: 171 total cpu time spent up to now is 664.1 secs Computing kpt #: 172 total cpu time spent up to now is 667.6 secs Computing kpt #: 173 total cpu time spent up to now is 671.2 secs Computing kpt #: 174 total cpu time spent up to now is 674.7 secs Computing kpt #: 175 total cpu time spent up to now is 678.2 secs Computing kpt #: 176 total cpu time spent up to now is 681.8 secs Computing kpt #: 177 total cpu time spent up to now is 685.2 secs Computing kpt #: 178 total cpu time spent up to now is 688.9 secs Computing kpt #: 179 total cpu time spent up to now is 692.5 secs Computing kpt #: 180 total cpu time spent up to now is 696.0 secs Computing kpt #: 181 total cpu time spent up to now is 700.0 secs Computing kpt #: 182 total cpu time spent up to now is 703.9 secs Computing kpt #: 183 total cpu time spent up to now is 707.8 secs Computing kpt #: 184 total cpu time spent up to now is 711.7 secs Computing kpt #: 185 total cpu time spent up to now is 715.1 secs Computing kpt #: 186 total cpu time spent up to now is 718.6 secs Computing kpt #: 187 total cpu time spent up to now is 722.0 secs Computing kpt #: 188 total cpu time spent up to now is 725.4 secs Computing kpt #: 189 total cpu time spent up to now is 728.9 secs Computing kpt #: 190 total cpu time spent up to now is 732.3 secs Computing kpt #: 191 total cpu time spent up to now is 735.7 secs Computing kpt #: 192 total cpu time spent up to now is 739.1 secs Computing kpt #: 193 total cpu time spent up to now is 742.5 secs Computing kpt #: 194 total cpu time spent up to now is 745.9 secs Computing kpt #: 195 total cpu time spent up to now is 749.3 secs Computing kpt #: 196 total cpu time spent up to now is 752.7 secs Computing kpt #: 197 total cpu time spent up to now is 756.1 secs Computing kpt #: 198 total cpu time spent up to now is 759.5 secs Computing kpt #: 199 total cpu time spent up to now is 763.0 secs Computing kpt #: 200 total cpu time spent up to now is 766.5 secs Computing kpt #: 201 total cpu time spent up to now is 770.1 secs Computing kpt #: 202 total cpu time spent up to now is 773.7 secs Computing kpt #: 203 total cpu time spent up to now is 777.6 secs Computing kpt #: 204 total cpu time spent up to now is 781.7 secs Computing kpt #: 205 total cpu time spent up to now is 785.4 secs Computing kpt #: 206 total cpu time spent up to now is 789.3 secs Computing kpt #: 207 total cpu time spent up to now is 793.3 secs Computing kpt #: 208 total cpu time spent up to now is 797.2 secs Computing kpt #: 209 total cpu time spent up to now is 801.2 secs Computing kpt #: 210 total cpu time spent up to now is 805.1 secs ethr = 1.16E-08, avg # of iterations = 22.6 total cpu time spent up to now is 805.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12349 PWs) bands (ev): -2.3117 -2.3117 -0.5334 -0.5334 -0.1742 -0.1742 1.0921 1.0921 1.2866 1.2866 1.2975 1.2975 1.5313 1.5313 2.6186 2.6186 2.7648 2.7648 2.9170 2.9170 2.9834 2.9834 3.0887 3.0887 3.3297 3.3297 3.4702 3.4702 3.8419 3.8419 4.2436 4.2436 4.5124 4.5124 4.5481 4.5481 4.7490 4.7490 4.8334 4.8334 5.4641 5.4641 5.4715 5.4715 5.6418 5.6418 5.6421 5.6421 5.6946 5.6946 6.1671 6.1671 6.1773 6.1773 6.3064 6.3064 6.4981 6.4981 6.5277 6.5277 6.6045 6.6045 6.6453 6.6453 6.6929 6.6929 6.9006 6.9006 7.0085 7.0085 7.0641 7.0641 7.1946 7.1946 7.4164 7.4164 7.5112 7.5112 7.5309 7.5309 7.6800 7.6800 7.7538 7.7538 7.8113 7.8113 7.8188 7.8188 7.9788 7.9788 8.1006 8.1006 8.5276 8.5276 8.6332 8.6332 9.0256 9.0256 9.4283 9.4283 9.5775 9.5775 9.6908 9.6908 k = 0.0000 0.0000 0.0193 ( 12346 PWs) bands (ev): -2.3103 -2.3103 -0.5585 -0.5585 -0.1466 -0.1466 1.0932 1.0932 1.2878 1.2878 1.2987 1.2987 1.5328 1.5328 2.5966 2.5966 2.7631 2.7631 2.8996 2.8996 2.9859 2.9859 3.0966 3.0966 3.3487 3.3487 3.4741 3.4741 3.8553 3.8553 4.2442 4.2442 4.5140 4.5140 4.5151 4.5151 4.7643 4.7643 4.8347 4.8347 5.4593 5.4593 5.4684 5.4684 5.6396 5.6396 5.6437 5.6437 5.7099 5.7099 6.1641 6.1641 6.1770 6.1770 6.3047 6.3047 6.4951 6.4951 6.5294 6.5294 6.6049 6.6049 6.6429 6.6429 6.6960 6.6960 6.9011 6.9011 7.0085 7.0085 7.0622 7.0622 7.1945 7.1945 7.4160 7.4160 7.5105 7.5105 7.5309 7.5309 7.6801 7.6801 7.7531 7.7531 7.7951 7.7951 7.8344 7.8344 7.9725 7.9725 8.1043 8.1043 8.5281 8.5281 8.6345 8.6345 9.0152 9.0152 9.4279 9.4279 9.5821 9.5821 9.6812 9.6812 k = 0.0000 0.0000 0.0385 ( 12347 PWs) bands (ev): -2.3062 -2.3062 -0.6189 -0.6189 -0.0790 -0.0790 1.0965 1.0965 1.2914 1.2914 1.3020 1.3020 1.5372 1.5372 2.5455 2.5455 2.7438 2.7438 2.8547 2.8547 2.9958 2.9958 3.1161 3.1161 3.3985 3.3985 3.4903 3.4903 3.8921 3.8921 4.2458 4.2458 4.4349 4.4349 4.5197 4.5197 4.7936 4.7936 4.8387 4.8387 5.4460 5.4460 5.4574 5.4574 5.6401 5.6401 5.6460 5.6460 5.7492 5.7492 6.1555 6.1555 6.1762 6.1762 6.2995 6.2995 6.4866 6.4866 6.5341 6.5341 6.6060 6.6060 6.6362 6.6362 6.7044 6.7044 6.9023 6.9023 7.0082 7.0082 7.0567 7.0567 7.1943 7.1943 7.4146 7.4146 7.5084 7.5084 7.5311 7.5311 7.6801 7.6801 7.7505 7.7505 7.7762 7.7762 7.8520 7.8520 7.9551 7.9551 8.1138 8.1138 8.5296 8.5296 8.6380 8.6380 8.9875 8.9875 9.4259 9.4259 9.5900 9.5900 9.6526 9.6526 k = 0.0000 0.0000 0.0578 ( 12360 PWs) bands (ev): -2.2993 -2.2993 -0.6945 -0.6945 0.0086 0.0086 1.1021 1.1021 1.2974 1.2974 1.3077 1.3077 1.5446 1.5446 2.4827 2.4827 2.7018 2.7018 2.7946 2.7946 2.9960 2.9960 3.1527 3.1527 3.4666 3.4666 3.5250 3.5250 3.9448 3.9448 4.2483 4.2483 4.3301 4.3301 4.5291 4.5291 4.8217 4.8217 4.8455 4.8455 5.4262 5.4262 5.4368 5.4368 5.6428 5.6428 5.6470 5.6470 5.8055 5.8055 6.1424 6.1424 6.1757 6.1757 6.2907 6.2907 6.4737 6.4737 6.5397 6.5397 6.6082 6.6082 6.6274 6.6274 6.7163 6.7163 6.9041 6.9041 7.0075 7.0075 7.0476 7.0476 7.1940 7.1940 7.4123 7.4123 7.5049 7.5049 7.5312 7.5312 7.6800 7.6800 7.7430 7.7430 7.7608 7.7608 7.8681 7.8681 7.9300 7.9300 8.1267 8.1267 8.5319 8.5319 8.6428 8.6428 8.9505 8.9505 9.4197 9.4197 9.5916 9.5916 9.6209 9.6209 k = 0.0000 0.0000 0.0771 ( 12363 PWs) bands (ev): -2.2898 -2.2898 -0.7756 -0.7756 0.1065 0.1065 1.1098 1.1098 1.3057 1.3057 1.3155 1.3155 1.5549 1.5549 2.4156 2.4156 2.6461 2.6461 2.7273 2.7273 2.9700 2.9700 3.2125 3.2125 3.5447 3.5447 3.5783 3.5783 4.0067 4.0067 4.2076 4.2076 4.2544 4.2544 4.5431 4.5431 4.8462 4.8462 4.8551 4.8551 5.4023 5.4023 5.4089 5.4089 5.6424 5.6424 5.6450 5.6450 5.8712 5.8712 6.1263 6.1263 6.1764 6.1764 6.2799 6.2799 6.4568 6.4568 6.5424 6.5424 6.6110 6.6110 6.6209 6.6209 6.7302 6.7302 6.9062 6.9062 7.0065 7.0065 7.0350 7.0350 7.1937 7.1937 7.4093 7.4093 7.5000 7.5000 7.5314 7.5314 7.6793 7.6793 7.7278 7.7278 7.7526 7.7526 7.8814 7.8814 7.9011 7.9011 8.1411 8.1411 8.5350 8.5350 8.6481 8.6481 8.9126 8.9126 9.4061 9.4061 9.5824 9.5824 9.6035 9.6035 k = 0.0000 0.0000 0.0963 ( 12364 PWs) bands (ev): -2.2775 -2.2775 -0.8582 -0.8582 0.2106 0.2106 1.1198 1.1198 1.3164 1.3164 1.3256 1.3256 1.5681 1.5681 2.3473 2.3473 2.5839 2.5839 2.6571 2.6571 2.9239 2.9239 3.2877 3.2877 3.6281 3.6281 3.6455 3.6455 4.0723 4.0723 4.0787 4.0787 4.2585 4.2585 4.5623 4.5623 4.8668 4.8668 4.8692 4.8692 5.3756 5.3756 5.3768 5.3768 5.6354 5.6354 5.6383 5.6383 5.9324 5.9324 6.1124 6.1124 6.1789 6.1789 6.2700 6.2700 6.4362 6.4362 6.5359 6.5359 6.6141 6.6141 6.6225 6.6225 6.7449 6.7449 6.9084 6.9084 7.0047 7.0047 7.0196 7.0196 7.1935 7.1935 7.4058 7.4058 7.4938 7.4938 7.5316 7.5316 7.6765 7.6765 7.7108 7.7108 7.7468 7.7468 7.8671 7.8671 7.8955 7.8955 8.1549 8.1549 8.5390 8.5390 8.6530 8.6530 8.8802 8.8802 9.3849 9.3849 9.5761 9.5761 9.5960 9.5960 k = 0.0000 0.0000 0.1156 ( 12358 PWs) bands (ev): -2.2624 -2.2624 -0.9405 -0.9405 0.3190 0.3190 1.1319 1.1319 1.3294 1.3294 1.3379 1.3379 1.5842 1.5842 2.2794 2.2794 2.5192 2.5192 2.5861 2.5861 2.8664 2.8664 3.3713 3.3713 3.7124 3.7124 3.7219 3.7219 3.9445 3.9445 4.1378 4.1378 4.2645 4.2645 4.5876 4.5876 4.8829 4.8829 4.8900 4.8900 5.3407 5.3407 5.3494 5.3494 5.6210 5.6210 5.6256 5.6256 5.9628 5.9628 6.1175 6.1175 6.1831 6.1831 6.2643 6.2643 6.4128 6.4128 6.5184 6.5184 6.6215 6.6215 6.6298 6.6298 6.7595 6.7595 6.9102 6.9102 6.9973 6.9973 7.0069 7.0069 7.1935 7.1935 7.4017 7.4017 7.4863 7.4863 7.5317 7.5317 7.6683 7.6683 7.6984 7.6984 7.7401 7.7401 7.8364 7.8364 7.9041 7.9041 8.1658 8.1658 8.5439 8.5439 8.6580 8.6580 8.8581 8.8581 9.3617 9.3617 9.5765 9.5765 9.5963 9.5963 k = 0.0000 0.0000 0.1348 ( 12353 PWs) bands (ev): -2.2447 -2.2447 -1.0215 -1.0215 0.4308 0.4308 1.1462 1.1462 1.3447 1.3447 1.3525 1.3525 1.6032 1.6032 2.2126 2.2126 2.4538 2.4538 2.5155 2.5155 2.8029 2.8029 3.4601 3.4601 3.7610 3.7610 3.8024 3.8024 3.8453 3.8453 4.1999 4.1999 4.2715 4.2715 4.6196 4.6196 4.9020 4.9020 4.9112 4.9112 5.3039 5.3039 5.3230 5.3230 5.5989 5.5989 5.6074 5.6074 5.9454 5.9454 6.1469 6.1469 6.1885 6.1885 6.2657 6.2657 6.3907 6.3907 6.4934 6.4934 6.6325 6.6325 6.6395 6.6395 6.7729 6.7729 6.9113 6.9113 6.9787 6.9787 7.0033 7.0033 7.1940 7.1940 7.3973 7.3973 7.4778 7.4778 7.5318 7.5318 7.6530 7.6530 7.6927 7.6927 7.7310 7.7310 7.8088 7.8088 7.9103 7.9103 8.1711 8.1711 8.5501 8.5501 8.6652 8.6652 8.8489 8.8489 9.3422 9.3422 9.5749 9.5749 9.6125 9.6125 k = 0.0000 0.0000 0.1541 ( 12355 PWs) bands (ev): -2.2242 -2.2242 -1.1009 -1.1009 0.5455 0.5455 1.1627 1.1627 1.3622 1.3622 1.3693 1.3693 1.6250 1.6250 2.1474 2.1474 2.3888 2.3888 2.4461 2.4461 2.7363 2.7363 3.5523 3.5523 3.6421 3.6421 3.8868 3.8868 3.9110 3.9110 4.2566 4.2566 4.2796 4.2796 4.6585 4.6585 4.9250 4.9250 4.9332 4.9332 5.2662 5.2662 5.2984 5.2984 5.5692 5.5692 5.5846 5.5846 5.8998 5.8998 6.1656 6.1656 6.1945 6.1945 6.2727 6.2727 6.3823 6.3823 6.4653 6.4653 6.6435 6.6435 6.6516 6.6516 6.7836 6.7836 6.9113 6.9113 6.9589 6.9589 7.0008 7.0008 7.1949 7.1949 7.3923 7.3923 7.4684 7.4684 7.5317 7.5317 7.6345 7.6345 7.6890 7.6890 7.7190 7.7190 7.7869 7.7869 7.9138 7.9138 8.1682 8.1682 8.5579 8.5579 8.6770 8.6770 8.8540 8.8540 9.3302 9.3302 9.5759 9.5759 9.6400 9.6400 k = 0.0000 0.0000 0.1734 ( 12352 PWs) bands (ev): -2.2010 -2.2010 -1.1783 -1.1783 0.6625 0.6625 1.1813 1.1813 1.3819 1.3819 1.3882 1.3882 1.6496 1.6496 2.0843 2.0843 2.3251 2.3251 2.3782 2.3782 2.6685 2.6685 3.4975 3.4975 3.6469 3.6469 3.9725 3.9725 4.0006 4.0006 4.2884 4.2884 4.3077 4.3077 4.7025 4.7025 4.9521 4.9521 4.9562 4.9562 5.2285 5.2285 5.2772 5.2772 5.5326 5.5326 5.5582 5.5582 5.8411 5.8411 6.1579 6.1579 6.1931 6.1931 6.2722 6.2722 6.4032 6.4032 6.4389 6.4389 6.6530 6.6530 6.6652 6.6652 6.7892 6.7892 6.9098 6.9098 6.9422 6.9422 6.9983 6.9983 7.1965 7.1965 7.3864 7.3864 7.4587 7.4587 7.5313 7.5313 7.6158 7.6158 7.6821 7.6821 7.7078 7.7078 7.7712 7.7712 7.9150 7.9150 8.1565 8.1565 8.5677 8.5677 8.6933 8.6933 8.8754 8.8754 9.3270 9.3270 9.5841 9.5841 9.6755 9.6755 k = 0.0000 0.0000 0.1926 ( 12346 PWs) bands (ev): -2.1750 -2.1750 -1.2535 -1.2535 0.7814 0.7814 1.2019 1.2019 1.4037 1.4037 1.4093 1.4093 1.6770 1.6770 2.0234 2.0234 2.2632 2.2632 2.3123 2.3123 2.6005 2.6005 3.3499 3.3499 3.7433 3.7433 4.0571 4.0571 4.0916 4.0916 4.2985 4.2985 4.3540 4.3540 4.7487 4.7487 4.9788 4.9788 4.9845 4.9845 5.1913 5.1913 5.2617 5.2617 5.4899 5.4899 5.5293 5.5293 5.7753 5.7753 6.1273 6.1273 6.1786 6.1786 6.2643 6.2643 6.4178 6.4178 6.4447 6.4447 6.6613 6.6613 6.6788 6.6788 6.7870 6.7870 6.9073 6.9073 6.9315 6.9315 6.9959 6.9959 7.1990 7.1990 7.3792 7.3792 7.4496 7.4496 7.5303 7.5303 7.5981 7.5981 7.6682 7.6682 7.7024 7.7024 7.7599 7.7599 7.9144 7.9144 8.1370 8.1370 8.5795 8.5795 8.7103 8.7103 8.9160 8.9160 9.3327 9.3327 9.6016 9.6016 9.7175 9.7175 k = 0.0000 0.0000 0.2119 ( 12349 PWs) bands (ev): -2.1464 -2.1464 -1.3264 -1.3264 0.9017 0.9017 1.2246 1.2246 1.4274 1.4274 1.4326 1.4326 1.7071 1.7071 1.9652 1.9652 2.2035 2.2035 2.2486 2.2486 2.5330 2.5330 3.2015 3.2015 3.8408 3.8408 4.1377 4.1377 4.1809 4.1809 4.3104 4.3104 4.3989 4.3989 4.7932 4.7932 5.0019 5.0019 5.0180 5.0180 5.1558 5.1558 5.2558 5.2558 5.4415 5.4415 5.4997 5.4997 5.7059 5.7059 6.0798 6.0798 6.1507 6.1507 6.2537 6.2537 6.4080 6.4080 6.4871 6.4871 6.6684 6.6684 6.6915 6.6915 6.7768 6.7768 6.9044 6.9044 6.9279 6.9279 6.9938 6.9938 7.2022 7.2022 7.3701 7.3701 7.4421 7.4421 7.5280 7.5280 7.5825 7.5825 7.6514 7.6514 7.7009 7.7009 7.7511 7.7511 7.9128 7.9128 8.1123 8.1123 8.5931 8.5931 8.7240 8.7240 8.9772 8.9772 9.3467 9.3467 9.6297 9.6297 9.7653 9.7653 k = 0.0000 0.0000 0.2312 ( 12360 PWs) bands (ev): -2.1150 -2.1150 -1.3970 -1.3970 1.0224 1.0224 1.2491 1.2491 1.4531 1.4531 1.4579 1.4579 1.7398 1.7398 1.9102 1.9102 2.1466 2.1466 2.1875 2.1875 2.4666 2.4666 3.0531 3.0531 3.9386 3.9386 4.2104 4.2104 4.2619 4.2619 4.3295 4.3295 4.4466 4.4466 4.8330 4.8330 5.0203 5.0203 5.0477 5.0477 5.1257 5.1257 5.2651 5.2651 5.3879 5.3879 5.4712 5.4712 5.6354 5.6354 6.0224 6.0224 6.1104 6.1104 6.2381 6.2381 6.4082 6.4082 6.5236 6.5236 6.6744 6.6744 6.7030 6.7030 6.7629 6.7629 6.8994 6.8994 6.9311 6.9311 6.9921 6.9921 7.2064 7.2064 7.3587 7.3587 7.4369 7.4369 7.5235 7.5235 7.5705 7.5705 7.6353 7.6353 7.7007 7.7007 7.7436 7.7436 7.9109 7.9109 8.0850 8.0850 8.6082 8.6082 8.7331 8.7331 9.0570 9.0570 9.3684 9.3684 9.6688 9.6688 9.8174 9.8174 k = 0.0000 0.0000 0.2504 ( 12358 PWs) bands (ev): -2.0810 -2.0810 -1.4651 -1.4651 1.1420 1.1420 1.2755 1.2755 1.4804 1.4804 1.4859 1.4859 1.7752 1.7752 1.8590 1.8590 2.0931 2.0931 2.1292 2.1292 2.4016 2.4016 2.9053 2.9053 4.0357 4.0357 4.2716 4.2716 4.3076 4.3076 4.3813 4.3813 4.5017 4.5017 4.8667 4.8667 5.0212 5.0212 5.0670 5.0670 5.1124 5.1124 5.2922 5.2922 5.3303 5.3303 5.4483 5.4483 5.5659 5.5659 5.9604 5.9604 6.0615 6.0615 6.2147 6.2147 6.4157 6.4157 6.5488 6.5488 6.6810 6.6810 6.7131 6.7131 6.7511 6.7511 6.8913 6.8913 6.9386 6.9386 6.9907 6.9907 7.2116 7.2116 7.3454 7.3454 7.4343 7.4343 7.5158 7.5158 7.5630 7.5630 7.6210 7.6210 7.7011 7.7011 7.7369 7.7369 7.9094 7.9094 8.0573 8.0573 8.6244 8.6244 8.7381 8.7381 9.1509 9.1509 9.3971 9.3971 9.7194 9.7194 9.8722 9.8722 k = 0.0000 0.0000 0.2697 ( 12358 PWs) bands (ev): -2.0442 -2.0442 -1.5307 -1.5307 1.2566 1.2566 1.3035 1.3035 1.5090 1.5090 1.5183 1.5183 1.8121 1.8121 1.8140 1.8140 2.0439 2.0439 2.0742 2.0742 2.3384 2.3384 2.7587 2.7587 4.1296 4.1296 4.3204 4.3204 4.3248 4.3248 4.4586 4.4586 4.5653 4.5653 4.8941 4.8941 4.9949 4.9949 5.0754 5.0754 5.1231 5.1231 5.2688 5.2688 5.3266 5.3266 5.4423 5.4423 5.4990 5.4990 5.8977 5.8977 6.0087 6.0087 6.1814 6.1814 6.4277 6.4277 6.5596 6.5596 6.6917 6.6917 6.7215 6.7215 6.7447 6.7447 6.8806 6.8806 6.9477 6.9477 6.9897 6.9897 7.2177 7.2177 7.3311 7.3311 7.4340 7.4340 7.5058 7.5058 7.5596 7.5596 7.6088 7.6088 7.7017 7.7017 7.7307 7.7307 7.9090 7.9090 8.0307 8.0307 8.6409 8.6409 8.7399 8.7399 9.2541 9.2541 9.4321 9.4321 9.7815 9.7815 9.9260 9.9260 k = 0.0000 0.0000 0.2890 ( 12356 PWs) bands (ev): -2.0048 -2.0048 -1.5938 -1.5938 1.3327 1.3327 1.3573 1.3573 1.5381 1.5381 1.5599 1.5599 1.7746 1.7746 1.8534 1.8534 2.0006 2.0006 2.0231 2.0231 2.2773 2.2773 2.6140 2.6140 4.2150 4.2150 4.3336 4.3336 4.3666 4.3666 4.5363 4.5363 4.6338 4.6338 4.9155 4.9155 4.9516 4.9516 5.0785 5.0785 5.1412 5.1412 5.2112 5.2112 5.3388 5.3388 5.4360 5.4360 5.4739 5.4739 5.8378 5.8378 5.9567 5.9567 6.1376 6.1376 6.4421 6.4421 6.5573 6.5573 6.7072 6.7072 6.7283 6.7283 6.7439 6.7439 6.8677 6.8677 6.9568 6.9568 6.9889 6.9889 7.2248 7.2248 7.3163 7.3163 7.4356 7.4356 7.4947 7.4947 7.5590 7.5590 7.5983 7.5983 7.7026 7.7026 7.7252 7.7252 7.9101 7.9101 8.0062 8.0062 8.6573 8.6573 8.7389 8.7389 9.3613 9.3613 9.4724 9.4724 9.8553 9.8553 9.9719 9.9719 k = 0.0000 0.0000 0.3082 ( 12359 PWs) bands (ev): -1.9627 -1.9627 -1.6543 -1.6543 1.3629 1.3629 1.4273 1.4273 1.5674 1.5674 1.6160 1.6160 1.7518 1.7518 1.8955 1.8955 1.9664 1.9664 1.9769 1.9769 2.2187 2.2187 2.4719 2.4719 4.2805 4.2805 4.3410 4.3410 4.4210 4.4210 4.6087 4.6087 4.6999 4.6999 4.8967 4.8967 4.9318 4.9318 5.0822 5.0822 5.1327 5.1327 5.1821 5.1821 5.3325 5.3325 5.3794 5.3794 5.5332 5.5332 5.7845 5.7845 5.9114 5.9114 6.0843 6.0843 6.4576 6.4576 6.5474 6.5474 6.7234 6.7234 6.7333 6.7333 6.7486 6.7486 6.8529 6.8529 6.9648 6.9648 6.9878 6.9878 7.2329 7.2329 7.3019 7.3019 7.4388 7.4388 7.4839 7.4839 7.5602 7.5602 7.5894 7.5894 7.7038 7.7038 7.7203 7.7203 7.9131 7.9131 7.9843 7.9843 8.6730 8.6730 8.7354 8.7354 9.4666 9.4666 9.5169 9.5169 9.9344 9.9344 9.9447 9.9447 k = 0.0000 0.0000 0.3275 ( 12354 PWs) bands (ev): -1.9179 -1.9179 -1.7123 -1.7123 1.3930 1.3930 1.4586 1.4586 1.5958 1.5958 1.6580 1.6580 1.7727 1.7727 1.9300 1.9300 1.9447 1.9447 1.9495 1.9495 2.1636 2.1636 2.3342 2.3342 4.3183 4.3183 4.3459 4.3459 4.4944 4.4944 4.6721 4.6721 4.7529 4.7529 4.8320 4.8320 4.9459 4.9459 5.0858 5.0858 5.0936 5.0936 5.1845 5.1845 5.3232 5.3232 5.3356 5.3356 5.5963 5.5963 5.7408 5.7408 5.8813 5.8813 6.0242 6.0242 6.4735 6.4735 6.5342 6.5342 6.7336 6.7336 6.7367 6.7367 6.7615 6.7615 6.8365 6.8365 6.9716 6.9716 6.9864 6.9864 7.2419 7.2419 7.2880 7.2880 7.4434 7.4434 7.4737 7.4737 7.5626 7.5626 7.5819 7.5819 7.7052 7.7052 7.7161 7.7161 7.9184 7.9184 7.9654 7.9654 8.6877 8.6877 8.7298 8.7298 9.5589 9.5589 9.5656 9.5656 9.8951 9.8951 9.9891 9.9891 k = 0.0000 0.0000 0.3467 ( 12358 PWs) bands (ev): -1.8705 -1.8705 -1.7676 -1.7676 1.4216 1.4216 1.4609 1.4609 1.6217 1.6217 1.6578 1.6578 1.8332 1.8332 1.9001 1.9001 1.9669 1.9669 1.9838 1.9838 2.1157 2.1157 2.2053 2.2053 4.3369 4.3369 4.3476 4.3476 4.5787 4.5787 4.7145 4.7145 4.7666 4.7666 4.7784 4.7784 4.9670 4.9670 5.0415 5.0415 5.1125 5.1125 5.1711 5.1711 5.3128 5.3128 5.3165 5.3165 5.6476 5.6476 5.7078 5.7078 5.8782 5.8782 5.9626 5.9626 6.4892 6.4892 6.5197 6.5197 6.7376 6.7376 6.7385 6.7385 6.7801 6.7801 6.8186 6.8186 6.9771 6.9771 6.9843 6.9843 7.2520 7.2520 7.2750 7.2750 7.4493 7.4493 7.4645 7.4645 7.5660 7.5660 7.5756 7.5756 7.7071 7.7071 7.7125 7.7125 7.9261 7.9261 7.9494 7.9494 8.7009 8.7009 8.7221 8.7221 9.6073 9.6073 9.6264 9.6264 9.8734 9.8734 9.9472 9.9472 k = 0.0000 0.0000 0.3660 ( 12352 PWs) bands (ev): -1.8204 -1.8204 -1.8203 -1.8203 1.4459 1.4459 1.4459 1.4459 1.6431 1.6431 1.6431 1.6431 1.8715 1.8715 1.8715 1.8715 2.0081 2.0081 2.0081 2.0081 2.1094 2.1094 2.1095 2.1095 4.3453 4.3453 4.3453 4.3453 4.6631 4.6631 4.6631 4.6631 4.7709 4.7709 4.7710 4.7710 5.0004 5.0004 5.0004 5.0004 5.1417 5.1417 5.1417 5.1417 5.3109 5.3109 5.3110 5.3110 5.6811 5.6811 5.6812 5.6812 5.9087 5.9087 5.9087 5.9087 6.5046 6.5046 6.5047 6.5047 6.7389 6.7389 6.7390 6.7390 6.7996 6.7996 6.7997 6.7997 6.9812 6.9812 6.9813 6.9813 7.2629 7.2629 7.2631 7.2631 7.4563 7.4563 7.4563 7.4563 7.5703 7.5703 7.5703 7.5703 7.7095 7.7095 7.7095 7.7095 7.9363 7.9363 7.9364 7.9364 8.7124 8.7124 8.7125 8.7125 9.6375 9.6375 9.6376 9.6376 9.8962 9.8962 9.8962 9.8962 k = 0.0000 0.0000 0.3660 ( 12352 PWs) bands (ev): -1.8204 -1.8204 -1.8203 -1.8203 1.4459 1.4459 1.4459 1.4459 1.6431 1.6431 1.6431 1.6431 1.8715 1.8715 1.8715 1.8715 2.0081 2.0081 2.0081 2.0081 2.1094 2.1094 2.1095 2.1095 4.3453 4.3453 4.3453 4.3453 4.6631 4.6631 4.6631 4.6631 4.7709 4.7709 4.7710 4.7710 5.0004 5.0004 5.0004 5.0004 5.1417 5.1417 5.1417 5.1417 5.3109 5.3109 5.3110 5.3110 5.6811 5.6811 5.6812 5.6812 5.9087 5.9087 5.9087 5.9087 6.5046 6.5046 6.5047 6.5047 6.7389 6.7389 6.7390 6.7390 6.7996 6.7996 6.7997 6.7997 6.9812 6.9812 6.9813 6.9813 7.2629 7.2629 7.2631 7.2631 7.4563 7.4563 7.4563 7.4563 7.5703 7.5703 7.5703 7.5703 7.7095 7.7095 7.7095 7.7095 7.9363 7.9363 7.9364 7.9364 8.7124 8.7124 8.7125 8.7125 9.6375 9.6375 9.6376 9.6376 9.8962 9.8962 9.8962 9.8962 k = 0.0000 0.0201 0.3660 ( 12359 PWs) bands (ev): -1.8190 -1.8190 -1.8188 -1.8188 1.3640 1.3640 1.5023 1.5023 1.6075 1.6075 1.6691 1.6691 1.8426 1.8426 1.8764 1.8764 2.0226 2.0226 2.0231 2.0231 2.0779 2.0779 2.1826 2.1826 4.3272 4.3272 4.3367 4.3367 4.6017 4.6017 4.6953 4.6953 4.7652 4.7652 4.7714 4.7714 4.9904 4.9904 5.0089 5.0089 5.1014 5.1014 5.2031 5.2031 5.3058 5.3058 5.3380 5.3380 5.6084 5.6084 5.7595 5.7595 5.9039 5.9039 5.9248 5.9248 6.4847 6.4847 6.5244 6.5244 6.7296 6.7296 6.7450 6.7450 6.7754 6.7754 6.8276 6.8276 6.9786 6.9786 6.9839 6.9839 7.2574 7.2574 7.2684 7.2684 7.4522 7.4522 7.4584 7.4584 7.5521 7.5521 7.5886 7.5886 7.6901 7.6901 7.7298 7.7298 7.9225 7.9225 7.9537 7.9537 8.7140 8.7140 8.7154 8.7154 9.5909 9.5909 9.6648 9.6648 9.8916 9.8916 9.9109 9.9109 k = 0.0000 0.0402 0.3660 ( 12360 PWs) bands (ev): -1.8146 -1.8146 -1.8142 -1.8142 1.2660 1.2660 1.4968 1.4968 1.5933 1.5933 1.6877 1.6877 1.8204 1.8204 1.8515 1.8515 2.0351 2.0351 2.0663 2.0663 2.0999 2.0999 2.2869 2.2869 4.2852 4.2852 4.3037 4.3037 4.5309 4.5309 4.6639 4.6639 4.7351 4.7351 4.8018 4.8018 4.9764 4.9764 5.0222 5.0222 5.0852 5.0852 5.2749 5.2749 5.3244 5.3244 5.3827 5.3827 5.5451 5.5451 5.8398 5.8398 5.9115 5.9115 5.9514 5.9514 6.4646 6.4646 6.5435 6.5435 6.7129 6.7129 6.7500 6.7500 6.7599 6.7599 6.8565 6.8565 6.9760 6.9760 6.9864 6.9864 7.2518 7.2518 7.2736 7.2736 7.4463 7.4463 7.4585 7.4585 7.5346 7.5346 7.6047 7.6047 7.6755 7.6755 7.7484 7.7484 7.9103 7.9103 7.9766 7.9766 8.7201 8.7201 8.7230 8.7230 9.5389 9.5389 9.6595 9.6595 9.9115 9.9115 9.9185 9.9185 k = 0.0000 0.0603 0.3660 ( 12368 PWs) bands (ev): -1.8073 -1.8073 -1.8067 -1.8067 1.1580 1.1580 1.4201 1.4201 1.6169 1.6169 1.7031 1.7031 1.8090 1.8090 1.8316 1.8316 2.0460 2.0460 2.0689 2.0689 2.2031 2.2031 2.4065 2.4065 4.2250 4.2250 4.2514 4.2514 4.4530 4.4530 4.6071 4.6071 4.6706 4.6706 4.8400 4.8400 4.9607 4.9607 5.0410 5.0410 5.0859 5.0859 5.3455 5.3455 5.3643 5.3643 5.4403 5.4403 5.4975 5.4975 5.9152 5.9152 5.9317 5.9317 5.9906 5.9906 6.4443 6.4443 6.5614 6.5614 6.6888 6.6888 6.7522 6.7522 6.7563 6.7563 6.8845 6.8845 6.9743 6.9743 6.9888 6.9888 7.2464 7.2464 7.2783 7.2783 7.4384 7.4384 7.4565 7.4565 7.5182 7.5182 7.6121 7.6121 7.6736 7.6736 7.7636 7.7636 7.8986 7.8986 8.0072 8.0072 8.7307 8.7307 8.7352 8.7352 9.4880 9.4880 9.6294 9.6294 9.9011 9.9011 9.9537 9.9537 k = 0.0000 0.0804 0.3660 ( 12381 PWs) bands (ev): -1.7970 -1.7970 -1.7963 -1.7963 1.0446 1.0446 1.3202 1.3202 1.6432 1.6432 1.7178 1.7178 1.8065 1.8065 1.8232 1.8232 2.0577 2.0577 2.0754 2.0754 2.3234 2.3234 2.5340 2.5340 4.1523 4.1523 4.1855 4.1855 4.3691 4.3691 4.5408 4.5408 4.5891 4.5891 4.8519 4.8519 4.9571 4.9571 5.0582 5.0582 5.0991 5.0991 5.3920 5.3920 5.4194 5.4194 5.4814 5.4814 5.5137 5.5137 5.9618 5.9618 5.9763 5.9763 6.0496 6.0496 6.4241 6.4241 6.5764 6.5764 6.6623 6.6623 6.7529 6.7529 6.7601 6.7601 6.9091 6.9091 6.9749 6.9749 6.9915 6.9915 7.2417 7.2417 7.2824 7.2824 7.4283 7.4283 7.4524 7.4524 7.5034 7.5034 7.6077 7.6077 7.6888 7.6888 7.7753 7.7753 7.8870 7.8870 8.0467 8.0467 8.7454 8.7454 8.7520 8.7520 9.4412 9.4412 9.5894 9.5894 9.8728 9.8728 9.9743 9.9743 k = 0.0000 0.1005 0.3660 ( 12364 PWs) bands (ev): -1.7837 -1.7837 -1.7828 -1.7828 0.9286 0.9286 1.2115 1.2115 1.6681 1.6681 1.7331 1.7331 1.8107 1.8107 1.8236 1.8236 2.0712 2.0712 2.0856 2.0856 2.4535 2.4535 2.6659 2.6659 4.0717 4.0717 4.1105 4.1105 4.2808 4.2808 4.4690 4.4690 4.4990 4.4990 4.8232 4.8232 4.9772 4.9772 5.0712 5.0712 5.1213 5.1213 5.3891 5.3891 5.4846 5.4846 5.5294 5.5294 5.5910 5.5910 6.0017 6.0017 6.0206 6.0206 6.1247 6.1247 6.4041 6.4041 6.5835 6.5835 6.6395 6.6395 6.7582 6.7582 6.7643 6.7643 6.9253 6.9253 6.9802 6.9802 6.9960 6.9960 7.2381 7.2381 7.2859 7.2859 7.4157 7.4157 7.4467 7.4467 7.4909 7.4909 7.5988 7.5988 7.7143 7.7143 7.7843 7.7843 7.8752 7.8752 8.0952 8.0952 8.7639 8.7639 8.7734 8.7734 9.4000 9.4000 9.5476 9.5476 9.8353 9.8353 9.9556 9.9556 k = 0.0000 0.1206 0.3660 ( 12364 PWs) bands (ev): -1.7675 -1.7675 -1.7664 -1.7664 0.8119 0.8119 1.0991 1.0991 1.6925 1.6925 1.7499 1.7499 1.8202 1.8202 1.8303 1.8303 2.0868 2.0868 2.0990 2.0990 2.5899 2.5899 2.8000 2.8000 3.9861 3.9861 4.0297 4.0297 4.1895 4.1895 4.3937 4.3937 4.4046 4.4046 4.7701 4.7701 5.0061 5.0061 5.0829 5.0829 5.1473 5.1473 5.3752 5.3752 5.5562 5.5562 5.5962 5.5962 5.6741 5.6741 6.0467 6.0467 6.0588 6.0588 6.2026 6.2026 6.3851 6.3851 6.5731 6.5731 6.6298 6.6298 6.7670 6.7670 6.7700 6.7700 6.9303 6.9303 6.9864 6.9864 7.0073 7.0073 7.2367 7.2367 7.2885 7.2885 7.4001 7.4001 7.4400 7.4400 7.4813 7.4813 7.5909 7.5909 7.7453 7.7453 7.7927 7.7927 7.8636 7.8636 8.1521 8.1521 8.7854 8.7854 8.7996 8.7996 9.3655 9.3655 9.5073 9.5073 9.7932 9.7932 9.9115 9.9115 k = 0.0000 0.1407 0.3660 ( 12356 PWs) bands (ev): -1.7484 -1.7484 -1.7471 -1.7471 0.6955 0.6955 0.9857 0.9857 1.7175 1.7175 1.7687 1.7687 1.8342 1.8342 1.8418 1.8418 2.1048 2.1048 2.1153 2.1153 2.7308 2.7308 2.9346 2.9346 3.8974 3.8974 3.9456 3.9456 4.0965 4.0965 4.3070 4.3070 4.3179 4.3179 4.7043 4.7043 5.0353 5.0353 5.0955 5.0955 5.1742 5.1742 5.3654 5.3654 5.6307 5.6307 5.6670 5.6670 5.7582 5.7582 6.0911 6.0911 6.0958 6.0958 6.2741 6.2741 6.3711 6.3711 6.5482 6.5482 6.6299 6.6299 6.7708 6.7708 6.7855 6.7855 6.9280 6.9280 6.9888 6.9888 7.0244 7.0244 7.2382 7.2382 7.2905 7.2905 7.3813 7.3813 7.4330 7.4330 7.4747 7.4747 7.5859 7.5859 7.7792 7.7792 7.8036 7.8036 7.8526 7.8526 8.2166 8.2166 8.8089 8.8089 8.8307 8.8307 9.3388 9.3388 9.4704 9.4704 9.7494 9.7494 9.8584 9.8584 k = 0.0000 0.1608 0.3660 ( 12369 PWs) bands (ev): -1.7262 -1.7262 -1.7248 -1.7248 0.5801 0.5801 0.8724 0.8724 1.7437 1.7437 1.7898 1.7898 1.8519 1.8519 1.8573 1.8573 2.1251 2.1251 2.1345 2.1345 2.8748 2.8748 3.0675 3.0675 3.8070 3.8070 3.8601 3.8601 4.0028 4.0028 4.2093 4.2093 4.2418 4.2418 4.6308 4.6308 5.0634 5.0634 5.1097 5.1097 5.2013 5.2013 5.3600 5.3600 5.7056 5.7056 5.7391 5.7391 5.8411 5.8411 6.1233 6.1233 6.1400 6.1400 6.3131 6.3131 6.3859 6.3859 6.5189 6.5189 6.6302 6.6302 6.7731 6.7731 6.8060 6.8060 6.9221 6.9221 6.9893 6.9893 7.0395 7.0395 7.2430 7.2430 7.2922 7.2922 7.3598 7.3598 7.4262 7.4262 7.4710 7.4710 7.5844 7.5844 7.8081 7.8081 7.8259 7.8259 7.8441 7.8441 8.2878 8.2878 8.8328 8.8328 8.8670 8.8670 9.3212 9.3212 9.4377 9.4377 9.7057 9.7057 9.8036 9.8036 k = 0.0000 0.1809 0.3660 ( 12366 PWs) bands (ev): -1.7012 -1.7012 -1.6995 -1.6995 0.4661 0.4661 0.7601 0.7601 1.7715 1.7715 1.8132 1.8132 1.8730 1.8730 1.8763 1.8763 2.1478 2.1478 2.1563 2.1563 3.0209 3.0209 3.1952 3.1952 3.7160 3.7160 3.7751 3.7751 3.9093 3.9093 4.1114 4.1114 4.1696 4.1696 4.5526 4.5526 5.0907 5.0907 5.1256 5.1256 5.2282 5.2282 5.3578 5.3578 5.7791 5.7791 5.8113 5.8113 5.9210 5.9210 6.1492 6.1492 6.1812 6.1812 6.3079 6.3079 6.4399 6.4399 6.4907 6.4907 6.6283 6.6283 6.7743 6.7743 6.8289 6.8289 6.9143 6.9143 6.9887 6.9887 7.0492 7.0492 7.2498 7.2498 7.2951 7.2951 7.3365 7.3365 7.4198 7.4198 7.4700 7.4700 7.5866 7.5866 7.8295 7.8295 7.8329 7.8329 7.8697 7.8697 8.3649 8.3649 8.8551 8.8551 8.9084 8.9084 9.3142 9.3142 9.4099 9.4099 9.6633 9.6633 9.7501 9.7501 k = 0.0000 0.2010 0.3660 ( 12374 PWs) bands (ev): -1.6731 -1.6731 -1.6713 -1.6713 0.3538 0.3538 0.6493 0.6493 1.8012 1.8012 1.8392 1.8392 1.8972 1.8972 1.8987 1.8987 2.1730 2.1730 2.1809 2.1809 3.1679 3.1679 3.3108 3.3108 3.6253 3.6253 3.6938 3.6938 3.8167 3.8167 4.0139 4.0139 4.1058 4.1058 4.4716 4.4716 5.1176 5.1176 5.1432 5.1432 5.2550 5.2550 5.3578 5.3578 5.8495 5.8495 5.8823 5.8823 5.9967 5.9967 6.1678 6.1678 6.2157 6.2157 6.2963 6.2963 6.4587 6.4587 6.5045 6.5045 6.6239 6.6239 6.7739 6.7739 6.8517 6.8517 6.9053 6.9053 6.9872 6.9872 7.0526 7.0526 7.2548 7.2548 7.3011 7.3011 7.3126 7.3126 7.4135 7.4135 7.4715 7.4715 7.5923 7.5923 7.8277 7.8277 7.8565 7.8565 7.9157 7.9157 8.4468 8.4468 8.8736 8.8736 8.9551 8.9551 9.3196 9.3196 9.3877 9.3877 9.6231 9.6231 9.6996 9.6996 k = 0.0000 0.2211 0.3660 ( 12372 PWs) bands (ev): -1.6422 -1.6422 -1.6402 -1.6402 0.2435 0.2435 0.5403 0.5403 1.8330 1.8330 1.8677 1.8677 1.9233 1.9233 1.9254 1.9254 2.2006 2.2006 2.2080 2.2080 3.3123 3.3123 3.3968 3.3968 3.5377 3.5377 3.6249 3.6249 3.7261 3.7261 3.9176 3.9176 4.0597 4.0597 4.3893 4.3893 5.1447 5.1447 5.1627 5.1627 5.2817 5.2817 5.3593 5.3593 5.9152 5.9152 5.9511 5.9511 6.0671 6.0671 6.1755 6.1755 6.2401 6.2401 6.2909 6.2909 6.4395 6.4395 6.5569 6.5569 6.6178 6.6178 6.7714 6.7714 6.8717 6.8717 6.8960 6.8960 6.9848 6.9848 7.0505 7.0505 7.2554 7.2554 7.2874 7.2874 7.3125 7.3125 7.4075 7.4075 7.4748 7.4748 7.6004 7.6004 7.8256 7.8256 7.8917 7.8917 7.9658 7.9658 8.5323 8.5323 8.8860 8.8860 9.0068 9.0068 9.3381 9.3381 9.3722 9.3722 9.5858 9.5858 9.6531 9.6531 k = 0.0000 0.2412 0.3660 ( 12371 PWs) bands (ev): -1.6083 -1.6083 -1.6061 -1.6061 0.1353 0.1353 0.4333 0.4333 1.8669 1.8669 1.8987 1.8987 1.9514 1.9514 1.9558 1.9558 2.2306 2.2306 2.2376 2.2376 3.4076 3.4076 3.4167 3.4167 3.4947 3.4947 3.5898 3.5898 3.6414 3.6414 3.8234 3.8234 4.0476 4.0476 4.3068 4.3068 5.1720 5.1720 5.1839 5.1839 5.3082 5.3082 5.3615 5.3615 5.9743 5.9743 6.0162 6.0162 6.1301 6.1301 6.1710 6.1710 6.2519 6.2519 6.2956 6.2956 6.4296 6.4296 6.5969 6.5969 6.6168 6.6168 6.7663 6.7663 6.8863 6.8863 6.8875 6.8875 6.9817 6.9817 7.0441 7.0441 7.2507 7.2507 7.2663 7.2663 7.3244 7.3244 7.4019 7.4019 7.4791 7.4791 7.6093 7.6093 7.8268 7.8268 7.9356 7.9356 8.0190 8.0190 8.6191 8.6191 8.8914 8.8914 9.0634 9.0634 9.3548 9.3548 9.3795 9.3795 9.5526 9.5526 9.6118 9.6118 k = 0.0000 0.2613 0.3660 ( 12369 PWs) bands (ev): -1.5715 -1.5715 -1.5691 -1.5691 0.0294 0.0294 0.3285 0.3285 1.9030 1.9030 1.9321 1.9321 1.9822 1.9822 1.9892 1.9892 2.2628 2.2628 2.2697 2.2697 3.3410 3.3410 3.3666 3.3666 3.5277 3.5277 3.5751 3.5751 3.6389 3.6389 3.7382 3.7382 4.0831 4.0831 4.2270 4.2270 5.1998 5.1998 5.2068 5.2068 5.3346 5.3346 5.3638 5.3638 6.0241 6.0241 6.0765 6.0765 6.1566 6.1566 6.1811 6.1811 6.2564 6.2564 6.3091 6.3091 6.4319 6.4319 6.5942 6.5942 6.6503 6.6503 6.7579 6.7579 6.8793 6.8793 6.8955 6.8955 6.9780 6.9780 7.0342 7.0342 7.2363 7.2363 7.2547 7.2547 7.3359 7.3359 7.3973 7.3973 7.4837 7.4837 7.6176 7.6176 7.8304 7.8304 7.9869 7.9869 8.0747 8.0747 8.7026 8.7026 8.8920 8.8920 9.1236 9.1236 9.3544 9.3544 9.4239 9.4239 9.5254 9.5254 9.5773 9.5773 k = 0.0000 0.2814 0.3660 ( 12362 PWs) bands (ev): -1.5317 -1.5317 -1.5292 -1.5292 -0.0741 -0.0741 0.2260 0.2260 1.9413 1.9413 1.9678 1.9678 2.0157 2.0157 2.0256 2.0256 2.2973 2.2973 2.3042 2.3042 3.2547 3.2547 3.2928 3.2928 3.4515 3.4515 3.5407 3.5407 3.6257 3.6257 3.7974 3.7974 4.1172 4.1172 4.1945 4.1945 5.2277 5.2277 5.2316 5.2316 5.3605 5.3605 5.3661 5.3661 6.0589 6.0589 6.1300 6.1300 6.1452 6.1452 6.1934 6.1934 6.2804 6.2804 6.3283 6.3283 6.4428 6.4428 6.5830 6.5830 6.6841 6.6841 6.7463 6.7463 6.8734 6.8734 6.8971 6.8971 6.9735 6.9735 7.0214 7.0214 7.2181 7.2181 7.2486 7.2486 7.3463 7.3463 7.3940 7.3940 7.4880 7.4880 7.6244 7.6244 7.8343 7.8343 8.0430 8.0430 8.1321 8.1321 8.7684 8.7684 8.8996 8.8996 9.1847 9.1847 9.3607 9.3607 9.4718 9.4718 9.5158 9.5158 9.5526 9.5526 k = 0.0000 0.3015 0.3660 ( 12354 PWs) bands (ev): -1.4891 -1.4891 -1.4863 -1.4863 -0.1752 -0.1752 0.1258 0.1258 1.9815 1.9815 2.0058 2.0058 2.0518 2.0518 2.0650 2.0650 2.3338 2.3338 2.3408 2.3408 3.1678 3.1678 3.2135 3.2135 3.3697 3.3697 3.4872 3.4872 3.5390 3.5390 3.9412 3.9412 4.0489 4.0489 4.2920 4.2920 5.2546 5.2546 5.2588 5.2588 5.3670 5.3670 5.3868 5.3868 6.0692 6.0692 6.1424 6.1424 6.1734 6.1734 6.1801 6.1801 6.3237 6.3237 6.3517 6.3517 6.4564 6.4564 6.5716 6.5716 6.7103 6.7103 6.7329 6.7329 6.8696 6.8696 6.8921 6.8921 6.9677 6.9677 7.0066 7.0066 7.2022 7.2022 7.2432 7.2432 7.3554 7.3554 7.3924 7.3924 7.4918 7.4918 7.6296 7.6296 7.8353 7.8353 8.1003 8.1003 8.1905 8.1905 8.7867 8.7867 8.9412 8.9412 9.2384 9.2384 9.3812 9.3812 9.4795 9.4795 9.5362 9.5362 9.5717 9.5717 k = 0.0000 0.3216 0.3660 ( 12363 PWs) bands (ev): -1.4435 -1.4435 -1.4406 -1.4406 -0.2738 -0.2738 0.0281 0.0281 2.0237 2.0237 2.0460 2.0460 2.0905 2.0905 2.1073 2.1073 2.3722 2.3722 2.3795 2.3795 3.0818 3.0818 3.1334 3.1334 3.2898 3.2898 3.4237 3.4237 3.4512 3.4512 3.9698 3.9698 4.0883 4.0883 4.4141 4.4141 5.2809 5.2809 5.2871 5.2871 5.3676 5.3676 5.4124 5.4124 6.0577 6.0577 6.1448 6.1448 6.1539 6.1539 6.2166 6.2166 6.3664 6.3664 6.3799 6.3799 6.4672 6.4672 6.5639 6.5639 6.7106 6.7106 6.7362 6.7362 6.8675 6.8675 6.8819 6.8819 6.9599 6.9599 6.9908 6.9908 7.1897 7.1897 7.2377 7.2377 7.3635 7.3635 7.3925 7.3925 7.4951 7.4951 7.6337 7.6337 7.8308 7.8308 8.1545 8.1545 8.2488 8.2488 8.7647 8.7647 9.0054 9.0054 9.2708 9.2708 9.4260 9.4260 9.4845 9.4845 9.5430 9.5430 9.6484 9.6484 k = 0.0000 0.3417 0.3660 ( 12372 PWs) bands (ev): -1.3951 -1.3951 -1.3919 -1.3919 -0.3699 -0.3699 -0.0671 -0.0671 2.0675 2.0675 2.0880 2.0880 2.1317 2.1317 2.1526 2.1526 2.4121 2.4121 2.4200 2.4200 2.9972 2.9972 3.0542 3.0542 3.2133 3.2133 3.3562 3.3562 3.3649 3.3649 3.8906 3.8906 4.2339 4.2339 4.5423 4.5423 5.3065 5.3065 5.3136 5.3136 5.3688 5.3688 5.4379 5.4379 6.0389 6.0389 6.1173 6.1173 6.1565 6.1565 6.2446 6.2446 6.3993 6.3993 6.4144 6.4144 6.4721 6.4721 6.5652 6.5652 6.6930 6.6930 6.7492 6.7492 6.8616 6.8616 6.8732 6.8732 6.9491 6.9491 6.9758 6.9758 7.1806 7.1806 7.2320 7.2320 7.3710 7.3710 7.3943 7.3943 7.4984 7.4984 7.6372 7.6372 7.8198 7.8198 8.2003 8.2003 8.3056 8.3056 8.7266 8.7266 9.0650 9.0650 9.2786 9.2786 9.4942 9.4942 9.5089 9.5089 9.5701 9.5701 9.7348 9.7348 k = 0.0000 0.3618 0.3660 ( 12382 PWs) bands (ev): -1.3438 -1.3438 -1.3404 -1.3404 -0.4633 -0.4633 -0.1598 -0.1598 2.1126 2.1126 2.1318 2.1318 2.1754 2.1754 2.2007 2.2007 2.4530 2.4530 2.4618 2.4618 2.9144 2.9144 2.9770 2.9770 3.1411 3.1411 3.2805 3.2805 3.2879 3.2879 3.8127 3.8127 4.3765 4.3765 4.6708 4.6708 5.3282 5.3282 5.3330 5.3330 5.3771 5.3771 5.4642 5.4642 6.0201 6.0201 6.0879 6.0879 6.1519 6.1519 6.2602 6.2602 6.4259 6.4259 6.4378 6.4378 6.4820 6.4820 6.5766 6.5766 6.6747 6.6747 6.7563 6.7563 6.8445 6.8445 6.8742 6.8742 6.9353 6.9353 6.9628 6.9628 7.1746 7.1746 7.2260 7.2260 7.3780 7.3780 7.3975 7.3975 7.5018 7.5018 7.6400 7.6400 7.8035 7.8035 8.2315 8.2315 8.3594 8.3594 8.6837 8.6837 9.1098 9.1098 9.2717 9.2717 9.5539 9.5539 9.5785 9.5785 9.6189 9.6189 9.8269 9.8269 k = 0.0000 0.3819 0.3660 ( 12378 PWs) bands (ev): -1.2896 -1.2896 -1.2860 -1.2860 -0.5540 -0.5540 -0.2498 -0.2498 2.1582 2.1582 2.1769 2.1769 2.2215 2.2215 2.2518 2.2518 2.4940 2.4940 2.5043 2.5043 2.8335 2.8335 2.9026 2.9026 3.0746 3.0746 3.1985 3.1985 3.2211 3.2211 3.7363 3.7363 4.5143 4.5143 4.7958 4.7958 5.3302 5.3302 5.3519 5.3519 5.3993 5.3993 5.4924 5.4924 6.0040 6.0040 6.0594 6.0594 6.1375 6.1375 6.2603 6.2603 6.4367 6.4367 6.4514 6.4514 6.5096 6.5096 6.5942 6.5942 6.6585 6.6585 6.7572 6.7572 6.8238 6.8238 6.8768 6.8768 6.9212 6.9212 6.9515 6.9515 7.1713 7.1713 7.2195 7.2195 7.3848 7.3848 7.4016 7.4016 7.5059 7.5059 7.6413 7.6413 7.7856 7.7856 8.2413 8.2413 8.4090 8.4090 8.6455 8.6455 9.1390 9.1390 9.2577 9.2577 9.6221 9.6221 9.6636 9.6636 9.6897 9.6897 9.9236 9.9236 k = 0.0000 0.4020 0.3660 ( 12384 PWs) bands (ev): -1.2327 -1.2327 -1.2288 -1.2288 -0.6419 -0.6419 -0.3371 -0.3371 2.2033 2.2033 2.2229 2.2229 2.2701 2.2701 2.3057 2.3057 2.5334 2.5334 2.5464 2.5464 2.7550 2.7550 2.8325 2.8325 3.0160 3.0160 3.1187 3.1187 3.1576 3.1576 3.6619 3.6619 4.6456 4.6456 4.9130 4.9130 5.3205 5.3205 5.3661 5.3661 5.4292 5.4292 5.5244 5.5244 5.9926 5.9926 6.0322 6.0322 6.1130 6.1130 6.2441 6.2441 6.4364 6.4364 6.4681 6.4681 6.5401 6.5401 6.6142 6.6142 6.6473 6.6473 6.7528 6.7528 6.8024 6.8024 6.8755 6.8755 6.9118 6.9118 6.9412 6.9412 7.1702 7.1702 7.2126 7.2126 7.3913 7.3913 7.4062 7.4062 7.5111 7.5111 7.6382 7.6382 7.7721 7.7721 8.2250 8.2250 8.4531 8.4531 8.6193 8.6193 9.1568 9.1568 9.2407 9.2407 9.7034 9.7034 9.7479 9.7479 9.7791 9.7791 10.0241 10.0241 k = 0.0000 0.4221 0.3660 ( 12372 PWs) bands (ev): -1.1731 -1.1731 -1.1687 -1.1687 -0.7270 -0.7270 -0.4218 -0.4218 2.2461 2.2461 2.2686 2.2686 2.3209 2.3209 2.3624 2.3624 2.5676 2.5676 2.5859 2.5859 2.6794 2.6794 2.7695 2.7695 2.9683 2.9683 3.0415 3.0415 3.1000 3.1000 3.5895 3.5895 4.7683 4.7683 5.0164 5.0164 5.3066 5.3066 5.3724 5.3724 5.4622 5.4622 5.5612 5.5612 5.9869 5.9869 6.0065 6.0065 6.0790 6.0790 6.2155 6.2155 6.4399 6.4399 6.4772 6.4772 6.5671 6.5671 6.6326 6.6326 6.6449 6.6449 6.7442 6.7442 6.7828 6.7828 6.8657 6.8657 6.9114 6.9114 6.9314 6.9314 7.1710 7.1710 7.2052 7.2052 7.3974 7.3974 7.4108 7.4108 7.5180 7.5180 7.6279 7.6279 7.7700 7.7700 8.1845 8.1845 8.4910 8.4910 8.6063 8.6063 9.1679 9.1679 9.2227 9.2227 9.7880 9.7880 9.8362 9.8362 9.8749 9.8749 10.1282 10.1282 k = 0.0000 0.4422 0.3660 ( 12360 PWs) bands (ev): -1.1112 -1.1112 -1.1059 -1.1059 -0.8088 -0.8088 -0.5036 -0.5036 2.2836 2.2836 2.3121 2.3121 2.3738 2.3738 2.4216 2.4216 2.5882 2.5882 2.5987 2.5987 2.6294 2.6294 2.7212 2.7212 2.9359 2.9359 2.9678 2.9678 3.0517 3.0517 3.5195 3.5195 4.8801 4.8801 5.0949 5.0949 5.2948 5.2948 5.3699 5.3699 5.4980 5.4980 5.6025 5.6025 5.9820 5.9820 5.9879 5.9879 6.0376 6.0376 6.1816 6.1816 6.4466 6.4466 6.4774 6.4774 6.5886 6.5886 6.6428 6.6428 6.6562 6.6562 6.7325 6.7325 6.7683 6.7683 6.8506 6.8506 6.9167 6.9167 6.9221 6.9221 7.1733 7.1733 7.1974 7.1974 7.4030 7.4030 7.4151 7.4151 7.5271 7.5271 7.6103 7.6103 7.7820 7.7820 8.1282 8.1282 8.5226 8.5226 8.6012 8.6012 9.1754 9.1754 9.2047 9.2047 9.8645 9.8645 9.9275 9.9275 9.9696 9.9696 10.2352 10.2352 k = 0.0000 0.4623 0.3660 ( 12358 PWs) bands (ev): -1.0481 -1.0481 -1.0404 -1.0404 -0.8863 -0.8863 -0.5826 -0.5826 2.3113 2.3113 2.3485 2.3485 2.4270 2.4270 2.4822 2.4822 2.5348 2.5348 2.5844 2.5844 2.6550 2.6550 2.6987 2.6987 2.8922 2.8922 2.9300 2.9300 3.0184 3.0184 3.4520 3.4520 4.9791 4.9791 5.1298 5.1298 5.2969 5.2969 5.3588 5.3588 5.5365 5.5365 5.6448 5.6448 5.9615 5.9615 5.9869 5.9869 6.0002 6.0002 6.1496 6.1496 6.4546 6.4546 6.4705 6.4705 6.6022 6.6022 6.6528 6.6528 6.6690 6.6690 6.7190 6.7190 6.7634 6.7634 6.8331 6.8331 6.9129 6.9129 6.9242 6.9242 7.1767 7.1767 7.1894 7.1894 7.4079 7.4079 7.4185 7.4185 7.5390 7.5390 7.5893 7.5893 7.8066 7.8066 8.0649 8.0649 8.5480 8.5480 8.5982 8.5982 9.1810 9.1810 9.1875 9.1875 9.9191 9.9191 10.0162 10.0162 10.0577 10.0577 10.3433 10.3433 k = 0.0000 0.4824 0.3660 ( 12360 PWs) bands (ev): -1.0011 -1.0011 -0.9725 -0.9725 -0.9419 -0.9419 -0.6584 -0.6584 2.3230 2.3230 2.3674 2.3674 2.4499 2.4499 2.5034 2.5034 2.5361 2.5361 2.5773 2.5773 2.6813 2.6813 2.6933 2.6933 2.8249 2.8249 2.9432 2.9432 3.0062 3.0062 3.3877 3.3877 5.0632 5.0632 5.1146 5.1146 5.3124 5.3124 5.3401 5.3401 5.5761 5.5761 5.6780 5.6780 5.9480 5.9480 5.9529 5.9529 6.0096 6.0096 6.1248 6.1248 6.4585 6.4585 6.4631 6.4631 6.6046 6.6046 6.6623 6.6623 6.6803 6.6803 6.7073 6.7073 6.7694 6.7694 6.8144 6.8144 6.9043 6.9043 6.9322 6.9322 7.1794 7.1794 7.1829 7.1829 7.4118 7.4118 7.4209 7.4209 7.5542 7.5542 7.5683 7.5683 7.8415 7.8415 8.0012 8.0012 8.5675 8.5675 8.5931 8.5931 9.1710 9.1710 9.1860 9.1860 9.9380 9.9380 10.0919 10.0919 10.1337 10.1337 10.4400 10.4400 k = 0.0000 0.4824 0.3660 ( 12360 PWs) bands (ev): -1.0011 -1.0011 -0.9725 -0.9725 -0.9419 -0.9419 -0.6584 -0.6584 2.3230 2.3230 2.3674 2.3674 2.4499 2.4499 2.5034 2.5034 2.5361 2.5361 2.5773 2.5773 2.6813 2.6813 2.6933 2.6933 2.8249 2.8249 2.9432 2.9432 3.0062 3.0062 3.3877 3.3877 5.0632 5.0632 5.1146 5.1146 5.3124 5.3124 5.3401 5.3401 5.5761 5.5761 5.6780 5.6780 5.9480 5.9480 5.9529 5.9529 6.0096 6.0096 6.1248 6.1248 6.4585 6.4585 6.4631 6.4631 6.6046 6.6046 6.6623 6.6623 6.6803 6.6803 6.7073 6.7073 6.7694 6.7694 6.8144 6.8144 6.9043 6.9043 6.9322 6.9322 7.1794 7.1794 7.1829 7.1829 7.4118 7.4118 7.4209 7.4209 7.5542 7.5542 7.5683 7.5683 7.8415 7.8415 8.0012 8.0012 8.5675 8.5675 8.5931 8.5931 9.1710 9.1710 9.1860 9.1860 9.9380 9.9380 10.0919 10.0919 10.1337 10.1337 10.4400 10.4400 k = 0.0000 0.4924 0.3511 ( 12362 PWs) bands (ev): -0.9830 -0.9830 -0.9767 -0.9767 -0.8887 -0.8887 -0.7389 -0.7389 2.3559 2.3559 2.3732 2.3732 2.4759 2.4759 2.5301 2.5301 2.5490 2.5490 2.5676 2.5676 2.6575 2.6575 2.7201 2.7201 2.8116 2.8116 2.9378 2.9378 3.0271 3.0271 3.2576 3.2576 5.0890 5.0890 5.1173 5.1173 5.3306 5.3306 5.3450 5.3450 5.6173 5.6173 5.6768 5.6768 5.9537 5.9537 5.9556 5.9556 6.0211 6.0211 6.0858 6.0858 6.4542 6.4542 6.4562 6.4562 6.6127 6.6127 6.6421 6.6421 6.6842 6.6842 6.6986 6.6986 6.7773 6.7773 6.8001 6.8001 6.9100 6.9100 6.9238 6.9238 7.1798 7.1798 7.1815 7.1815 7.4163 7.4163 7.4211 7.4211 7.5572 7.5572 7.5644 7.5644 7.8747 7.8747 7.9552 7.9552 8.5716 8.5716 8.5843 8.5843 9.1658 9.1658 9.1733 9.1733 9.9864 9.9864 10.0640 10.0640 10.2298 10.2298 10.4080 10.4080 k = 0.0000 0.5024 0.3362 ( 12360 PWs) bands (ev): -0.9795 -0.9795 -0.9795 -0.9795 -0.8164 -0.8164 -0.8164 -0.8164 2.3704 2.3704 2.3704 2.3704 2.5155 2.5155 2.5155 2.5155 2.5539 2.5539 2.5539 2.5539 2.6812 2.6812 2.6813 2.6813 2.8703 2.8703 2.8703 2.8703 3.1352 3.1352 3.1352 3.1352 5.1077 5.1077 5.1078 5.1078 5.3418 5.3418 5.3419 5.3419 5.6531 5.6531 5.6532 5.6532 5.9568 5.9568 5.9568 5.9568 6.0488 6.0488 6.0489 6.0489 6.4530 6.4530 6.4531 6.4531 6.6252 6.6252 6.6252 6.6252 6.6907 6.6907 6.6908 6.6908 6.7876 6.7876 6.7877 6.7877 6.9165 6.9165 6.9165 6.9165 7.1804 7.1804 7.1805 7.1805 7.4193 7.4193 7.4195 7.4195 7.5606 7.5606 7.5606 7.5606 7.9127 7.9127 7.9128 7.9128 8.5772 8.5772 8.5772 8.5772 9.1665 9.1665 9.1666 9.1666 10.0285 10.0285 10.0286 10.0286 10.3238 10.3238 10.3238 10.3238 k = 0.0000 0.5024 0.3362 ( 12360 PWs) bands (ev): -0.9795 -0.9795 -0.9795 -0.9795 -0.8164 -0.8164 -0.8164 -0.8164 2.3704 2.3704 2.3704 2.3704 2.5155 2.5155 2.5155 2.5155 2.5539 2.5539 2.5539 2.5539 2.6812 2.6812 2.6813 2.6813 2.8703 2.8703 2.8703 2.8703 3.1352 3.1352 3.1352 3.1352 5.1077 5.1077 5.1078 5.1078 5.3418 5.3418 5.3419 5.3419 5.6531 5.6531 5.6532 5.6532 5.9568 5.9568 5.9568 5.9568 6.0488 6.0488 6.0489 6.0489 6.4530 6.4530 6.4531 6.4531 6.6252 6.6252 6.6252 6.6252 6.6907 6.6907 6.6908 6.6908 6.7876 6.7876 6.7877 6.7877 6.9165 6.9165 6.9165 6.9165 7.1804 7.1804 7.1805 7.1805 7.4193 7.4193 7.4195 7.4195 7.5606 7.5606 7.5606 7.5606 7.9127 7.9127 7.9128 7.9128 8.5772 8.5772 8.5772 8.5772 9.1665 9.1665 9.1666 9.1666 10.0285 10.0285 10.0286 10.0286 10.3238 10.3238 10.3238 10.3238 k = 0.0200 0.5024 0.3362 ( 12364 PWs) bands (ev): -0.9780 -0.9780 -0.9780 -0.9780 -0.8150 -0.8150 -0.8150 -0.8150 2.3215 2.3215 2.3216 2.3216 2.4550 2.4550 2.4559 2.4559 2.5812 2.5812 2.5826 2.5826 2.7375 2.7375 2.7376 2.7376 2.8938 2.8938 2.8939 2.8939 3.1421 3.1421 3.1423 3.1423 5.1053 5.1053 5.1056 5.1056 5.3316 5.3316 5.3322 5.3322 5.6519 5.6519 5.6522 5.6522 5.9534 5.9534 5.9550 5.9550 6.0525 6.0525 6.0543 6.0543 6.4544 6.4544 6.4571 6.4571 6.6269 6.6269 6.6270 6.6270 6.6912 6.6912 6.6925 6.6925 6.7885 6.7885 6.7900 6.7900 6.9170 6.9170 6.9177 6.9177 7.1811 7.1811 7.1826 7.1826 7.4189 7.4189 7.4191 7.4191 7.5589 7.5589 7.5606 7.5606 7.9122 7.9122 7.9123 7.9123 8.5794 8.5794 8.5796 8.5796 9.1703 9.1703 9.1709 9.1709 10.0192 10.0192 10.0218 10.0218 10.3270 10.3270 10.3286 10.3286 k = 0.0400 0.5024 0.3362 ( 12372 PWs) bands (ev): -0.9737 -0.9737 -0.9737 -0.9737 -0.8108 -0.8108 -0.8107 -0.8107 2.2221 2.2221 2.2222 2.2222 2.3527 2.3527 2.3533 2.3533 2.6141 2.6141 2.6150 2.6150 2.8418 2.8418 2.8421 2.8421 2.9517 2.9517 2.9518 2.9518 3.1665 3.1665 3.1669 3.1669 5.0982 5.0982 5.0988 5.0988 5.3029 5.3029 5.3039 5.3039 5.6491 5.6491 5.6497 5.6497 5.9419 5.9419 5.9449 5.9449 6.0673 6.0673 6.0708 6.0708 6.4604 6.4604 6.4655 6.4655 6.6316 6.6316 6.6322 6.6322 6.6939 6.6939 6.6964 6.6964 6.7927 6.7927 6.7956 6.7956 6.9193 6.9193 6.9205 6.9205 7.1846 7.1846 7.1875 7.1875 7.4177 7.4177 7.4179 7.4179 7.5556 7.5556 7.5589 7.5589 7.9105 7.9105 7.9108 7.9108 8.5863 8.5863 8.5866 8.5866 9.1822 9.1822 9.1833 9.1833 9.9955 9.9955 10.0004 10.0004 10.3371 10.3371 10.3401 10.3401 k = 0.0600 0.5024 0.3362 ( 12372 PWs) bands (ev): -0.9665 -0.9665 -0.9665 -0.9665 -0.8037 -0.8037 -0.8037 -0.8037 2.1086 2.1086 2.1088 2.1088 2.2412 2.2412 2.2415 2.2415 2.6367 2.6367 2.6373 2.6373 2.9515 2.9515 2.9527 2.9527 3.0211 3.0211 3.0220 3.0220 3.2182 3.2182 3.2187 3.2187 5.0857 5.0857 5.0866 5.0866 5.2593 5.2593 5.2606 5.2606 5.6464 5.6464 5.6471 5.6471 5.9209 5.9209 5.9249 5.9249 6.0934 6.0934 6.0981 6.0981 6.4686 6.4686 6.4759 6.4759 6.6384 6.6384 6.6396 6.6396 6.6995 6.6995 6.7031 6.7031 6.8003 6.8003 6.8040 6.8040 6.9234 6.9234 6.9252 6.9252 7.1908 7.1908 7.1953 7.1953 7.4155 7.4155 7.4160 7.4160 7.5506 7.5506 7.5556 7.5556 7.9080 7.9080 7.9082 7.9082 8.5977 8.5977 8.5983 8.5983 9.2022 9.2022 9.2038 9.2038 9.9613 9.9613 9.9678 9.9678 10.3505 10.3505 10.3549 10.3549 k = 0.0800 0.5024 0.3362 ( 12382 PWs) bands (ev): -0.9564 -0.9564 -0.9564 -0.9564 -0.7938 -0.7938 -0.7938 -0.7938 1.9912 1.9912 1.9913 1.9913 2.1267 2.1267 2.1270 2.1270 2.6542 2.6542 2.6547 2.6547 3.0257 3.0257 3.0272 3.0272 3.1177 3.1177 3.1188 3.1188 3.3021 3.3021 3.3027 3.3027 5.0665 5.0665 5.0677 5.0677 5.2059 5.2059 5.2073 5.2073 5.6445 5.6445 5.6452 5.6452 5.8941 5.8941 5.8986 5.8986 6.1256 6.1256 6.1313 6.1313 6.4769 6.4769 6.4862 6.4862 6.6454 6.6454 6.6477 6.6477 6.7083 6.7083 6.7130 6.7130 6.8111 6.8111 6.8151 6.8151 6.9294 6.9294 6.9318 6.9318 7.1999 7.1999 7.2061 7.2061 7.4124 7.4124 7.4134 7.4134 7.5441 7.5441 7.5509 7.5509 7.9046 7.9046 7.9047 7.9047 8.6137 8.6137 8.6147 8.6147 9.2302 9.2302 9.2323 9.2323 9.9202 9.9202 9.9278 9.9278 10.3306 10.3306 10.3341 10.3341 k = 0.1000 0.5024 0.3362 ( 12378 PWs) bands (ev): -0.9435 -0.9435 -0.9435 -0.9435 -0.7811 -0.7811 -0.7811 -0.7811 1.8729 1.8729 1.8731 1.8731 2.0116 2.0116 2.0119 2.0119 2.6707 2.6707 2.6711 2.6711 3.0620 3.0620 3.0631 3.0631 3.2434 3.2434 3.2441 3.2441 3.4086 3.4086 3.4092 3.4092 5.0382 5.0382 5.0394 5.0394 5.1484 5.1484 5.1496 5.1496 5.6434 5.6434 5.6441 5.6441 5.8658 5.8658 5.8707 5.8707 6.1588 6.1588 6.1653 6.1653 6.4842 6.4842 6.4952 6.4952 6.6513 6.6513 6.6549 6.6549 6.7201 6.7201 6.7258 6.7258 6.8250 6.8250 6.8283 6.8283 6.9377 6.9377 6.9406 6.9406 7.2118 7.2118 7.2198 7.2198 7.4083 7.4083 7.4101 7.4101 7.5360 7.5360 7.5447 7.5447 7.9004 7.9004 7.9005 7.9005 8.6341 8.6341 8.6356 8.6356 9.2663 9.2663 9.2689 9.2689 9.8748 9.8748 9.8835 9.8835 10.2727 10.2727 10.2783 10.2783 k = 0.1200 0.5024 0.3362 ( 12388 PWs) bands (ev): -0.9277 -0.9277 -0.9276 -0.9276 -0.7656 -0.7656 -0.7656 -0.7656 1.7553 1.7553 1.7554 1.7554 1.8970 1.8970 1.8973 1.8973 2.6880 2.6880 2.6883 2.6883 3.0874 3.0874 3.0882 3.0882 3.3766 3.3766 3.3772 3.3772 3.5267 3.5267 3.5272 3.5272 4.9971 4.9971 4.9979 4.9979 5.0934 5.0934 5.0940 5.0940 5.6429 5.6429 5.6434 5.6434 5.8398 5.8398 5.8448 5.8448 6.1895 6.1895 6.1966 6.1966 6.4905 6.4905 6.5030 6.5030 6.6556 6.6556 6.6607 6.6607 6.7335 6.7335 6.7404 6.7404 6.8411 6.8411 6.8428 6.8428 6.9482 6.9482 6.9517 6.9517 7.2263 7.2263 7.2360 7.2360 7.4032 7.4032 7.4062 7.4062 7.5267 7.5267 7.5374 7.5374 7.8954 7.8954 7.8958 7.8958 8.6587 8.6587 8.6608 8.6608 9.3103 9.3103 9.3133 9.3133 9.8275 9.8275 9.8369 9.8369 10.2171 10.2171 10.2234 10.2234 k = 0.1400 0.5024 0.3362 ( 12386 PWs) bands (ev): -0.9090 -0.9090 -0.9089 -0.9089 -0.7473 -0.7473 -0.7472 -0.7472 1.6390 1.6390 1.6391 1.6391 1.7835 1.7835 1.7838 1.7838 2.7068 2.7068 2.7071 2.7071 3.1101 3.1101 3.1107 3.1107 3.5124 3.5124 3.5128 3.5128 3.6500 3.6500 3.6505 3.6505 4.9420 4.9420 4.9422 4.9422 5.0440 5.0440 5.0442 5.0442 5.6426 5.6426 5.6428 5.6428 5.8186 5.8186 5.8236 5.8236 6.2156 6.2156 6.2231 6.2231 6.4959 6.4959 6.5095 6.5095 6.6585 6.6585 6.6650 6.6650 6.7471 6.7471 6.7553 6.7553 6.8578 6.8578 6.8585 6.8585 6.9611 6.9611 6.9656 6.9656 7.2428 7.2428 7.2542 7.2542 7.3970 7.3970 7.4016 7.4016 7.5165 7.5165 7.5293 7.5293 7.8899 7.8899 7.8907 7.8907 8.6873 8.6873 8.6900 8.6900 9.3620 9.3620 9.3655 9.3655 9.7796 9.7796 9.7898 9.7898 10.1655 10.1655 10.1721 10.1721 k = 0.1600 0.5024 0.3362 ( 12388 PWs) bands (ev): -0.8874 -0.8874 -0.8874 -0.8874 -0.7262 -0.7262 -0.7261 -0.7261 1.5244 1.5244 1.5245 1.5245 1.6716 1.6716 1.6718 1.6718 2.7277 2.7277 2.7280 2.7280 3.1327 3.1327 3.1332 3.1332 3.6488 3.6488 3.6492 3.6492 3.7751 3.7751 3.7756 3.7756 4.8772 4.8772 4.8775 4.8775 4.9975 4.9975 4.9984 4.9984 5.6423 5.6423 5.6424 5.6424 5.8036 5.8036 5.8085 5.8085 6.2361 6.2361 6.2439 6.2439 6.5006 6.5006 6.5151 6.5151 6.6603 6.6603 6.6680 6.6680 6.7597 6.7597 6.7694 6.7694 6.8722 6.8722 6.8762 6.8762 6.9764 6.9764 6.9820 6.9820 7.2606 7.2606 7.2734 7.2734 7.3897 7.3897 7.3964 7.3964 7.5059 7.5059 7.5208 7.5208 7.8839 7.8839 7.8853 7.8853 8.7190 8.7190 8.7226 8.7226 9.4209 9.4209 9.4249 9.4249 9.7323 9.7323 9.7435 9.7435 10.1189 10.1189 10.1257 10.1257 k = 0.1800 0.5024 0.3362 ( 12372 PWs) bands (ev): -0.8630 -0.8630 -0.8630 -0.8630 -0.7023 -0.7023 -0.7023 -0.7023 1.4118 1.4118 1.4119 1.4119 1.5615 1.5615 1.5617 1.5617 2.7508 2.7508 2.7511 2.7511 3.1564 3.1564 3.1569 3.1569 3.7842 3.7842 3.7846 3.7846 3.8992 3.8992 3.8998 3.8998 4.8098 4.8098 4.8104 4.8104 4.9510 4.9510 4.9524 4.9524 5.6421 5.6421 5.6427 5.6427 5.7951 5.7951 5.7999 5.7999 6.2510 6.2510 6.2589 6.2589 6.5046 6.5046 6.5197 6.5197 6.6612 6.6612 6.6699 6.6699 6.7708 6.7708 6.7818 6.7818 6.8852 6.8852 6.8930 6.8930 6.9939 6.9939 7.0008 7.0008 7.2786 7.2786 7.2922 7.2922 7.3815 7.3815 7.3907 7.3907 7.4960 7.4960 7.5126 7.5126 7.8776 7.8776 7.8797 7.8797 8.7533 8.7533 8.7578 8.7578 9.4860 9.4860 9.4907 9.4907 9.6869 9.6869 9.6991 9.6991 10.0782 10.0782 10.0851 10.0851 k = 0.2000 0.5024 0.3362 ( 12386 PWs) bands (ev): -0.8358 -0.8358 -0.8357 -0.8357 -0.6757 -0.6757 -0.6756 -0.6756 1.3012 1.3012 1.3013 1.3013 1.4533 1.4533 1.4536 1.4536 2.7763 2.7763 2.7765 2.7765 3.1817 3.1817 3.1821 3.1821 3.9163 3.9163 3.9167 3.9167 4.0193 4.0193 4.0200 4.0200 4.7459 4.7459 4.7469 4.7469 4.9037 4.9037 4.9054 4.9054 5.6429 5.6429 5.6439 5.6439 5.7926 5.7926 5.7971 5.7971 6.2607 6.2607 6.2686 6.2686 6.5077 6.5077 6.5230 6.5230 6.6610 6.6610 6.6706 6.6706 6.7802 6.7802 6.7924 6.7924 6.8963 6.8963 6.9079 6.9079 7.0133 7.0133 7.0210 7.0210 7.2951 7.2951 7.3088 7.3088 7.3724 7.3724 7.3844 7.3844 7.4880 7.4880 7.5058 7.5058 7.8710 7.8710 7.8740 7.8740 8.7888 8.7888 8.7943 8.7943 9.5536 9.5536 9.5599 9.5599 9.6458 9.6458 9.6600 9.6600 10.0444 10.0444 10.0514 10.0514 k = 0.2200 0.5024 0.3362 ( 12384 PWs) bands (ev): -0.8057 -0.8057 -0.8057 -0.8057 -0.6464 -0.6464 -0.6463 -0.6463 1.1930 1.1930 1.1931 1.1931 1.3474 1.3474 1.3476 1.3476 2.8042 2.8042 2.8044 2.8044 3.2089 3.2089 3.2092 3.2092 4.0399 4.0399 4.0404 4.0404 4.1316 4.1316 4.1324 4.1324 4.6932 4.6932 4.6944 4.6944 4.8571 4.8571 4.8591 4.8591 5.6453 5.6453 5.6466 5.6466 5.7950 5.7950 5.7994 5.7994 6.2661 6.2661 6.2741 6.2741 6.5098 6.5098 6.5251 6.5251 6.6597 6.6597 6.6701 6.6701 6.7879 6.7879 6.8011 6.8011 6.9055 6.9055 6.9207 6.9207 7.0338 7.0338 7.0416 7.0416 7.3084 7.3084 7.3213 7.3213 7.3629 7.3629 7.3775 7.3775 7.4840 7.4840 7.5015 7.5015 7.8640 7.8640 7.8682 7.8682 8.8240 8.8240 8.8306 8.8306 9.5874 9.5874 9.5894 9.5894 9.6531 9.6531 9.6591 9.6591 10.0188 10.0188 10.0259 10.0259 k = 0.2400 0.5024 0.3362 ( 12384 PWs) bands (ev): -0.7729 -0.7729 -0.7728 -0.7728 -0.6143 -0.6143 -0.6142 -0.6142 1.0871 1.0871 1.0872 1.0872 1.2437 1.2437 1.2439 1.2439 2.8345 2.8345 2.8347 2.8347 3.2380 3.2380 3.2383 3.2383 4.1407 4.1407 4.1416 4.1416 4.2334 4.2334 4.2339 4.2339 4.6638 4.6638 4.6654 4.6654 4.8159 4.8159 4.8181 4.8181 5.6499 5.6499 5.6514 5.6514 5.8014 5.8014 5.8058 5.8058 6.2680 6.2680 6.2761 6.2761 6.5106 6.5106 6.5256 6.5256 6.6572 6.6572 6.6682 6.6682 6.7940 6.7940 6.8082 6.8082 6.9130 6.9130 6.9313 6.9313 7.0541 7.0541 7.0611 7.0611 7.3164 7.3164 7.3282 7.3282 7.3537 7.3537 7.3694 7.3694 7.4859 7.4859 7.5011 7.5011 7.8567 7.8567 7.8620 7.8620 8.8574 8.8574 8.8650 8.8650 9.5523 9.5523 9.5611 9.5611 9.7254 9.7254 9.7262 9.7262 10.0034 10.0034 10.0110 10.0110 k = 0.2600 0.5024 0.3362 ( 12380 PWs) bands (ev): -0.7372 -0.7372 -0.7372 -0.7372 -0.5797 -0.5797 -0.5795 -0.5795 0.9836 0.9836 0.9837 0.9837 1.1425 1.1425 1.1427 1.1427 2.8673 2.8673 2.8675 2.8675 3.2690 3.2690 3.2693 3.2693 4.1931 4.1931 4.1943 4.1943 4.3246 4.3246 4.3248 4.3248 4.6727 4.6727 4.6747 4.6747 4.7909 4.7909 4.7936 4.7936 5.6568 5.6568 5.6585 5.6585 5.8108 5.8108 5.8153 5.8153 6.2673 6.2673 6.2755 6.2755 6.5100 6.5100 6.5244 6.5244 6.6532 6.6532 6.6647 6.6647 6.7986 6.7986 6.8137 6.8137 6.9191 6.9191 6.9401 6.9401 7.0730 7.0730 7.0783 7.0783 7.3180 7.3180 7.3295 7.3295 7.3456 7.3456 7.3605 7.3605 7.4939 7.4939 7.5054 7.5054 7.8488 7.8488 7.8554 7.8554 8.8870 8.8870 8.8957 8.8957 9.5138 9.5138 9.5241 9.5241 9.7952 9.7952 9.7975 9.7975 10.0038 10.0038 10.0120 10.0120 k = 0.2800 0.5024 0.3362 ( 12388 PWs) bands (ev): -0.6988 -0.6988 -0.6987 -0.6987 -0.5424 -0.5424 -0.5422 -0.5422 0.8827 0.8827 0.8828 0.8828 1.0438 1.0438 1.0440 1.0440 2.9025 2.9025 2.9027 2.9027 3.3019 3.3019 3.3023 3.3023 4.1900 4.1900 4.1912 4.1912 4.3905 4.3905 4.3906 4.3906 4.7191 4.7191 4.7211 4.7211 4.8045 4.8045 4.8075 4.8075 5.6661 5.6661 5.6679 5.6679 5.8225 5.8225 5.8272 5.8272 6.2648 6.2648 6.2732 6.2732 6.5077 6.5077 6.5215 6.5215 6.6475 6.6475 6.6595 6.6595 6.8019 6.8019 6.8177 6.8177 6.9240 6.9240 6.9474 6.9474 7.0892 7.0892 7.0921 7.0921 7.3137 7.3137 7.3252 7.3252 7.3388 7.3388 7.3525 7.3525 7.5068 7.5068 7.5141 7.5141 7.8401 7.8401 7.8482 7.8482 8.9112 8.9112 8.9208 8.9208 9.4754 9.4754 9.4863 9.4863 9.8430 9.8430 9.8447 9.8447 10.0331 10.0331 10.0410 10.0410 k = 0.3000 0.5024 0.3362 ( 12384 PWs) bands (ev): -0.6577 -0.6577 -0.6576 -0.6576 -0.5025 -0.5025 -0.5024 -0.5024 0.7844 0.7844 0.7844 0.7844 0.9478 0.9478 0.9480 0.9480 2.9401 2.9401 2.9402 2.9402 3.3367 3.3367 3.3370 3.3370 4.1520 4.1520 4.1530 4.1530 4.4086 4.4086 4.4089 4.4089 4.7913 4.7913 4.7928 4.7928 4.8699 4.8699 4.8726 4.8726 5.6778 5.6778 5.6796 5.6796 5.8361 5.8361 5.8412 5.8412 6.2613 6.2613 6.2698 6.2698 6.5037 6.5037 6.5166 6.5166 6.6400 6.6400 6.6523 6.6523 6.8036 6.8036 6.8202 6.8202 6.9281 6.9281 6.9537 6.9537 7.1016 7.1016 7.1018 7.1018 7.3062 7.3062 7.3152 7.3152 7.3326 7.3326 7.3482 7.3482 7.5227 7.5227 7.5263 7.5263 7.8304 7.8304 7.8401 7.8401 8.9288 8.9288 8.9391 8.9391 9.4368 9.4368 9.4478 9.4478 9.8528 9.8528 9.8535 9.8535 10.0966 10.0966 10.1035 10.1035 k = 0.3200 0.5024 0.3362 ( 12404 PWs) bands (ev): -0.6139 -0.6139 -0.6138 -0.6138 -0.4603 -0.4603 -0.4601 -0.4601 0.6887 0.6887 0.6888 0.6888 0.8545 0.8545 0.8548 0.8548 2.9800 2.9800 2.9802 2.9802 3.3729 3.3729 3.3733 3.3733 4.0973 4.0973 4.0982 4.0982 4.3854 4.3854 4.3858 4.3858 4.8851 4.8851 4.8861 4.8861 4.9647 4.9647 4.9672 4.9672 5.6920 5.6920 5.6936 5.6936 5.8510 5.8510 5.8567 5.8567 6.2573 6.2573 6.2662 6.2662 6.4976 6.4976 6.5096 6.5096 6.6304 6.6304 6.6429 6.6429 6.8038 6.8038 6.8211 6.8211 6.9316 6.9316 6.9591 6.9591 7.1070 7.1070 7.1101 7.1101 7.2966 7.2966 7.3011 7.3011 7.3277 7.3277 7.3478 7.3478 7.5401 7.5401 7.5406 7.5406 7.8195 7.8195 7.8308 7.8308 8.9390 8.9390 8.9500 8.9500 9.3974 9.3974 9.4080 9.4080 9.8287 9.8287 9.8317 9.8317 10.1711 10.1711 10.1783 10.1783 k = 0.3400 0.5024 0.3362 ( 12404 PWs) bands (ev): -0.5675 -0.5675 -0.5674 -0.5674 -0.4157 -0.4157 -0.4155 -0.4155 0.5959 0.5959 0.5959 0.5959 0.7643 0.7643 0.7646 0.7646 3.0223 3.0223 3.0225 3.0225 3.4103 3.4103 3.4107 3.4107 4.0358 4.0358 4.0366 4.0366 4.3407 4.3407 4.3412 4.3412 4.9883 4.9883 4.9889 4.9889 5.0697 5.0697 5.0720 5.0720 5.7086 5.7086 5.7100 5.7100 5.8671 5.8671 5.8735 5.8735 6.2538 6.2538 6.2630 6.2630 6.4894 6.4894 6.5002 6.5002 6.6185 6.6185 6.6311 6.6311 6.8023 6.8023 6.8203 6.8203 6.9347 6.9347 6.9641 6.9641 7.1085 7.1085 7.1144 7.1144 7.2850 7.2850 7.2850 7.2850 7.3256 7.3256 7.3505 7.3505 7.5561 7.5561 7.5579 7.5579 7.8074 7.8074 7.8202 7.8202 8.9420 8.9420 8.9534 8.9534 9.3566 9.3566 9.3665 9.3665 9.7814 9.7814 9.7862 9.7862 10.1975 10.1975 10.2066 10.2066 k = 0.3600 0.5024 0.3362 ( 12410 PWs) bands (ev): -0.5186 -0.5186 -0.5185 -0.5185 -0.3691 -0.3691 -0.3689 -0.3689 0.5060 0.5060 0.5060 0.5060 0.6773 0.6773 0.6777 0.6777 3.0668 3.0668 3.0670 3.0670 3.4481 3.4481 3.4485 3.4485 3.9727 3.9727 3.9735 3.9735 4.2864 4.2864 4.2869 4.2869 5.0900 5.0900 5.0902 5.0902 5.1769 5.1769 5.1789 5.1789 5.7281 5.7281 5.7290 5.7290 5.8838 5.8838 5.8911 5.8911 6.2513 6.2513 6.2611 6.2611 6.4788 6.4788 6.4881 6.4881 6.6043 6.6043 6.6167 6.6167 6.7989 6.7989 6.8176 6.8176 6.9377 6.9377 6.9688 6.9688 7.1072 7.1072 7.1157 7.1157 7.2680 7.2680 7.2713 7.2713 7.3268 7.3268 7.3555 7.3555 7.5718 7.5718 7.5755 7.5755 7.7941 7.7941 7.8085 7.8085 8.9379 8.9379 8.9497 8.9497 9.3146 9.3146 9.3236 9.3236 9.7194 9.7194 9.7254 9.7254 10.1371 10.1371 10.1457 10.1457 k = 0.3800 0.5024 0.3362 ( 12404 PWs) bands (ev): -0.4674 -0.4674 -0.4673 -0.4673 -0.3207 -0.3207 -0.3204 -0.3204 0.4191 0.4191 0.4192 0.4192 0.5939 0.5939 0.5943 0.5943 3.1135 3.1135 3.1137 3.1137 3.4847 3.4847 3.4853 3.4853 3.9116 3.9116 3.9124 3.9124 4.2278 4.2278 4.2284 4.2284 5.1830 5.1830 5.1837 5.1837 5.2818 5.2818 5.2831 5.2831 5.7510 5.7510 5.7512 5.7512 5.9008 5.9008 5.9089 5.9089 6.2507 6.2507 6.2610 6.2610 6.4657 6.4657 6.4732 6.4732 6.5876 6.5876 6.5997 6.5997 6.7937 6.7937 6.8131 6.8131 6.9405 6.9405 6.9733 6.9733 7.1045 7.1045 7.1155 7.1155 7.2505 7.2505 7.2560 7.2560 7.3308 7.3308 7.3620 7.3620 7.5869 7.5869 7.5922 7.5922 7.7801 7.7801 7.7958 7.7958 8.9275 8.9275 8.9394 8.9394 9.2726 9.2726 9.2805 9.2805 9.6517 9.6517 9.6588 9.6588 10.0619 10.0619 10.0709 10.0709 k = 0.4000 0.5024 0.3362 ( 12406 PWs) bands (ev): -0.4142 -0.4142 -0.4141 -0.4141 -0.2711 -0.2711 -0.2708 -0.2708 0.3357 0.3357 0.3357 0.3357 0.5146 0.5146 0.5151 0.5151 3.1622 3.1622 3.1624 3.1624 3.5174 3.5174 3.5181 3.5181 3.8566 3.8566 3.8576 3.8576 4.1676 4.1676 4.1682 4.1682 5.2638 5.2638 5.2653 5.2653 5.3798 5.3798 5.3802 5.3802 5.7775 5.7775 5.7783 5.7783 5.9174 5.9174 5.9262 5.9262 6.2523 6.2523 6.2631 6.2631 6.4506 6.4506 6.4558 6.4558 6.5685 6.5685 6.5798 6.5798 6.7868 6.7868 6.8070 6.8070 6.9432 6.9432 6.9775 6.9775 7.1019 7.1019 7.1154 7.1154 7.2332 7.2332 7.2394 7.2394 7.3364 7.3364 7.3695 7.3695 7.6007 7.6007 7.6074 7.6074 7.7661 7.7661 7.7829 7.7829 8.9117 8.9117 8.9236 8.9236 9.2326 9.2326 9.2394 9.2394 9.5860 9.5860 9.5940 9.5940 9.9960 9.9960 10.0059 10.0059 k = 0.4200 0.5024 0.3362 ( 12406 PWs) bands (ev): -0.3595 -0.3595 -0.3594 -0.3594 -0.2211 -0.2211 -0.2208 -0.2208 0.2562 0.2562 0.2563 0.2563 0.4404 0.4404 0.4409 0.4409 3.2128 3.2128 3.2130 3.2130 3.5396 3.5396 3.5405 3.5405 3.8147 3.8147 3.8158 3.8158 4.1072 4.1072 4.1078 4.1078 5.3303 5.3303 5.3327 5.3327 5.4649 5.4649 5.4657 5.4657 5.8089 5.8089 5.8107 5.8107 5.9334 5.9334 5.9420 5.9420 6.2555 6.2555 6.2667 6.2667 6.4350 6.4350 6.4374 6.4374 6.5470 6.5470 6.5572 6.5572 6.7788 6.7788 6.7998 6.7998 6.9458 6.9458 6.9814 6.9814 7.1004 7.1004 7.1170 7.1170 7.2163 7.2163 7.2220 7.2220 7.3427 7.3427 7.3771 7.3771 7.6125 7.6125 7.6203 7.6203 7.7531 7.7531 7.7709 7.7709 8.8920 8.8920 8.9039 8.9039 9.1974 9.1974 9.2030 9.2030 9.5275 9.5275 9.5364 9.5364 9.9433 9.9433 9.9541 9.9541 k = 0.4400 0.5024 0.3362 ( 12406 PWs) bands (ev): -0.3045 -0.3045 -0.3043 -0.3043 -0.1726 -0.1726 -0.1721 -0.1721 0.1818 0.1818 0.1819 0.1819 0.3731 0.3731 0.3737 0.3737 3.2650 3.2650 3.2652 3.2652 3.5416 3.5416 3.5425 3.5425 3.7964 3.7964 3.7976 3.7976 4.0477 4.0477 4.0483 4.0483 5.3818 5.3818 5.3848 5.3848 5.5323 5.5323 5.5344 5.5344 5.8453 5.8453 5.8473 5.8473 5.9486 5.9486 5.9554 5.9554 6.2580 6.2580 6.2692 6.2692 6.4217 6.4217 6.4226 6.4226 6.5233 6.5233 6.5320 6.5320 6.7709 6.7709 6.7925 6.7925 6.9481 6.9481 6.9848 6.9848 7.1006 7.1006 7.1212 7.1212 7.2006 7.2006 7.2043 7.2043 7.3488 7.3488 7.3842 7.3842 7.6213 7.6213 7.6302 7.6302 7.7425 7.7425 7.7608 7.7608 8.8709 8.8709 8.8827 8.8827 9.1690 9.1690 9.1736 9.1736 9.4795 9.4795 9.4893 9.4893 9.9040 9.9040 9.9155 9.9155 k = 0.4600 0.5024 0.3362 ( 12402 PWs) bands (ev): -0.2518 -0.2518 -0.2515 -0.2515 -0.1286 -0.1286 -0.1281 -0.1281 0.1149 0.1149 0.1151 0.1151 0.3158 0.3158 0.3166 0.3166 3.3183 3.3183 3.3186 3.3186 3.5183 3.5183 3.5191 3.5191 3.8071 3.8071 3.8081 3.8081 3.9898 3.9898 3.9906 3.9906 5.4179 5.4179 5.4214 5.4214 5.5797 5.5797 5.5826 5.5826 5.8824 5.8824 5.8831 5.8831 5.9643 5.9643 5.9660 5.9660 6.2562 6.2562 6.2661 6.2661 6.4152 6.4152 6.4190 6.4190 6.4981 6.4981 6.5051 6.5051 6.7640 6.7640 6.7861 6.7861 6.9499 6.9499 6.9874 6.9874 7.1024 7.1024 7.1285 7.1285 7.1867 7.1867 7.1871 7.1871 7.3539 7.3539 7.3899 7.3899 7.6268 7.6268 7.6367 7.6367 7.7351 7.7351 7.7536 7.7536 8.8518 8.8518 8.8636 8.8636 9.1487 9.1487 9.1524 9.1524 9.4440 9.4440 9.4547 9.4547 9.8770 9.8770 9.8890 9.8890 k = 0.4800 0.5024 0.3362 ( 12408 PWs) bands (ev): -0.2081 -0.2081 -0.2079 -0.2079 -0.0953 -0.0953 -0.0946 -0.0946 0.0622 0.0622 0.0625 0.0625 0.2750 0.2750 0.2759 0.2759 3.3718 3.3718 3.3720 3.3720 3.4774 3.4774 3.4781 3.4781 3.8393 3.8393 3.8401 3.8401 3.9347 3.9347 3.9355 3.9355 5.4392 5.4392 5.4429 5.4429 5.6071 5.6071 5.6105 5.6105 5.9063 5.9063 5.9129 5.9129 5.9735 5.9735 5.9803 5.9803 6.2499 6.2499 6.2574 6.2574 6.4213 6.4213 6.4275 6.4275 6.4734 6.4734 6.4782 6.4782 6.7594 6.7594 6.7818 6.7818 6.9511 6.9511 6.9891 6.9891 7.1048 7.1048 7.1386 7.1386 7.1702 7.1702 7.1775 7.1775 7.3572 7.3572 7.3938 7.3938 7.6295 7.6295 7.6400 7.6400 7.7311 7.7311 7.7497 7.7497 8.8385 8.8385 8.8503 8.8503 9.1365 9.1365 9.1396 9.1396 9.4224 9.4224 9.4336 9.4336 9.8613 9.8613 9.8736 9.8736 k = 0.5000 0.5024 0.3362 ( 12420 PWs) bands (ev): -0.1894 -0.1894 -0.1890 -0.1890 -0.0820 -0.0820 -0.0813 -0.0813 0.0400 0.0400 0.0403 0.0403 0.2597 0.2597 0.2606 0.2606 3.4151 3.4151 3.4154 3.4154 3.4370 3.4370 3.4382 3.4382 3.8805 3.8805 3.8813 3.8813 3.8859 3.8859 3.8883 3.8883 5.4463 5.4463 5.4500 5.4500 5.6160 5.6160 5.6195 5.6195 5.9141 5.9141 5.9242 5.9242 5.9767 5.9767 5.9881 5.9881 6.2461 6.2461 6.2524 6.2524 6.4303 6.4303 6.4395 6.4395 6.4586 6.4586 6.4604 6.4604 6.7577 6.7577 6.7803 6.7803 6.9515 6.9515 6.9897 6.9897 7.1059 7.1059 7.1472 7.1472 7.1593 7.1593 7.1739 7.1739 7.3584 7.3584 7.3951 7.3951 7.6302 7.6302 7.6409 7.6409 7.7299 7.7299 7.7484 7.7484 8.8338 8.8338 8.8455 8.8455 9.1325 9.1325 9.1354 9.1354 9.4151 9.4151 9.4266 9.4266 9.8561 9.8561 9.8686 9.8686 k = 0.5000 0.5024 0.3362 ( 12420 PWs) bands (ev): -0.1894 -0.1894 -0.1890 -0.1890 -0.0820 -0.0820 -0.0813 -0.0813 0.0400 0.0400 0.0403 0.0403 0.2597 0.2597 0.2606 0.2606 3.4151 3.4151 3.4154 3.4154 3.4370 3.4370 3.4382 3.4382 3.8805 3.8805 3.8813 3.8813 3.8859 3.8859 3.8883 3.8883 5.4463 5.4463 5.4500 5.4500 5.6160 5.6160 5.6195 5.6195 5.9141 5.9141 5.9242 5.9242 5.9767 5.9767 5.9881 5.9881 6.2461 6.2461 6.2524 6.2524 6.4303 6.4303 6.4395 6.4395 6.4586 6.4586 6.4604 6.4604 6.7577 6.7577 6.7803 6.7803 6.9515 6.9515 6.9897 6.9897 7.1059 7.1059 7.1472 7.1472 7.1593 7.1593 7.1739 7.1739 7.3584 7.3584 7.3951 7.3951 7.6302 7.6302 7.6409 7.6409 7.7299 7.7299 7.7484 7.7484 8.8338 8.8338 8.8455 8.8455 9.1325 9.1325 9.1354 9.1354 9.4151 9.4151 9.4266 9.4266 9.8561 9.8561 9.8686 9.8686 k = 0.5000 0.5124 0.3212 ( 12416 PWs) bands (ev): -0.1938 -0.1938 -0.1935 -0.1935 -0.0867 -0.0867 -0.0861 -0.0861 0.0353 0.0353 0.0357 0.0357 0.2778 0.2778 0.2787 0.2787 3.3530 3.3530 3.3537 3.3537 3.4979 3.4979 3.4987 3.4987 3.7626 3.7626 3.7642 3.7642 4.0063 4.0063 4.0080 4.0080 5.4431 5.4431 5.4469 5.4469 5.6151 5.6151 5.6185 5.6185 5.9124 5.9124 5.9220 5.9220 5.9777 5.9777 5.9896 5.9896 6.2448 6.2448 6.2511 6.2511 6.4298 6.4298 6.4380 6.4380 6.4603 6.4603 6.4611 6.4611 6.7592 6.7592 6.7816 6.7816 6.9511 6.9511 6.9892 6.9892 7.1054 7.1054 7.1461 7.1461 7.1601 7.1601 7.1749 7.1749 7.3573 7.3573 7.3939 7.3939 7.6316 7.6316 7.6427 7.6427 7.7301 7.7301 7.7481 7.7481 8.8371 8.8371 8.8488 8.8488 9.1341 9.1341 9.1369 9.1369 9.4188 9.4188 9.4303 9.4303 9.8567 9.8567 9.8692 9.8692 k = 0.5000 0.5223 0.3063 ( 12410 PWs) bands (ev): -0.2095 -0.2095 -0.2093 -0.2093 -0.0972 -0.0972 -0.0966 -0.0966 0.0282 0.0282 0.0285 0.0285 0.3243 0.3243 0.3252 0.3252 3.2802 3.2802 3.2809 3.2809 3.5585 3.5585 3.5590 3.5590 3.6549 3.6549 3.6562 3.6562 4.1300 4.1300 4.1317 4.1317 5.4339 5.4339 5.4375 5.4375 5.6122 5.6122 5.6154 5.6154 5.9076 5.9076 5.9156 5.9156 5.9806 5.9806 5.9937 5.9937 6.2409 6.2409 6.2476 6.2476 6.4286 6.4286 6.4344 6.4344 6.4635 6.4635 6.4646 6.4646 6.7635 6.7635 6.7854 6.7854 6.9497 6.9497 6.9878 6.9878 7.1039 7.1039 7.1430 7.1430 7.1622 7.1622 7.1778 7.1778 7.3542 7.3542 7.3905 7.3905 7.6352 7.6352 7.6473 7.6473 7.7311 7.7311 7.7476 7.7476 8.8470 8.8470 8.8583 8.8583 9.1387 9.1387 9.1414 9.1414 9.4298 9.4298 9.4414 9.4414 9.8586 9.8586 9.8711 9.8711 k = 0.5000 0.5223 0.3063 ( 12410 PWs) bands (ev): -0.2095 -0.2095 -0.2093 -0.2093 -0.0972 -0.0972 -0.0966 -0.0966 0.0282 0.0282 0.0285 0.0285 0.3243 0.3243 0.3252 0.3252 3.2802 3.2802 3.2809 3.2809 3.5585 3.5585 3.5590 3.5590 3.6549 3.6549 3.6562 3.6562 4.1300 4.1300 4.1317 4.1317 5.4339 5.4339 5.4375 5.4375 5.6122 5.6122 5.6154 5.6154 5.9076 5.9076 5.9156 5.9156 5.9806 5.9806 5.9937 5.9937 6.2409 6.2409 6.2476 6.2476 6.4286 6.4286 6.4344 6.4344 6.4635 6.4635 6.4646 6.4646 6.7635 6.7635 6.7854 6.7854 6.9497 6.9497 6.9878 6.9878 7.1039 7.1039 7.1430 7.1430 7.1622 7.1622 7.1778 7.1778 7.3542 7.3542 7.3905 7.3905 7.6352 7.6352 7.6473 7.6473 7.7311 7.7311 7.7476 7.7476 8.8470 8.8470 8.8583 8.8583 9.1387 9.1387 9.1414 9.1414 9.4298 9.4298 9.4414 9.4414 9.8586 9.8586 9.8711 9.8711 k = 0.5000 0.5212 0.2865 ( 12422 PWs) bands (ev): -0.2333 -0.2333 -0.2330 -0.2330 -0.1034 -0.1034 -0.1033 -0.1033 0.0361 0.0361 0.0363 0.0363 0.3673 0.3673 0.3682 0.3682 3.1483 3.1483 3.1490 3.1490 3.5017 3.5017 3.5030 3.5030 3.7207 3.7207 3.7213 3.7213 4.2557 4.2557 4.2576 4.2576 5.4334 5.4334 5.4370 5.4370 5.6140 5.6140 5.6172 5.6172 5.9081 5.9081 5.9153 5.9153 5.9793 5.9793 5.9925 5.9925 6.2455 6.2455 6.2517 6.2517 6.4197 6.4197 6.4250 6.4250 6.4686 6.4686 6.4702 6.4702 6.7684 6.7684 6.7891 6.7891 6.9472 6.9472 6.9854 6.9854 7.0964 7.0964 7.1324 7.1324 7.1687 7.1687 7.1851 7.1851 7.3512 7.3512 7.3872 7.3872 7.6458 7.6458 7.6582 7.6582 7.7363 7.7363 7.7512 7.7512 8.8495 8.8495 8.8605 8.8605 9.1400 9.1400 9.1426 9.1426 9.4300 9.4300 9.4419 9.4419 9.8575 9.8575 9.8700 9.8700 k = 0.5000 0.5200 0.2668 ( 12416 PWs) bands (ev): -0.2661 -0.2661 -0.2658 -0.2658 -0.1227 -0.1227 -0.1225 -0.1225 0.0690 0.0690 0.0695 0.0695 0.4175 0.4175 0.4184 0.4184 3.0177 3.0177 3.0184 3.0184 3.3777 3.3777 3.3790 3.3790 3.8551 3.8551 3.8560 3.8560 4.3803 4.3803 4.3824 4.3824 5.4318 5.4318 5.4353 5.4353 5.6157 5.6157 5.6188 5.6188 5.9081 5.9081 5.9149 5.9149 5.9779 5.9779 5.9905 5.9905 6.2526 6.2526 6.2577 6.2577 6.4059 6.4059 6.4115 6.4115 6.4778 6.4778 6.4791 6.4791 6.7754 6.7754 6.7946 6.7946 6.9435 6.9435 6.9817 6.9817 7.0871 7.0871 7.1203 7.1203 7.1768 7.1768 7.1926 7.1926 7.3483 7.3483 7.3841 7.3841 7.6607 7.6607 7.6732 7.6732 7.7450 7.7450 7.7579 7.7579 8.8505 8.8505 8.8612 8.8612 9.1416 9.1416 9.1441 9.1441 9.4267 9.4267 9.4390 9.4390 9.8566 9.8566 9.8690 9.8690 k = 0.5000 0.5188 0.2470 ( 12410 PWs) bands (ev): -0.3006 -0.3006 -0.3003 -0.3003 -0.1504 -0.1504 -0.1500 -0.1500 0.1175 0.1175 0.1181 0.1181 0.4728 0.4728 0.4737 0.4737 2.8888 2.8888 2.8894 2.8894 3.2523 3.2523 3.2535 3.2535 3.9925 3.9925 3.9935 3.9935 4.5032 4.5032 4.5055 4.5055 5.4292 5.4292 5.4326 5.4326 5.6170 5.6170 5.6201 5.6201 5.9079 5.9079 5.9143 5.9143 5.9765 5.9765 5.9881 5.9881 6.2607 6.2607 6.2645 6.2645 6.3909 6.3909 6.3971 6.3971 6.4879 6.4879 6.4887 6.4887 6.7844 6.7844 6.8017 6.8017 6.9387 6.9387 6.9766 6.9766 7.0777 7.0777 7.1083 7.1083 7.1847 7.1847 7.1988 7.1988 7.3468 7.3468 7.3822 7.3822 7.6792 7.6792 7.6916 7.6916 7.7568 7.7568 7.7674 7.7674 8.8500 8.8500 8.8602 8.8602 9.1436 9.1436 9.1459 9.1459 9.4193 9.4193 9.4322 9.4322 9.8552 9.8552 9.8675 9.8675 k = 0.5000 0.5176 0.2272 ( 12404 PWs) bands (ev): -0.3344 -0.3344 -0.3341 -0.3341 -0.1805 -0.1805 -0.1802 -0.1802 0.1742 0.1742 0.1749 0.1749 0.5321 0.5321 0.5331 0.5331 2.7617 2.7617 2.7622 2.7622 3.1276 3.1276 3.1287 3.1287 4.1303 4.1303 4.1314 4.1314 4.6238 4.6238 4.6263 4.6263 5.4259 5.4259 5.4291 5.4291 5.6179 5.6179 5.6210 5.6210 5.9073 5.9073 5.9135 5.9135 5.9754 5.9754 5.9856 5.9856 6.2678 6.2678 6.2704 6.2704 6.3770 6.3770 6.3835 6.3835 6.4981 6.4981 6.4983 6.4983 6.7955 6.7955 6.8106 6.8106 6.9328 6.9328 6.9702 6.9702 7.0692 7.0692 7.0972 7.0972 7.1911 7.1911 7.2030 7.2030 7.3476 7.3476 7.3824 7.3824 7.7004 7.7004 7.7128 7.7128 7.7709 7.7709 7.7792 7.7792 8.8478 8.8478 8.8574 8.8574 9.1460 9.1460 9.1480 9.1480 9.4072 9.4072 9.4209 9.4209 9.8521 9.8521 9.8642 9.8642 k = 0.5000 0.5165 0.2074 ( 12414 PWs) bands (ev): -0.3665 -0.3665 -0.3662 -0.3662 -0.2107 -0.2107 -0.2103 -0.2103 0.2362 0.2362 0.2370 0.2370 0.5949 0.5949 0.5960 0.5960 2.6366 2.6366 2.6371 2.6371 3.0042 3.0042 3.0053 3.0053 4.2678 4.2678 4.2690 4.2690 4.7411 4.7411 4.7440 4.7440 5.4222 5.4222 5.4251 5.4251 5.6186 5.6186 5.6216 5.6216 5.9064 5.9064 5.9126 5.9126 5.9745 5.9745 5.9832 5.9832 6.2706 6.2706 6.2726 6.2726 6.3670 6.3670 6.3729 6.3729 6.5077 6.5077 6.5080 6.5080 6.8085 6.8085 6.8213 6.8213 6.9261 6.9261 6.9626 6.9626 7.0622 7.0622 7.0874 7.0874 7.1953 7.1953 7.2049 7.2049 7.3519 7.3519 7.3856 7.3856 7.7236 7.7236 7.7360 7.7360 7.7871 7.7871 7.7929 7.7929 8.8438 8.8438 8.8527 8.8527 9.1487 9.1487 9.1504 9.1504 9.3892 9.3892 9.4037 9.4037 9.8440 9.8440 9.8554 9.8554 k = 0.5000 0.5153 0.1877 ( 12416 PWs) bands (ev): -0.3965 -0.3965 -0.3962 -0.3962 -0.2395 -0.2395 -0.2391 -0.2391 0.3021 0.3021 0.3029 0.3029 0.6606 0.6606 0.6618 0.6618 2.5138 2.5138 2.5142 2.5142 2.8824 2.8824 2.8834 2.8834 4.4043 4.4043 4.4057 4.4057 4.8544 4.8544 4.8577 4.8577 5.4183 5.4183 5.4210 5.4210 5.6189 5.6189 5.6219 5.6219 5.9054 5.9054 5.9115 5.9115 5.9738 5.9738 5.9810 5.9810 6.2654 6.2654 6.2681 6.2681 6.3638 6.3638 6.3677 6.3677 6.5169 6.5169 6.5176 6.5176 6.8234 6.8234 6.8337 6.8337 6.9187 6.9187 6.9538 6.9538 7.0570 7.0570 7.0793 7.0793 7.1971 7.1971 7.2044 7.2044 7.3601 7.3601 7.3921 7.3921 7.7481 7.7481 7.7606 7.7606 7.8046 7.8046 7.8079 7.8079 8.8375 8.8375 8.8457 8.8457 9.1518 9.1518 9.1530 9.1530 9.3637 9.3637 9.3792 9.3792 9.8200 9.8200 9.8302 9.8302 k = 0.5000 0.5141 0.1679 ( 12402 PWs) bands (ev): -0.4242 -0.4242 -0.4239 -0.4239 -0.2666 -0.2666 -0.2662 -0.2662 0.3713 0.3713 0.3722 0.3722 0.7290 0.7290 0.7302 0.7302 2.3934 2.3934 2.3937 2.3937 2.7625 2.7625 2.7635 2.7635 4.5391 4.5391 4.5407 4.5407 4.9627 4.9627 4.9664 4.9664 5.4146 5.4146 5.4171 5.4171 5.6193 5.6193 5.6222 5.6222 5.9044 5.9044 5.9104 5.9104 5.9730 5.9730 5.9788 5.9788 6.2514 6.2514 6.2557 6.2557 6.3676 6.3676 6.3685 6.3685 6.5260 6.5260 6.5268 6.5268 6.8399 6.8399 6.8477 6.8477 6.9110 6.9110 6.9442 6.9442 7.0538 7.0538 7.0731 7.0731 7.1966 7.1966 7.2020 7.2020 7.3725 7.3725 7.4022 7.4022 7.7731 7.7731 7.7856 7.7856 7.8235 7.8235 7.8244 7.8244 8.8282 8.8282 8.8354 8.8354 9.1552 9.1552 9.1559 9.1559 9.3289 9.3289 9.3451 9.3451 9.7589 9.7589 9.7695 9.7695 k = 0.5000 0.5129 0.1481 ( 12392 PWs) bands (ev): -0.4494 -0.4494 -0.4492 -0.4492 -0.2914 -0.2914 -0.2911 -0.2911 0.4433 0.4433 0.4443 0.4443 0.7996 0.7996 0.8009 0.8009 2.2757 2.2757 2.2759 2.2759 2.6447 2.6447 2.6456 2.6456 4.6714 4.6714 4.6733 4.6733 5.0646 5.0646 5.0689 5.0689 5.4114 5.4114 5.4137 5.4137 5.6198 5.6198 5.6227 5.6227 5.9034 5.9034 5.9093 5.9093 5.9718 5.9718 5.9764 5.9764 6.2305 6.2305 6.2363 6.2363 6.3734 6.3734 6.3754 6.3754 6.5350 6.5350 6.5358 6.5358 6.8569 6.8569 6.8629 6.8629 6.9037 6.9037 6.9341 6.9341 7.0525 7.0525 7.0688 7.0688 7.1944 7.1944 7.1981 7.1981 7.3888 7.3888 7.4156 7.4156 7.7973 7.7973 7.8093 7.8093 7.8428 7.8428 7.8438 7.8438 8.8144 8.8144 8.8205 8.8205 9.1587 9.1587 9.1588 9.1588 9.2838 9.2838 9.3002 9.3002 9.6743 9.6743 9.6863 9.6863 k = 0.5000 0.5118 0.1283 ( 12388 PWs) bands (ev): -0.4721 -0.4721 -0.4719 -0.4719 -0.3140 -0.3140 -0.3137 -0.3137 0.5180 0.5180 0.5190 0.5190 0.8720 0.8720 0.8734 0.8734 2.1611 2.1611 2.1612 2.1612 2.5292 2.5292 2.5300 2.5300 4.8002 4.8002 4.8025 4.8025 5.1586 5.1586 5.1636 5.1636 5.4096 5.4096 5.4116 5.4116 5.6211 5.6211 5.6240 5.6240 5.9025 5.9025 5.9082 5.9082 5.9698 5.9698 5.9732 5.9732 6.2050 6.2050 6.2120 6.2120 6.3801 6.3801 6.3845 6.3845 6.5442 6.5442 6.5449 6.5449 6.8714 6.8714 6.8783 6.8783 6.8997 6.8997 6.9244 6.9244 7.0528 7.0528 7.0664 7.0664 7.1913 7.1913 7.1934 7.1934 7.4085 7.4085 7.4320 7.4320 7.8190 7.8190 7.8296 7.8296 7.8649 7.8649 7.8663 7.8663 8.7938 8.7938 8.7987 8.7987 9.1614 9.1614 9.1620 9.1620 9.2303 9.2303 9.2458 9.2458 9.5947 9.5947 9.6071 9.6071 k = 0.5000 0.5106 0.1086 ( 12386 PWs) bands (ev): -0.4922 -0.4922 -0.4920 -0.4920 -0.3340 -0.3340 -0.3338 -0.3338 0.5950 0.5950 0.5960 0.5960 0.9455 0.9455 0.9471 0.9471 2.0500 2.0500 2.0501 2.0501 2.4163 2.4163 2.4170 2.4170 4.9243 4.9243 4.9270 4.9270 5.2426 5.2426 5.2486 5.2486 5.4102 5.4102 5.4120 5.4120 5.6237 5.6237 5.6266 5.6266 5.9016 5.9016 5.9073 5.9073 5.9663 5.9663 5.9687 5.9687 6.1761 6.1761 6.1839 6.1839 6.3868 6.3868 6.3930 6.3930 6.5537 6.5537 6.5543 6.5543 6.8749 6.8749 6.8907 6.8907 6.9071 6.9071 6.9180 6.9180 7.0544 7.0544 7.0656 7.0656 7.1881 7.1881 7.1887 7.1887 7.4309 7.4309 7.4509 7.4509 7.8373 7.8373 7.8453 7.8453 7.8908 7.8908 7.8915 7.8915 8.7635 8.7635 8.7671 8.7671 9.1575 9.1575 9.1608 9.1608 9.1803 9.1803 9.1922 9.1922 9.5278 9.5278 9.5398 9.5398 k = 0.5000 0.5094 0.0888 ( 12394 PWs) bands (ev): -0.5097 -0.5097 -0.5095 -0.5095 -0.3515 -0.3515 -0.3513 -0.3513 0.6740 0.6740 0.6751 0.6751 1.0193 1.0193 1.0211 1.0211 1.9434 1.9434 1.9436 1.9436 2.3064 2.3064 2.3070 2.3070 5.0414 5.0414 5.0448 5.0448 5.3130 5.3130 5.3197 5.3197 5.4166 5.4166 5.4180 5.4180 5.6286 5.6286 5.6315 5.6315 5.9007 5.9007 5.9065 5.9065 5.9608 5.9608 5.9621 5.9621 6.1446 6.1446 6.1528 6.1528 6.3926 6.3926 6.3998 6.3998 6.5634 6.5634 6.5639 6.5639 6.8699 6.8699 6.8915 6.8915 6.9229 6.9229 6.9234 6.9234 7.0564 7.0564 7.0658 7.0658 7.1849 7.1849 7.1857 7.1857 7.4550 7.4550 7.4714 7.4714 7.8519 7.8519 7.8576 7.8576 7.9190 7.9190 7.9192 7.9192 8.7211 8.7211 8.7235 8.7235 9.1151 9.1151 9.1241 9.1241 9.1735 9.1735 9.1782 9.1782 9.4723 9.4723 9.4836 9.4836 k = 0.5000 0.5082 0.0690 ( 12388 PWs) bands (ev): -0.5245 -0.5245 -0.5243 -0.5243 -0.3664 -0.3664 -0.3662 -0.3662 0.7547 0.7547 0.7559 0.7559 1.0914 1.0914 1.0934 1.0934 1.8429 1.8429 1.8434 1.8434 2.2001 2.2001 2.2005 2.2005 5.1479 5.1479 5.1521 5.1521 5.3638 5.3638 5.3696 5.3696 5.4361 5.4361 5.4370 5.4370 5.6370 5.6370 5.6396 5.6396 5.8995 5.8995 5.9057 5.9057 5.9524 5.9524 5.9525 5.9525 6.1116 6.1116 6.1200 6.1200 6.3972 6.3972 6.4045 6.4045 6.5732 6.5732 6.5737 6.5737 6.8633 6.8633 6.8837 6.8837 6.9372 6.9372 6.9398 6.9398 7.0580 7.0580 7.0660 7.0660 7.1829 7.1829 7.1848 7.1848 7.4794 7.4794 7.4924 7.4924 7.8639 7.8639 7.8676 7.8676 7.9478 7.9478 7.9487 7.9487 8.6673 8.6673 8.6687 8.6687 9.0719 9.0719 9.0793 9.0793 9.1771 9.1771 9.1820 9.1820 9.4258 9.4258 9.4366 9.4366 k = 0.5000 0.5071 0.0493 ( 12384 PWs) bands (ev): -0.5366 -0.5366 -0.5365 -0.5365 -0.3786 -0.3786 -0.3784 -0.3784 0.8364 0.8364 0.8377 0.8377 1.1584 1.1584 1.1607 1.1607 1.7518 1.7518 1.7526 1.7526 2.0981 2.0981 2.0984 2.0984 5.2361 5.2361 5.2408 5.2408 5.3978 5.3978 5.4007 5.4007 5.4686 5.4686 5.4730 5.4730 5.6497 5.6497 5.6516 5.6516 5.8971 5.8971 5.9046 5.9046 5.9382 5.9382 5.9408 5.9408 6.0791 6.0791 6.0870 6.0870 6.4004 6.4004 6.4072 6.4072 6.5826 6.5826 6.5833 6.5833 6.8572 6.8572 6.8745 6.8745 6.9521 6.9521 6.9555 6.9555 7.0584 7.0584 7.0651 7.0651 7.1834 7.1834 7.1858 7.1858 7.5026 7.5026 7.5123 7.5123 7.8738 7.8738 7.8760 7.8760 7.9769 7.9769 7.9783 7.9783 8.6071 8.6071 8.6075 8.6075 9.0373 9.0373 9.0427 9.0427 9.1819 9.1819 9.1874 9.1874 9.3878 9.3878 9.3982 9.3982 k = 0.5000 0.5059 0.0295 ( 12382 PWs) bands (ev): -0.5461 -0.5461 -0.5459 -0.5459 -0.3881 -0.3881 -0.3880 -0.3880 0.9180 0.9180 0.9194 0.9194 1.2130 1.2130 1.2157 1.2157 1.6769 1.6769 1.6780 1.6780 2.0021 2.0021 2.0023 2.0023 5.2936 5.2936 5.2974 5.2974 5.4344 5.4344 5.4349 5.4349 5.5070 5.5070 5.5132 5.5132 5.6655 5.6655 5.6662 5.6662 5.8911 5.8911 5.9012 5.9012 5.9195 5.9195 5.9264 5.9264 6.0503 6.0503 6.0569 6.0569 6.4026 6.4026 6.4082 6.4082 6.5911 6.5911 6.5919 6.5919 6.8523 6.8523 6.8658 6.8658 6.9659 6.9659 6.9692 6.9692 7.0571 7.0571 7.0625 7.0625 7.1861 7.1861 7.1886 7.1886 7.5226 7.5226 7.5294 7.5294 7.8823 7.8823 7.8834 7.8834 8.0051 8.0051 8.0067 8.0067 8.5471 8.5471 8.5473 8.5473 9.0098 9.0098 9.0134 9.0134 9.1870 9.1870 9.1927 9.1927 9.3595 9.3595 9.3689 9.3689 k = 0.5000 0.5047 0.0097 ( 12386 PWs) bands (ev): -0.5528 -0.5528 -0.5527 -0.5527 -0.3949 -0.3949 -0.3948 -0.3948 0.9972 0.9972 0.9988 0.9988 1.2421 1.2421 1.2450 1.2450 1.6304 1.6304 1.6317 1.6317 1.9156 1.9156 1.9157 1.9157 5.3202 5.3202 5.3222 5.3222 5.4681 5.4681 5.4700 5.4700 5.5553 5.5553 5.5602 5.5602 5.6787 5.6787 5.6796 5.6796 5.8755 5.8755 5.8824 5.8824 5.9092 5.9092 5.9150 5.9150 6.0287 6.0287 6.0332 6.0332 6.4041 6.4041 6.4080 6.4080 6.5980 6.5980 6.5987 6.5987 6.8490 6.8490 6.8584 6.8584 6.9777 6.9777 6.9802 6.9802 7.0547 7.0547 7.0584 7.0584 7.1900 7.1900 7.1919 7.1919 7.5380 7.5380 7.5423 7.5423 7.8892 7.8892 7.8897 7.8897 8.0301 8.0301 8.0316 8.0316 8.4951 8.4951 8.4957 8.4957 8.9886 8.9886 8.9908 8.9908 9.1920 9.1920 9.1969 9.1969 9.3414 9.3414 9.3490 9.3490 k = 0.5000 0.5035-0.0101 ( 12394 PWs) bands (ev): -0.5569 -0.5569 -0.5568 -0.5568 -0.3990 -0.3990 -0.3990 -0.3990 1.0675 1.0675 1.0690 1.0690 1.2363 1.2363 1.2386 1.2386 1.6201 1.6201 1.6211 1.6211 1.8472 1.8472 1.8473 1.8473 5.3303 5.3303 5.3312 5.3312 5.4870 5.4870 5.4879 5.4879 5.6107 5.6107 5.6122 5.6122 5.6815 5.6815 5.6836 5.6836 5.8528 5.8528 5.8547 5.8547 5.9078 5.9078 5.9101 5.9101 6.0161 6.0161 6.0182 6.0182 6.4052 6.4052 6.4072 6.4072 6.6027 6.6027 6.6031 6.6031 6.8479 6.8479 6.8527 6.8527 6.9862 6.9862 6.9875 6.9875 7.0523 7.0523 7.0543 7.0543 7.1935 7.1935 7.1945 7.1945 7.5479 7.5479 7.5499 7.5499 7.8939 7.8939 7.8941 7.8941 8.0485 8.0485 8.0494 8.0494 8.4592 8.4592 8.4597 8.4597 8.9748 8.9748 8.9759 8.9759 9.1960 9.1960 9.1988 9.1988 9.3330 9.3330 9.3373 9.3373 k = 0.5000 0.5024-0.0298 ( 12388 PWs) bands (ev): -0.5582 -0.5582 -0.5582 -0.5582 -0.4003 -0.4003 -0.4003 -0.4003 1.1040 1.1040 1.1040 1.1040 1.2213 1.2213 1.2213 1.2213 1.6251 1.6251 1.6251 1.6251 1.8181 1.8181 1.8181 1.8181 5.3332 5.3332 5.3333 5.3333 5.4926 5.4926 5.4928 5.4928 5.6441 5.6441 5.6442 5.6442 5.6742 5.6742 5.6742 5.6742 5.8414 5.8414 5.8415 5.8415 5.9082 5.9082 5.9083 5.9083 6.0126 6.0126 6.0126 6.0126 6.4062 6.4062 6.4062 6.4062 6.6043 6.6043 6.6045 6.6045 6.8491 6.8491 6.8491 6.8491 6.9898 6.9898 6.9898 6.9898 7.0519 7.0519 7.0519 7.0519 7.1952 7.1952 7.1952 7.1952 7.5518 7.5518 7.5519 7.5519 7.8957 7.8957 7.8957 7.8957 8.0557 8.0557 8.0558 8.0558 8.4465 8.4465 8.4465 8.4465 8.9703 8.9703 8.9704 8.9704 9.1984 9.1984 9.1985 9.1985 9.3321 9.3321 9.3322 9.3322 k = 0.5000 0.5024-0.0298 ( 12388 PWs) bands (ev): -0.5582 -0.5582 -0.5582 -0.5582 -0.4003 -0.4003 -0.4003 -0.4003 1.1040 1.1040 1.1040 1.1040 1.2213 1.2213 1.2213 1.2213 1.6251 1.6251 1.6251 1.6251 1.8181 1.8181 1.8181 1.8181 5.3332 5.3332 5.3333 5.3333 5.4926 5.4926 5.4928 5.4928 5.6441 5.6441 5.6442 5.6442 5.6742 5.6742 5.6742 5.6742 5.8414 5.8414 5.8415 5.8415 5.9082 5.9082 5.9083 5.9083 6.0126 6.0126 6.0126 6.0126 6.4062 6.4062 6.4062 6.4062 6.6043 6.6043 6.6045 6.6045 6.8491 6.8491 6.8491 6.8491 6.9898 6.9898 6.9898 6.9898 7.0519 7.0519 7.0519 7.0519 7.1952 7.1952 7.1952 7.1952 7.5518 7.5518 7.5519 7.5519 7.8957 7.8957 7.8957 7.8957 8.0557 8.0557 8.0558 8.0558 8.4465 8.4465 8.4465 8.4465 8.9703 8.9703 8.9704 8.9704 9.1984 9.1984 9.1985 9.1985 9.3321 9.3321 9.3322 9.3322 k = 0.4800 0.5024-0.0298 ( 12388 PWs) bands (ev): -0.5986 -0.5986 -0.5675 -0.5675 -0.3858 -0.3858 -0.3599 -0.3599 1.0764 1.0764 1.0803 1.0803 1.2321 1.2321 1.2615 1.2615 1.6081 1.6081 1.6107 1.6107 1.8256 1.8256 1.8532 1.8532 5.3220 5.3220 5.3238 5.3238 5.4523 5.4523 5.5155 5.5155 5.6243 5.6243 5.6562 5.6562 5.6579 5.6579 5.6880 5.6880 5.8366 5.8366 5.8502 5.8502 5.8663 5.8663 5.9421 5.9421 6.0127 6.0127 6.0237 6.0237 6.3914 6.3914 6.4300 6.4300 6.6041 6.6041 6.6079 6.6079 6.8464 6.8464 6.8514 6.8514 6.9809 6.9809 6.9971 6.9971 7.0481 7.0481 7.0583 7.0583 7.1838 7.1838 7.2052 7.2052 7.5413 7.5413 7.5619 7.5619 7.8714 7.8714 7.9184 7.9184 7.9916 7.9916 8.1068 8.1068 8.3970 8.3970 8.4951 8.4951 8.9614 8.9614 8.9795 8.9795 9.1702 9.1702 9.2055 9.2055 9.3333 9.3333 9.3609 9.3609 k = 0.4600 0.5024-0.0298 ( 12394 PWs) bands (ev): -0.6562 -0.6562 -0.6142 -0.6142 -0.3286 -0.3286 -0.2973 -0.2973 1.0229 1.0229 1.0350 1.0350 1.2636 1.2636 1.3252 1.3252 1.5649 1.5649 1.5881 1.5881 1.8682 1.8682 1.9120 1.9120 5.2878 5.2878 5.2916 5.2916 5.4016 5.4016 5.5185 5.5185 5.6018 5.6018 5.6419 5.6419 5.6559 5.6559 5.6991 5.6991 5.7971 5.7971 5.8621 5.8621 5.8740 5.8740 5.9516 5.9516 6.0154 6.0154 6.0505 6.0505 6.3892 6.3892 6.4525 6.4525 6.6069 6.6069 6.6186 6.6186 6.8436 6.8436 6.8533 6.8533 6.9707 6.9707 7.0023 7.0023 7.0474 7.0474 7.0666 7.0666 7.1714 7.1714 7.2136 7.2136 7.5308 7.5308 7.5708 7.5708 7.8464 7.8464 7.9133 7.9133 7.9465 7.9465 8.1338 8.1338 8.3562 8.3562 8.5375 8.5375 8.9480 8.9480 8.9903 8.9903 9.1386 9.1386 9.2004 9.2004 9.3582 9.3582 9.4025 9.4025 k = 0.4400 0.5024-0.0298 ( 12400 PWs) bands (ev): -0.7165 -0.7165 -0.6701 -0.6701 -0.2568 -0.2568 -0.2269 -0.2269 0.9650 0.9650 0.9858 0.9858 1.2852 1.2852 1.3964 1.3964 1.5119 1.5119 1.5798 1.5798 1.9279 1.9279 1.9815 1.9815 5.2234 5.2234 5.2346 5.2346 5.3547 5.3547 5.5020 5.5020 5.5759 5.5759 5.6320 5.6320 5.6459 5.6459 5.7036 5.7036 5.7522 5.7522 5.8810 5.8810 5.8995 5.8995 5.9499 5.9499 6.0182 6.0182 6.0793 6.0793 6.3963 6.3963 6.4610 6.4610 6.6133 6.6133 6.6432 6.6432 6.8414 6.8414 6.8553 6.8553 6.9595 6.9595 7.0047 7.0047 7.0500 7.0500 7.0759 7.0759 7.1588 7.1588 7.2210 7.2210 7.5208 7.5208 7.5776 7.5776 7.8203 7.8203 7.8410 7.8410 7.9646 7.9646 8.1247 8.1247 8.3355 8.3355 8.5710 8.5710 8.9256 8.9256 9.0007 9.0007 9.1189 9.1189 9.2074 9.2074 9.3858 9.3858 9.4472 9.4472 k = 0.4200 0.5024-0.0298 ( 12398 PWs) bands (ev): -0.7762 -0.7762 -0.7271 -0.7271 -0.1787 -0.1787 -0.1524 -0.1524 0.9075 0.9075 0.9370 0.9370 1.2847 1.2847 1.4524 1.4524 1.4763 1.4763 1.5978 1.5978 1.9962 1.9962 2.0568 2.0568 5.1303 5.1303 5.1539 5.1539 5.3162 5.3162 5.4736 5.4736 5.5445 5.5445 5.6227 5.6227 5.6299 5.6299 5.6927 5.6927 5.7258 5.7258 5.9014 5.9014 5.9294 5.9294 5.9477 5.9477 6.0210 6.0210 6.1027 6.1027 6.4054 6.4054 6.4517 6.4517 6.6254 6.6254 6.6790 6.6790 6.8410 6.8410 6.8587 6.8587 6.9474 6.9474 7.0035 7.0035 7.0559 7.0559 7.0852 7.0852 7.1471 7.1471 7.2279 7.2279 7.5114 7.5114 7.5816 7.5816 7.7606 7.7606 7.7998 7.7998 7.9843 7.9843 8.0828 8.0828 8.3314 8.3314 8.5948 8.5948 8.8946 8.8946 9.0069 9.0069 9.1207 9.1207 9.2345 9.2345 9.4087 9.4087 9.4932 9.4932 k = 0.4000 0.5024-0.0298 ( 12402 PWs) bands (ev): -0.8340 -0.8340 -0.7829 -0.7829 -0.0963 -0.0963 -0.0753 -0.0753 0.8518 0.8518 0.8902 0.8902 1.2636 1.2636 1.4004 1.4004 1.5524 1.5524 1.6409 1.6409 2.0701 2.0701 2.1363 2.1363 5.0184 5.0184 5.0534 5.0534 5.2818 5.2818 5.4406 5.4406 5.5073 5.5073 5.6014 5.6014 5.6086 5.6086 5.6722 5.6722 5.7189 5.7189 5.9193 5.9193 5.9490 5.9490 5.9603 5.9603 6.0249 6.0249 6.1208 6.1208 6.4089 6.4089 6.4294 6.4294 6.6438 6.6438 6.7143 6.7143 6.8427 6.8427 6.8672 6.8672 6.9349 6.9349 6.9981 6.9981 7.0641 7.0641 7.0939 7.0939 7.1377 7.1377 7.2352 7.2352 7.5023 7.5023 7.5821 7.5821 7.6854 7.6854 7.7773 7.7773 8.0033 8.0033 8.0244 8.0244 8.3301 8.3301 8.6094 8.6094 8.8593 8.8593 9.0107 9.0107 9.1432 9.1432 9.2787 9.2787 9.4277 9.4277 9.5423 9.5423 k = 0.3800 0.5024-0.0298 ( 12406 PWs) bands (ev): -0.8895 -0.8895 -0.8367 -0.8367 -0.0105 -0.0105 0.0034 0.0034 0.7983 0.7983 0.8465 0.8465 1.2306 1.2306 1.3474 1.3474 1.6340 1.6340 1.7007 1.7007 2.1482 2.1482 2.2190 2.2190 4.8946 4.8946 4.9382 4.9382 5.2486 5.2486 5.4055 5.4055 5.4644 5.4644 5.5678 5.5678 5.5786 5.5786 5.6585 5.6585 5.7138 5.7138 5.9303 5.9303 5.9587 5.9587 5.9870 5.9870 6.0326 6.0326 6.1346 6.1346 6.3945 6.3945 6.4089 6.4089 6.6667 6.6667 6.7384 6.7384 6.8447 6.8447 6.8844 6.8844 6.9242 6.9242 6.9891 6.9891 7.0723 7.0723 7.1013 7.1013 7.1334 7.1334 7.2430 7.2430 7.4929 7.4929 7.5779 7.5779 7.6149 7.6149 7.7576 7.7576 7.9592 7.9592 8.0231 8.0231 8.3254 8.3254 8.6165 8.6165 8.8237 8.8237 9.0176 9.0176 9.1779 9.1779 9.3339 9.3339 9.4462 9.4462 9.5982 9.5982 k = 0.3600 0.5024-0.0298 ( 12412 PWs) bands (ev): -0.9425 -0.9425 -0.8883 -0.8883 0.0784 0.0784 0.0828 0.0828 0.7472 0.7472 0.8069 0.8069 1.1925 1.1925 1.2965 1.2965 1.7184 1.7184 1.7706 1.7706 2.2297 2.2297 2.3047 2.3047 4.7626 4.7626 4.8127 4.8127 5.2161 5.2161 5.3681 5.3681 5.4160 5.4160 5.5260 5.5260 5.5436 5.5436 5.6464 5.6464 5.7058 5.7058 5.9350 5.9350 5.9749 5.9749 6.0042 6.0042 6.0479 6.0479 6.1447 6.1447 6.3600 6.3600 6.3977 6.3977 6.6902 6.6902 6.7494 6.7494 6.8455 6.8455 6.8949 6.8949 6.9290 6.9290 6.9794 6.9794 7.0755 7.0755 7.1094 7.1094 7.1367 7.1367 7.2506 7.2506 7.4825 7.4825 7.5442 7.5442 7.5765 7.5765 7.7411 7.7411 7.8943 7.8943 8.0428 8.0428 8.3176 8.3176 8.6180 8.6180 8.7902 8.7902 9.0297 9.0297 9.2177 9.2177 9.3915 9.3915 9.4697 9.4697 9.6634 9.6634 k = 0.3400 0.5024-0.0298 ( 12404 PWs) bands (ev): -0.9928 -0.9928 -0.9374 -0.9374 0.1611 0.1611 0.1705 0.1705 0.6987 0.6987 0.7730 0.7730 1.1526 1.1526 1.2481 1.2481 1.8054 1.8054 1.8472 1.8472 2.3143 2.3143 2.3930 2.3930 4.6250 4.6250 4.6801 4.6801 5.1836 5.1836 5.3266 5.3266 5.3620 5.3620 5.4812 5.4812 5.5041 5.5041 5.6324 5.6324 5.6929 5.6929 5.9374 5.9374 5.9929 5.9929 6.0117 6.0117 6.0680 6.0680 6.1502 6.1502 6.3247 6.3247 6.3838 6.3838 6.7108 6.7108 6.7520 6.7520 6.8447 6.8447 6.8863 6.8863 6.9448 6.9448 6.9817 6.9817 7.0713 7.0713 7.1201 7.1201 7.1471 7.1471 7.2564 7.2564 7.4699 7.4699 7.4893 7.4893 7.5651 7.5651 7.7276 7.7276 7.8339 7.8339 8.0636 8.0636 8.3092 8.3092 8.6157 8.6157 8.7598 8.7598 9.0467 9.0467 9.2582 9.2582 9.4371 9.4371 9.5090 9.5090 9.7378 9.7378 k = 0.3200 0.5024-0.0298 ( 12398 PWs) bands (ev): -1.0404 -1.0404 -0.9839 -0.9839 0.2363 0.2363 0.2652 0.2652 0.6528 0.6528 0.7472 0.7472 1.1130 1.1130 1.2026 1.2026 1.8947 1.8947 1.9285 1.9285 2.4016 2.4016 2.4836 2.4836 4.4834 4.4834 4.5427 4.5427 5.1509 5.1509 5.2784 5.2784 5.3027 5.3027 5.4367 5.4367 5.4607 5.4607 5.6158 5.6158 5.6734 5.6734 5.9386 5.9386 6.0106 6.0106 6.0139 6.0139 6.0836 6.0836 6.1496 6.1496 6.2966 6.2966 6.3693 6.3693 6.7264 6.7264 6.7505 6.7505 6.8412 6.8412 6.8745 6.8745 6.9427 6.9427 7.0065 7.0065 7.0632 7.0632 7.1308 7.1308 7.1623 7.1623 7.2578 7.2578 7.4378 7.4378 7.4620 7.4620 7.5521 7.5521 7.7152 7.7152 7.7835 7.7835 8.0858 8.0858 8.3022 8.3022 8.6111 8.6111 8.7332 8.7332 9.0677 9.0677 9.2977 9.2977 9.4658 9.4658 9.5645 9.5645 9.8180 9.8180 k = 0.3000 0.5024-0.0298 ( 12390 PWs) bands (ev): -1.0852 -1.0852 -1.0277 -1.0277 0.3039 0.3039 0.3627 0.3627 0.6096 0.6096 0.7335 0.7335 1.0744 1.0744 1.1602 1.1602 1.9863 1.9863 2.0137 2.0137 2.4915 2.4915 2.5763 2.5763 4.3392 4.3392 4.4023 4.4023 5.1165 5.1165 5.2206 5.2206 5.2391 5.2391 5.3953 5.3953 5.4141 5.4141 5.5961 5.5961 5.6463 5.6463 5.9388 5.9388 6.0091 6.0091 6.0292 6.0292 6.0885 6.0885 6.1411 6.1411 6.2840 6.2840 6.3568 6.3568 6.7357 6.7357 6.7477 6.7477 6.8342 6.8342 6.8626 6.8626 6.9395 6.9395 7.0311 7.0311 7.0562 7.0562 7.1402 7.1402 7.1794 7.1794 7.2527 7.2527 7.4019 7.4019 7.4501 7.4501 7.5373 7.5373 7.6978 7.6978 7.7521 7.7521 8.1097 8.1097 8.2979 8.2979 8.6045 8.6045 8.7114 8.7114 9.0919 9.0919 9.3358 9.3358 9.4883 9.4883 9.6218 9.6218 9.8983 9.8983 k = 0.2800 0.5024-0.0298 ( 12380 PWs) bands (ev): -1.1272 -1.1272 -1.0689 -1.0689 0.3573 0.3573 0.4627 0.4627 0.5691 0.5691 0.7379 0.7379 1.0376 1.0376 1.1214 1.1214 2.0800 2.0800 2.1022 2.1022 2.5835 2.5835 2.6710 2.6710 4.1935 4.1935 4.2602 4.2602 5.0762 5.0762 5.1523 5.1523 5.1748 5.1748 5.3582 5.3582 5.3653 5.3653 5.5704 5.5704 5.6133 5.6133 5.9379 5.9379 5.9970 5.9970 6.0460 6.0460 6.0844 6.0844 6.1236 6.1236 6.2897 6.2897 6.3479 6.3479 6.7370 6.7370 6.7470 6.7470 6.8235 6.8235 6.8519 6.8519 6.9411 6.9411 7.0321 7.0321 7.0683 7.0683 7.1480 7.1480 7.1947 7.1947 7.2403 7.2403 7.3775 7.3775 7.4400 7.4400 7.5213 7.5213 7.6742 7.6742 7.7421 7.7421 8.1350 8.1350 8.2967 8.2967 8.5958 8.5958 8.6953 8.6953 9.1188 9.1188 9.3733 9.3733 9.5098 9.5098 9.6732 9.6732 9.9735 9.9735 k = 0.2600 0.5024-0.0298 ( 12380 PWs) bands (ev): -1.1664 -1.1664 -1.1072 -1.1072 0.3905 0.3905 0.5305 0.5305 0.5663 0.5663 0.7659 0.7659 1.0028 1.0028 1.0873 1.0873 2.1758 2.1758 2.1936 2.1936 2.6774 2.6774 2.7672 2.7672 4.0472 4.0472 4.1175 4.1175 5.0204 5.0204 5.0744 5.0744 5.1194 5.1194 5.3125 5.3125 5.3272 5.3272 5.5294 5.5294 5.5829 5.5829 5.9359 5.9359 5.9763 5.9763 6.0589 6.0589 6.0792 6.0792 6.1004 6.1004 6.3083 6.3083 6.3429 6.3429 6.7326 6.7326 6.7477 6.7477 6.8099 6.8099 6.8437 6.8437 6.9464 6.9464 7.0196 7.0196 7.0886 7.0886 7.1541 7.1541 7.2058 7.2058 7.2232 7.2232 7.3646 7.3646 7.4308 7.4308 7.5050 7.5050 7.6547 7.6547 7.7431 7.7431 8.1613 8.1613 8.2984 8.2984 8.5852 8.5852 8.6857 8.6857 9.1483 9.1483 9.4109 9.4109 9.5321 9.5321 9.7169 9.7169 10.0413 10.0413 k = 0.2400 0.5024-0.0298 ( 12372 PWs) bands (ev): -1.2027 -1.2027 -1.1428 -1.1428 0.4031 0.4031 0.4959 0.4959 0.6712 0.6712 0.8151 0.8151 0.9703 0.9703 1.0602 1.0602 2.2733 2.2733 2.2875 2.2875 2.7727 2.7727 2.8643 2.8643 3.9016 3.9016 3.9755 3.9755 4.9436 4.9436 4.9875 4.9875 5.0793 5.0793 5.2581 5.2581 5.2991 5.2991 5.4681 5.4681 5.5599 5.5599 5.9324 5.9324 5.9516 5.9516 6.0476 6.0476 6.0770 6.0770 6.0927 6.0927 6.3325 6.3325 6.3413 6.3413 6.7270 6.7270 6.7464 6.7464 6.7952 6.7952 6.8388 6.8388 6.9537 6.9537 7.0052 7.0052 7.1059 7.1059 7.1570 7.1570 7.2027 7.2027 7.2164 7.2164 7.3606 7.3606 7.4214 7.4214 7.4891 7.4891 7.6440 7.6440 7.7491 7.7491 8.1877 8.1877 8.3028 8.3028 8.5740 8.5740 8.6820 8.6820 9.1801 9.1801 9.4493 9.4493 9.5557 9.5557 9.7539 9.7539 10.1015 10.1015 k = 0.2200 0.5024-0.0298 ( 12368 PWs) bands (ev): -1.2362 -1.2362 -1.1757 -1.1757 0.4012 0.4012 0.4636 0.4636 0.7787 0.7787 0.8716 0.8716 0.9403 0.9403 1.0483 1.0483 2.3724 2.3724 2.3838 2.3838 2.8684 2.8684 2.9610 2.9610 3.7583 3.7583 3.8357 3.8357 4.8526 4.8526 4.8928 4.8928 5.0492 5.0492 5.2002 5.2002 5.2743 5.2743 5.3911 5.3911 5.5408 5.5408 5.9224 5.9224 5.9320 5.9320 6.0115 6.0115 6.0759 6.0759 6.1056 6.1056 6.3384 6.3384 6.3616 6.3616 6.7212 6.7212 6.7429 6.7429 6.7811 6.7811 6.8367 6.8367 6.9613 6.9613 6.9909 6.9909 7.1170 7.1170 7.1554 7.1554 7.1918 7.1918 7.2220 7.2220 7.3614 7.3614 7.4116 7.4116 7.4743 7.4743 7.6417 7.6417 7.7576 7.7576 8.2128 8.2128 8.3094 8.3094 8.5645 8.5645 8.6829 8.6829 9.2139 9.2139 9.4891 9.4891 9.5811 9.5811 9.7861 9.7861 10.1543 10.1543 k = 0.2000 0.5024-0.0298 ( 12372 PWs) bands (ev): -1.2668 -1.2668 -1.2057 -1.2057 0.3913 0.3913 0.4341 0.4341 0.8850 0.8850 0.9072 0.9072 0.9168 0.9168 1.0729 1.0729 2.4726 2.4726 2.4820 2.4820 2.9627 2.9627 3.0545 3.0545 3.6206 3.6206 3.7009 3.7009 4.7531 4.7531 4.7919 4.7919 5.0237 5.0237 5.1387 5.1387 5.2522 5.2522 5.3023 5.3023 5.5238 5.5238 5.9016 5.9016 5.9225 5.9225 5.9716 5.9716 6.0759 6.0759 6.1214 6.1214 6.3372 6.3372 6.3891 6.3891 6.7160 6.7160 6.7370 6.7370 6.7694 6.7694 6.8366 6.8366 6.9655 6.9655 6.9803 6.9803 7.1171 7.1171 7.1543 7.1543 7.1881 7.1881 7.2290 7.2290 7.3622 7.3622 7.4022 7.4022 7.4613 7.4613 7.6457 7.6457 7.7674 7.7674 8.2349 8.2349 8.3177 8.3177 8.5593 8.5593 8.6868 8.6868 9.2498 9.2498 9.5303 9.5303 9.6084 9.6084 9.8156 9.8156 10.2000 10.2000 k = 0.1800 0.5024-0.0298 ( 12364 PWs) bands (ev): -1.2944 -1.2944 -1.2329 -1.2329 0.3778 0.3778 0.4073 0.4073 0.8851 0.8851 0.9089 0.9089 1.0043 1.0043 1.1428 1.1428 2.5731 2.5731 2.5817 2.5817 3.0505 3.0505 3.1346 3.1346 3.4993 3.4993 3.5771 3.5771 4.6479 4.6479 4.6859 4.6859 5.0001 5.0001 5.0737 5.0737 5.2037 5.2037 5.2331 5.2331 5.5085 5.5085 5.8823 5.8823 5.9023 5.9023 5.9422 5.9422 6.0764 6.0764 6.1376 6.1376 6.3353 6.3353 6.4156 6.4156 6.7115 6.7115 6.7293 6.7293 6.7604 6.7604 6.8380 6.8380 6.9575 6.9575 6.9824 6.9824 7.1076 7.1076 7.1584 7.1584 7.1876 7.1876 7.2381 7.2381 7.3594 7.3594 7.3949 7.3949 7.4505 7.4505 7.6540 7.6540 7.7778 7.7778 8.2522 8.2522 8.3272 8.3272 8.5604 8.5604 8.6925 8.6925 9.2874 9.2874 9.5730 9.5730 9.6379 9.6379 9.8441 9.8441 10.2398 10.2398 k = 0.1600 0.5024-0.0298 ( 12370 PWs) bands (ev): -1.3192 -1.3192 -1.2572 -1.2572 0.3632 0.3632 0.3833 0.3833 0.8630 0.8630 0.8959 0.8959 1.1191 1.1191 1.2362 1.2362 2.6718 2.6718 2.6817 2.6817 3.1170 3.1170 3.1627 3.1627 3.4338 3.4338 3.4813 3.4813 4.5386 4.5386 4.5758 4.5758 4.9704 4.9704 5.0120 5.0120 5.0986 5.0986 5.2157 5.2157 5.4946 5.4946 5.8652 5.8652 5.8661 5.8661 5.9305 5.9305 6.0770 6.0770 6.1537 6.1537 6.3323 6.3323 6.4400 6.4400 6.7077 6.7077 6.7208 6.7208 6.7537 6.7537 6.8406 6.8406 6.9455 6.9455 6.9893 6.9893 7.0963 7.0963 7.1636 7.1636 7.1878 7.1878 7.2492 7.2492 7.3522 7.3522 7.3898 7.3898 7.4423 7.4423 7.6647 7.6647 7.7880 7.7880 8.2635 8.2635 8.3373 8.3373 8.5687 8.5687 8.6992 8.6992 9.3265 9.3265 9.6170 9.6170 9.6698 9.6698 9.8725 9.8725 10.2752 10.2752 k = 0.1400 0.5024-0.0298 ( 12366 PWs) bands (ev): -1.3411 -1.3411 -1.2787 -1.2787 0.3489 0.3489 0.3621 0.3621 0.8430 0.8430 0.8797 0.8797 1.2366 1.2366 1.3400 1.3400 2.7628 2.7628 2.7780 2.7780 3.0978 3.0978 3.1287 3.1287 3.4534 3.4534 3.4689 3.4689 4.4265 4.4265 4.4627 4.4627 4.9092 4.9092 4.9783 4.9783 4.9884 4.9884 5.2005 5.2005 5.4823 5.4823 5.8259 5.8259 5.8518 5.8518 5.9246 5.9246 6.0776 6.0776 6.1695 6.1695 6.3281 6.3281 6.4617 6.4617 6.7044 6.7044 6.7131 6.7131 6.7484 6.7484 6.8440 6.8440 6.9341 6.9341 6.9964 6.9964 7.0862 7.0862 7.1676 7.1676 7.1886 7.1886 7.2615 7.2615 7.3425 7.3425 7.3853 7.3853 7.4361 7.4361 7.6764 7.6764 7.7976 7.7976 8.2690 8.2690 8.3476 8.3476 8.5838 8.5838 8.7062 8.7062 9.3665 9.3665 9.6618 9.6618 9.7042 9.7042 9.9018 9.9018 10.3068 10.3068 k = 0.1200 0.5024-0.0298 ( 12368 PWs) bands (ev): -1.3601 -1.3601 -1.2974 -1.2974 0.3357 0.3357 0.3438 0.3438 0.8256 0.8256 0.8639 0.8639 1.3565 1.3565 1.4496 1.4496 2.8233 2.8233 2.8454 2.8454 3.0156 3.0156 3.0964 3.0964 3.5050 3.5050 3.5539 3.5539 4.3126 4.3126 4.3473 4.3473 4.8283 4.8283 4.8741 4.8741 4.9610 4.9610 5.1874 5.1874 5.4715 5.4715 5.7890 5.7890 5.8402 5.8402 5.9203 5.9203 6.0781 6.0781 6.1850 6.1850 6.3227 6.3227 6.4804 6.4804 6.6999 6.6999 6.7085 6.7085 6.7440 6.7440 6.8479 6.8479 6.9237 6.9237 7.0032 7.0032 7.0781 7.0781 7.1698 7.1698 7.1906 7.1906 7.2739 7.2739 7.3327 7.3327 7.3807 7.3807 7.4311 7.4311 7.6881 7.6881 7.8063 7.8063 8.2700 8.2700 8.3575 8.3575 8.6037 8.6037 8.7128 8.7128 9.4068 9.4068 9.7070 9.7070 9.7410 9.7410 9.9323 9.9323 10.3321 10.3321 k = 0.1000 0.5024-0.0298 ( 12374 PWs) bands (ev): -1.3761 -1.3761 -1.3131 -1.3131 0.3240 0.3240 0.3282 0.3282 0.8108 0.8108 0.8499 0.8499 1.4786 1.4786 1.5632 1.5632 2.7896 2.7896 2.8024 2.8024 3.0457 3.0457 3.1135 3.1135 3.5942 3.5942 3.6527 3.6527 4.1979 4.1979 4.2303 4.2303 4.7396 4.7396 4.7576 4.7576 4.9480 4.9480 5.1763 5.1763 5.4623 5.4623 5.7568 5.7568 5.8306 5.8306 5.9169 5.9169 6.0786 6.0786 6.2000 6.2000 6.3161 6.3161 6.4958 6.4958 6.6942 6.6942 6.7071 6.7071 6.7403 6.7403 6.8522 6.8522 6.9143 6.9143 7.0099 7.0099 7.0713 7.0713 7.1700 7.1700 7.1941 7.1941 7.2850 7.2850 7.3245 7.3245 7.3764 7.3764 7.4262 7.4262 7.6990 7.6990 7.8138 7.8138 8.2679 8.2679 8.3666 8.3666 8.6261 8.6261 8.7185 8.7185 9.4462 9.4462 9.7521 9.7521 9.7800 9.7800 9.9638 9.9638 10.3372 10.3372 k = 0.0800 0.5024-0.0298 ( 12372 PWs) bands (ev): -1.3893 -1.3893 -1.3261 -1.3261 0.3141 0.3141 0.3155 0.3155 0.7986 0.7986 0.8380 0.8380 1.6028 1.6028 1.6793 1.6793 2.6676 2.6676 2.7106 2.7106 3.1408 3.1408 3.1923 3.1923 3.6975 3.6975 3.7545 3.7545 4.0845 4.0845 4.1124 4.1124 4.6372 4.6372 4.6482 4.6482 4.9378 4.9378 5.1673 5.1673 5.4547 5.4547 5.7301 5.7301 5.8230 5.8230 5.9141 5.9141 6.0790 6.0790 6.2146 6.2146 6.3084 6.3084 6.5079 6.5079 6.6887 6.6887 6.7074 6.7074 6.7372 6.7372 6.8569 6.8569 6.9060 6.9060 7.0165 7.0165 7.0655 7.0655 7.1693 7.1693 7.1985 7.1985 7.2917 7.2917 7.3208 7.3208 7.3733 7.3733 7.4205 7.4205 7.7086 7.7086 7.8201 7.8201 8.2644 8.2644 8.3747 8.3747 8.6484 8.6484 8.7230 8.7230 9.4832 9.4832 9.7967 9.7967 9.8202 9.8202 9.9954 9.9954 10.3088 10.3088 k = 0.0600 0.5024-0.0298 ( 12370 PWs) bands (ev): -1.3995 -1.3995 -1.3361 -1.3361 0.3056 0.3056 0.3064 0.3064 0.7892 0.7892 0.8286 0.8286 1.7285 1.7285 1.7965 1.7965 2.5354 2.5354 2.5963 2.5963 3.2465 3.2465 3.2933 3.2933 3.8070 3.8070 3.8469 3.8469 3.9818 3.9818 3.9945 3.9945 4.5186 4.5186 4.5509 4.5509 4.9300 4.9300 5.1603 5.1603 5.4488 5.4488 5.7093 5.7093 5.8172 5.8172 5.9119 5.9119 6.0793 6.0793 6.2287 6.2287 6.2997 6.2997 6.5170 6.5170 6.6843 6.6843 6.7082 6.7082 6.7347 6.7347 6.8617 6.8617 6.8986 6.8986 7.0230 7.0230 7.0600 7.0600 7.1681 7.1681 7.2030 7.2030 7.2914 7.2914 7.3236 7.3236 7.3722 7.3722 7.4140 7.4140 7.7166 7.7166 7.8250 7.8250 8.2606 8.2606 8.3813 8.3813 8.6689 8.6689 8.7257 8.7257 9.5156 9.5156 9.8399 9.8399 9.8600 9.8600 10.0256 10.0256 10.2626 10.2626 k = 0.0400 0.5024-0.0298 ( 12364 PWs) bands (ev): -1.4068 -1.4068 -1.3433 -1.3433 0.2985 0.2985 0.3007 0.3007 0.7824 0.7824 0.8219 0.8219 1.8552 1.8552 1.9120 1.9120 2.4025 2.4025 2.4785 2.4785 3.3542 3.3542 3.4018 3.4018 3.8300 3.8300 3.8750 3.8750 3.9219 3.9219 3.9885 3.9885 4.3994 4.3994 4.4539 4.4539 4.9245 4.9245 5.1553 5.1553 5.4446 5.4446 5.6944 5.6944 5.8131 5.8131 5.9103 5.9103 6.0795 6.0795 6.2422 6.2422 6.2901 6.2901 6.5232 6.5232 6.6811 6.6811 6.7092 6.7092 6.7329 6.7329 6.8667 6.8667 6.8919 6.8919 7.0295 7.0295 7.0544 7.0544 7.1671 7.1671 7.2071 7.2071 7.2877 7.2877 7.3287 7.3287 7.3739 7.3739 7.4066 7.4066 7.7224 7.7224 7.8284 7.8284 8.2575 8.2575 8.3862 8.3862 8.6859 8.6859 8.7265 8.7265 9.5413 9.5413 9.8796 9.8796 9.8964 9.8964 10.0518 10.0518 10.2134 10.2134 k = 0.0200 0.5024-0.0298 ( 12368 PWs) bands (ev): -1.4112 -1.4112 -1.3476 -1.3476 0.2943 0.2943 0.2973 0.2973 0.7784 0.7784 0.8178 0.8178 1.9794 1.9794 2.0171 2.0171 2.2740 2.2740 2.3710 2.3710 3.4573 3.4573 3.5118 3.5118 3.7328 3.7328 3.7615 3.7615 4.0348 4.0348 4.0727 4.0727 4.2818 4.2818 4.3643 4.3643 4.9212 4.9212 5.1522 5.1522 5.4420 5.4420 5.6855 5.6855 5.8106 5.8106 5.9094 5.9094 6.0796 6.0796 6.2548 6.2548 6.2797 6.2797 6.5268 6.5268 6.6791 6.6791 6.7100 6.7100 6.7318 6.7318 6.8717 6.8717 6.8860 6.8860 7.0358 7.0358 7.0488 7.0488 7.1663 7.1663 7.2099 7.2099 7.2845 7.2845 7.3322 7.3322 7.3781 7.3781 7.3991 7.3991 7.7261 7.7261 7.8305 7.8305 8.2554 8.2554 8.3892 8.3892 8.6982 8.6982 8.7255 8.7255 9.5578 9.5578 9.9097 9.9097 9.9249 9.9249 10.0701 10.0701 10.1732 10.1732 k = 0.0000 0.5024-0.0298 ( 12366 PWs) bands (ev): -1.4127 -1.4127 -1.3491 -1.3491 0.2929 0.2929 0.2962 0.2962 0.7770 0.7770 0.8164 0.8164 2.0635 2.0635 2.0717 2.0717 2.1884 2.1884 2.3155 2.3155 3.5187 3.5187 3.5920 3.5920 3.6714 3.6714 3.6801 3.6801 4.1185 4.1185 4.1252 4.1252 4.1918 4.1918 4.3168 4.3168 4.9201 4.9201 5.1512 5.1512 5.4412 5.4412 5.6825 5.6825 5.8098 5.8098 5.9090 5.9090 6.0797 6.0797 6.2640 6.2640 6.2713 6.2713 6.5279 6.5279 6.6785 6.6785 6.7103 6.7103 6.7314 6.7314 6.8747 6.8747 6.8827 6.8827 7.0405 7.0405 7.0443 7.0443 7.1661 7.1661 7.2109 7.2109 7.2833 7.2833 7.3334 7.3334 7.3814 7.3814 7.3949 7.3949 7.7273 7.7273 7.8312 7.8312 8.2546 8.2546 8.3902 8.3902 8.7030 8.7030 8.7244 8.7244 9.5635 9.5635 9.9210 9.9210 9.9370 9.9370 10.0767 10.0767 10.1568 10.1568 k = 0.0000 0.5024-0.0298 ( 12366 PWs) bands (ev): -1.4127 -1.4127 -1.3491 -1.3491 0.2929 0.2929 0.2962 0.2962 0.7770 0.7770 0.8164 0.8164 2.0635 2.0635 2.0717 2.0717 2.1884 2.1884 2.3155 2.3155 3.5187 3.5187 3.5920 3.5920 3.6714 3.6714 3.6801 3.6801 4.1185 4.1185 4.1252 4.1252 4.1918 4.1918 4.3168 4.3168 4.9201 4.9201 5.1512 5.1512 5.4412 5.4412 5.6825 5.6825 5.8098 5.8098 5.9090 5.9090 6.0797 6.0797 6.2640 6.2640 6.2713 6.2713 6.5279 6.5279 6.6785 6.6785 6.7103 6.7103 6.7314 6.7314 6.8747 6.8747 6.8827 6.8827 7.0405 7.0405 7.0443 7.0443 7.1661 7.1661 7.2109 7.2109 7.2833 7.2833 7.3334 7.3334 7.3814 7.3814 7.3949 7.3949 7.7273 7.7273 7.8312 7.8312 8.2546 8.2546 8.3902 8.3902 8.7030 8.7030 8.7244 8.7244 9.5635 9.5635 9.9210 9.9210 9.9370 9.9370 10.0767 10.0767 10.1568 10.1568 k = 0.0000 0.5035-0.0101 ( 12364 PWs) bands (ev): -1.4112 -1.4112 -1.3476 -1.3476 0.2237 0.2237 0.3410 0.3410 0.7503 0.7503 0.8723 0.8723 2.0648 2.0648 2.0729 2.0729 2.1897 2.1897 2.3169 2.3169 3.5038 3.5038 3.5661 3.5661 3.6734 3.6734 3.6774 3.6774 4.1179 4.1179 4.1338 4.1338 4.2162 4.2162 4.3309 4.3309 4.9023 4.9023 5.1470 5.1470 5.4365 5.4365 5.6740 5.6740 5.8062 5.8062 5.9100 5.9100 6.0942 6.0942 6.2643 6.2643 6.2795 6.2795 6.5271 6.5271 6.6789 6.6789 6.7098 6.7098 6.7328 6.7328 6.8745 6.8745 6.8826 6.8826 7.0390 7.0390 7.0420 7.0420 7.1639 7.1639 7.2100 7.2100 7.2841 7.2841 7.3338 7.3338 7.3803 7.3803 7.3978 7.3978 7.7274 7.7274 7.8281 7.8281 8.2533 8.2533 8.3946 8.3946 8.7094 8.7094 8.7269 8.7269 9.5622 9.5622 9.8978 9.8978 9.9184 9.9184 10.0826 10.0826 10.1778 10.1778 k = 0.0000 0.5047 0.0097 ( 12361 PWs) bands (ev): -1.4070 -1.4070 -1.3434 -1.3434 0.1425 0.1425 0.3449 0.3449 0.7560 0.7560 0.9586 0.9586 2.0688 2.0688 2.0767 2.0767 2.1935 2.1935 2.3208 2.3208 3.4647 3.4647 3.5111 3.5111 3.6540 3.6540 3.6703 3.6703 4.1317 4.1317 4.1633 4.1633 4.2692 4.2692 4.3694 4.3694 4.8520 4.8520 5.1305 5.1305 5.4246 5.4246 5.6541 5.6541 5.7959 5.7959 5.9122 5.9122 6.1325 6.1325 6.2656 6.2656 6.3014 6.3014 6.5244 6.5244 6.6801 6.6801 6.7087 6.7087 6.7366 6.7366 6.8735 6.8735 6.8828 6.8828 7.0318 7.0318 7.0384 7.0384 7.1575 7.1575 7.2075 7.2075 7.2859 7.2859 7.3351 7.3351 7.3779 7.3779 7.4055 7.4055 7.7279 7.7279 7.8192 7.8192 8.2492 8.2492 8.4076 8.4076 8.7281 8.7281 8.7342 8.7342 9.5570 9.5570 9.8390 9.8390 9.8835 9.8835 10.0913 10.0913 10.2215 10.2215 k = 0.0000 0.5059 0.0295 ( 12369 PWs) bands (ev): -1.3998 -1.3998 -1.3363 -1.3363 0.0574 0.0574 0.3064 0.3064 0.8080 0.8080 1.0546 1.0546 2.0753 2.0753 2.0829 2.0829 2.1999 2.1999 2.3275 2.3275 3.4111 3.4111 3.4457 3.4457 3.6188 3.6188 3.6408 3.6408 4.1696 4.1696 4.2119 4.2119 4.3340 4.3340 4.4249 4.4249 4.7762 4.7762 5.0946 5.0946 5.4112 5.4112 5.6336 5.6336 5.7805 5.7805 5.9146 5.9146 6.1840 6.1840 6.2675 6.2675 6.3319 6.3319 6.5202 6.5202 6.6820 6.6820 6.7075 6.7075 6.7419 6.7419 6.8707 6.8707 6.8833 6.8833 7.0202 7.0202 7.0343 7.0343 7.1469 7.1469 7.2038 7.2038 7.2874 7.2874 7.3372 7.3372 7.3749 7.3749 7.4169 7.4169 7.7288 7.7288 7.8050 7.8050 8.2423 8.2423 8.4290 8.4290 8.7439 8.7439 8.7595 8.7595 9.5445 9.5445 9.7689 9.7689 9.8488 9.8488 10.0915 10.0915 10.2662 10.2662 k = 0.0000 0.5071 0.0493 ( 12371 PWs) bands (ev): -1.3898 -1.3898 -1.3264 -1.3264 -0.0285 -0.0285 0.2438 0.2438 0.8886 0.8886 1.1566 1.1566 2.0845 2.0845 2.0916 2.0916 2.2089 2.2089 2.3368 2.3368 3.3497 3.3497 3.3760 3.3760 3.5713 3.5713 3.5940 3.5940 4.2246 4.2246 4.2755 4.2755 4.4042 4.4042 4.4911 4.4911 4.6829 4.6829 5.0349 5.0349 5.4014 5.4014 5.6204 5.6204 5.7614 5.7614 5.9164 5.9164 6.2393 6.2393 6.2695 6.2695 6.3655 6.3655 6.5145 6.5145 6.6842 6.6842 6.7064 6.7064 6.7482 6.7482 6.8657 6.8657 6.8826 6.8826 7.0081 7.0081 7.0287 7.0287 7.1323 7.1323 7.1992 7.1992 7.2871 7.2871 7.3403 7.3403 7.3721 7.3721 7.4307 7.4307 7.7303 7.7303 7.7866 7.7866 8.2326 8.2326 8.4584 8.4584 8.7567 8.7567 8.7998 8.7998 9.5220 9.5220 9.7007 9.7007 9.8219 9.8219 10.0814 10.0814 10.2311 10.2311 k = 0.0000 0.5082 0.0690 ( 12378 PWs) bands (ev): -1.3769 -1.3769 -1.3137 -1.3137 -0.1139 -0.1139 0.1710 0.1710 0.9842 0.9842 1.2630 1.2630 2.0963 2.0963 2.1028 2.1028 2.2203 2.2203 2.3487 2.3487 3.2848 3.2848 3.3047 3.3047 3.5159 3.5159 3.5369 3.5369 4.2852 4.2852 4.3495 4.3495 4.4745 4.4745 4.5638 4.5638 4.5836 4.5836 4.9531 4.9531 5.3970 5.3970 5.6172 5.6172 5.7398 5.7398 5.9170 5.9170 6.2703 6.2703 6.2929 6.2929 6.3978 6.3978 6.5077 6.5077 6.6865 6.6865 6.7053 6.7053 6.7550 6.7550 6.8580 6.8580 6.8781 6.8781 6.9993 6.9993 7.0222 7.0222 7.1143 7.1143 7.1936 7.1936 7.2834 7.2834 7.3443 7.3443 7.3703 7.3703 7.4457 7.4457 7.7323 7.7323 7.7654 7.7654 8.2203 8.2203 8.4946 8.4946 8.7692 8.7692 8.8473 8.8473 9.4917 9.4917 9.6424 9.6424 9.8011 9.8011 10.0671 10.0671 10.1556 10.1556 k = 0.0000 0.5094 0.0888 ( 12379 PWs) bands (ev): -1.3612 -1.3612 -1.2981 -1.2981 -0.1980 -0.1980 0.0945 0.0945 1.0881 1.0881 1.3729 1.3729 2.1107 2.1107 2.1163 2.1163 2.2343 2.2343 2.3633 2.3633 3.2187 3.2187 3.2331 3.2331 3.4560 3.4560 3.4744 3.4744 4.3230 4.3230 4.4303 4.4303 4.4863 4.4863 4.5619 4.5619 4.6403 4.6403 4.8550 4.8550 5.3974 5.3974 5.6239 5.6239 5.7167 5.7167 5.9162 5.9162 6.2704 6.2704 6.3395 6.3395 6.4255 6.4255 6.5001 6.5001 6.6883 6.6883 6.7036 6.7036 6.7615 6.7615 6.8467 6.8467 6.8692 6.8692 6.9936 6.9936 7.0169 7.0169 7.0946 7.0946 7.1870 7.1870 7.2754 7.2754 7.3495 7.3495 7.3702 7.3702 7.4608 7.4608 7.7331 7.7331 7.7447 7.7447 8.2057 8.2057 8.5353 8.5353 8.7786 8.7786 8.8980 8.8980 9.4603 9.4603 9.6007 9.6007 9.7769 9.7769 10.0603 10.0603 10.0835 10.0835 k = 0.0000 0.5106 0.1086 ( 12384 PWs) bands (ev): -1.3426 -1.3426 -1.2797 -1.2797 -0.2803 -0.2803 0.0171 0.0171 1.1975 1.1975 1.4857 1.4857 2.1277 2.1277 2.1323 2.1323 2.2508 2.2508 2.3804 2.3804 3.1527 3.1527 3.1623 3.1623 3.3939 3.3939 3.4091 3.4091 4.2639 4.2639 4.4994 4.4994 4.5158 4.5158 4.6228 4.6228 4.7184 4.7184 4.7536 4.7536 5.4013 5.4013 5.6391 5.6391 5.6933 5.6933 5.9142 5.9142 6.2677 6.2677 6.3784 6.3784 6.4460 6.4460 6.4923 6.4923 6.6884 6.6884 6.7012 6.7012 6.7671 6.7671 6.8313 6.8313 6.8588 6.8588 6.9841 6.9841 7.0144 7.0144 7.0775 7.0775 7.1786 7.1786 7.2633 7.2633 7.3558 7.3558 7.3719 7.3719 7.4752 7.4752 7.7157 7.7157 7.7426 7.7426 8.1892 8.1892 8.5769 8.5769 8.7818 8.7818 8.9477 8.9477 9.4351 9.4351 9.5812 9.5812 9.7411 9.7411 10.0203 10.0203 10.0718 10.0718 k = 0.0000 0.5118 0.1283 ( 12385 PWs) bands (ev): -1.3212 -1.3212 -1.2585 -1.2585 -0.3606 -0.3606 -0.0597 -0.0597 1.3108 1.3108 1.6011 1.6011 2.1473 2.1473 2.1506 2.1506 2.2698 2.2698 2.3999 2.3999 3.0881 3.0881 3.0927 3.0927 3.3310 3.3310 3.3424 3.3424 4.1452 4.1452 4.5636 4.5636 4.5937 4.5937 4.6036 4.6036 4.7388 4.7388 4.7964 4.7964 5.4079 5.4079 5.6612 5.6612 5.6711 5.6711 5.9113 5.9113 6.2614 6.2614 6.4094 6.4094 6.4567 6.4567 6.4850 6.4850 6.6837 6.6837 6.6995 6.6995 6.7698 6.7698 6.8170 6.8170 6.8489 6.8489 6.9675 6.9675 7.0057 7.0057 7.0729 7.0729 7.1674 7.1674 7.2486 7.2486 7.3630 7.3630 7.3753 7.3753 7.4882 7.4882 7.6924 7.6924 7.7480 7.7480 8.1714 8.1714 8.6139 8.6139 8.7767 8.7767 8.9940 8.9940 9.4206 9.4206 9.5858 9.5858 9.6953 9.6953 9.9745 9.9745 10.1018 10.1018 k = 0.0000 0.5129 0.1481 ( 12383 PWs) bands (ev): -1.2969 -1.2969 -1.2345 -1.2345 -0.4386 -0.4386 -0.1351 -0.1351 1.4271 1.4271 1.7188 1.7188 2.1695 2.1695 2.1711 2.1711 2.2913 2.2913 2.4217 2.4217 3.0246 3.0246 3.0257 3.0257 3.2683 3.2683 3.2750 3.2750 4.0128 4.0128 4.4737 4.4737 4.6393 4.6393 4.6925 4.6925 4.8074 4.8074 4.8726 4.8726 5.4168 5.4168 5.6497 5.6497 5.6906 5.6906 5.9076 5.9076 6.2501 6.2501 6.4333 6.4333 6.4557 6.4557 6.4783 6.4783 6.6723 6.6723 6.6992 6.6992 6.7679 6.7679 6.8103 6.8103 6.8395 6.8395 6.9436 6.9436 6.9864 6.9864 7.0819 7.0819 7.1517 7.1517 7.2338 7.2338 7.3702 7.3702 7.3803 7.3803 7.4996 7.4996 7.6698 7.6698 7.7551 7.7551 8.1527 8.1527 8.6401 8.6401 8.7627 8.7627 9.0380 9.0380 9.4159 9.4159 9.6092 9.6092 9.6486 9.6486 9.9556 9.9556 10.1464 10.1464 k = 0.0000 0.5141 0.1679 ( 12382 PWs) bands (ev): -1.2698 -1.2698 -1.2077 -1.2077 -0.5143 -0.5143 -0.2086 -0.2086 1.5456 1.5456 1.8383 1.8383 2.1936 2.1936 2.1945 2.1945 2.3152 2.3152 2.4455 2.4455 2.9585 2.9585 2.9666 2.9666 3.2060 3.2060 3.2078 3.2078 3.8760 3.8760 4.3430 4.3430 4.7138 4.7138 4.7810 4.7810 4.8841 4.8841 4.9451 4.9451 5.4276 5.4276 5.6328 5.6328 5.7242 5.7242 5.9038 5.9038 6.2327 6.2327 6.4409 6.4409 6.4523 6.4523 6.4714 6.4714 6.6577 6.6577 6.6992 6.6992 6.7636 6.7636 6.8107 6.8107 6.8305 6.8305 6.9131 6.9131 6.9635 6.9635 7.0940 7.0940 7.1324 7.1324 7.2213 7.2213 7.3768 7.3768 7.3871 7.3871 7.5097 7.5097 7.6489 7.6489 7.7635 7.7635 8.1335 8.1335 8.6520 8.6520 8.7414 8.7414 9.0812 9.0812 9.4127 9.4127 9.6131 9.6131 9.6421 9.6421 9.9749 9.9749 10.2012 10.2012 k = 0.0000 0.5153 0.1877 ( 12378 PWs) bands (ev): -1.2399 -1.2399 -1.1781 -1.1781 -0.5875 -0.5875 -0.2801 -0.2801 1.6658 1.6658 1.9592 1.9592 2.2183 2.2183 2.2220 2.2220 2.3414 2.3414 2.4705 2.4705 2.8946 2.8946 2.9121 2.9121 3.1391 3.1391 3.1463 3.1463 3.7379 3.7379 4.2079 4.2079 4.7858 4.7858 4.8667 4.8667 4.9621 4.9621 5.0124 5.0124 5.4405 5.4405 5.6216 5.6216 5.7615 5.7615 5.9004 5.9004 6.2086 6.2086 6.4128 6.4128 6.4632 6.4632 6.4678 6.4678 6.6439 6.6439 6.6988 6.6988 6.7601 6.7601 6.8110 6.8110 6.8223 6.8223 6.8802 6.8802 6.9399 6.9399 7.0888 7.0888 7.1250 7.1250 7.2119 7.2119 7.3825 7.3825 7.3948 7.3948 7.5186 7.5186 7.6299 7.6299 7.7730 7.7730 8.1141 8.1141 8.6503 8.6503 8.7157 8.7157 9.1209 9.1209 9.3968 9.3968 9.6068 9.6068 9.6777 9.6777 10.0347 10.0347 10.2628 10.2628 k = 0.0000 0.5165 0.2074 ( 12390 PWs) bands (ev): -1.2071 -1.2071 -1.1456 -1.1456 -0.6582 -0.6582 -0.3494 -0.3494 1.7871 1.7871 2.0807 2.0807 2.2445 2.2445 2.2525 2.2525 2.3700 2.3700 2.4954 2.4954 2.8332 2.8332 2.8645 2.8645 3.0705 3.0705 3.0876 3.0876 3.6007 3.6007 4.0707 4.0707 4.8536 4.8536 4.9458 4.9458 5.0393 5.0393 5.0738 5.0738 5.4556 5.4556 5.6181 5.6181 5.8010 5.8010 5.8983 5.8983 6.1778 6.1778 6.3709 6.3709 6.4604 6.4604 6.4766 6.4766 6.6324 6.6324 6.6978 6.6978 6.7573 6.7573 6.8020 6.8020 6.8125 6.8125 6.8567 6.8567 6.9154 6.9154 7.0613 7.0613 7.1354 7.1354 7.2050 7.2050 7.3878 7.3878 7.4024 7.4024 7.5268 7.5268 7.6130 7.6130 7.7833 7.7833 8.0948 8.0948 8.6391 8.6391 8.6884 8.6884 9.1511 9.1511 9.3641 9.3641 9.6314 9.6314 9.7245 9.7245 10.1229 10.1229 10.3284 10.3284 k = 0.0000 0.5176 0.2272 ( 12384 PWs) bands (ev): -1.1715 -1.1715 -1.1104 -1.1104 -0.7264 -0.7264 -0.4163 -0.4163 1.9083 1.9083 2.2011 2.2011 2.2721 2.2721 2.2869 2.2869 2.4008 2.4008 2.5174 2.5174 2.7746 2.7746 2.8279 2.8279 3.0006 3.0006 3.0313 3.0313 3.4663 3.4663 3.9325 3.9325 4.9165 4.9165 5.0112 5.0112 5.1136 5.1136 5.1317 5.1317 5.4732 5.4732 5.6237 5.6237 5.8407 5.8407 5.8987 5.8987 6.1412 6.1412 6.3202 6.3202 6.4580 6.4580 6.4839 6.4839 6.6222 6.6222 6.6964 6.6964 6.7519 6.7519 6.7796 6.7796 6.7989 6.7989 6.8518 6.8518 6.8916 6.8916 7.0300 7.0300 7.1472 7.1472 7.1996 7.1996 7.3930 7.3930 7.4090 7.4090 7.5346 7.5346 7.5981 7.5981 7.7943 7.7943 8.0757 8.0757 8.6232 8.6232 8.6620 8.6620 9.1684 9.1684 9.3236 9.3236 9.6772 9.6772 9.7889 9.7889 10.2167 10.2167 10.3943 10.3943 k = 0.0000 0.5188 0.2470 ( 12391 PWs) bands (ev): -1.1331 -1.1331 -1.0724 -1.0724 -0.7919 -0.7919 -0.4806 -0.4806 2.0279 2.0279 2.2991 2.2991 2.3051 2.3051 2.3397 2.3397 2.4337 2.4337 2.5325 2.5325 2.7192 2.7192 2.8090 2.8090 2.9281 2.9281 2.9782 2.9782 3.3369 3.3369 3.7942 3.7942 4.9743 4.9743 5.0544 5.0544 5.1821 5.1821 5.1908 5.1908 5.4940 5.4940 5.6375 5.6375 5.8779 5.8779 5.9033 5.9033 6.1011 6.1011 6.2658 6.2658 6.4567 6.4567 6.4878 6.4878 6.6119 6.6119 6.6946 6.6946 6.7327 6.7327 6.7646 6.7646 6.7832 6.7832 6.8472 6.8472 6.8779 6.8779 7.0004 7.0004 7.1578 7.1578 7.1951 7.1951 7.3980 7.3980 7.4142 7.4142 7.5425 7.5425 7.5851 7.5851 7.8057 7.8057 8.0569 8.0569 8.6060 8.6060 8.6383 8.6383 9.1744 9.1744 9.2827 9.2827 9.7350 9.7350 9.8693 9.8693 10.2652 10.2652 10.4129 10.4129 k = 0.0000 0.5200 0.2668 ( 12374 PWs) bands (ev): -1.0919 -1.0919 -1.0317 -1.0317 -0.8548 -0.8548 -0.5425 -0.5425 2.1430 2.1430 2.3271 2.3271 2.3540 2.3540 2.4408 2.4408 2.4685 2.4685 2.5409 2.5409 2.6676 2.6676 2.8140 2.8140 2.8518 2.8518 2.9306 2.9306 3.2152 3.2152 3.6566 3.6566 5.0266 5.0266 5.0738 5.0738 5.2409 5.2409 5.2504 5.2504 5.5185 5.5185 5.6554 5.6554 5.9086 5.9086 5.9149 5.9149 6.0613 6.0613 6.2126 6.2126 6.4564 6.4564 6.4868 6.4868 6.6025 6.6025 6.6919 6.6919 6.7085 6.7085 6.7494 6.7494 6.7708 6.7708 6.8337 6.8337 6.8816 6.8816 6.9742 6.9742 7.1667 7.1667 7.1909 7.1909 7.4029 7.4029 7.4180 7.4180 7.5505 7.5505 7.5737 7.5737 7.8174 7.8174 8.0382 8.0382 8.5901 8.5901 8.6185 8.6185 9.1740 9.1740 9.2452 9.2452 9.7998 9.7998 9.9585 9.9585 10.2333 10.2333 10.4690 10.4690 k = 0.0000 0.5212 0.2865 ( 12374 PWs) bands (ev): -1.0479 -1.0479 -0.9882 -0.9882 -0.9150 -0.9150 -0.6018 -0.6018 2.2467 2.2467 2.3511 2.3511 2.3994 2.3994 2.4969 2.4969 2.5044 2.5044 2.5881 2.5881 2.6202 2.6202 2.7713 2.7713 2.8341 2.8341 2.9027 2.9027 3.1043 3.1043 3.5207 3.5207 5.0731 5.0731 5.0752 5.0752 5.2856 5.2856 5.3029 5.3029 5.5467 5.5467 5.6710 5.6710 5.9293 5.9293 5.9349 5.9349 6.0276 6.0276 6.1649 6.1649 6.4569 6.4569 6.4781 6.4781 6.5986 6.5986 6.6851 6.6851 6.6908 6.6908 6.7222 6.7222 6.7688 6.7688 6.8223 6.8223 6.8918 6.8918 6.9516 6.9516 7.1741 7.1741 7.1867 7.1867 7.4075 7.4075 7.4202 7.4202 7.5586 7.5586 7.5640 7.5640 7.8294 7.8294 8.0197 8.0197 8.5770 8.5770 8.6033 8.6033 9.1717 9.1717 9.2128 9.2128 9.8683 9.8683 10.0482 10.0482 10.1691 10.1691 10.4671 10.4671 k = 0.0000 0.5223 0.3063 ( 12360 PWs) bands (ev): -1.0011 -1.0011 -0.9725 -0.9725 -0.9419 -0.9419 -0.6584 -0.6584 2.3230 2.3230 2.3674 2.3674 2.4499 2.4499 2.5034 2.5034 2.5361 2.5361 2.5773 2.5773 2.6813 2.6813 2.6933 2.6933 2.8249 2.8249 2.9432 2.9432 3.0062 3.0062 3.3877 3.3877 5.0632 5.0632 5.1146 5.1146 5.3124 5.3124 5.3401 5.3401 5.5761 5.5761 5.6780 5.6780 5.9480 5.9480 5.9529 5.9529 6.0096 6.0096 6.1248 6.1248 6.4585 6.4585 6.4631 6.4631 6.6046 6.6046 6.6623 6.6623 6.6803 6.6803 6.7073 6.7073 6.7694 6.7694 6.8144 6.8144 6.9043 6.9043 6.9322 6.9322 7.1794 7.1794 7.1829 7.1829 7.4118 7.4118 7.4209 7.4209 7.5542 7.5542 7.5683 7.5683 7.8415 7.8415 8.0012 8.0012 8.5675 8.5675 8.5931 8.5931 9.1710 9.1710 9.1860 9.1860 9.9380 9.9380 10.0919 10.0919 10.1337 10.1337 10.4400 10.4400 k = 0.5000 0.4824 0.3660 ( 12410 PWs) bands (ev): -0.2095 -0.2095 -0.2093 -0.2093 -0.0972 -0.0972 -0.0966 -0.0966 0.0282 0.0282 0.0285 0.0285 0.3243 0.3243 0.3252 0.3252 3.2802 3.2802 3.2809 3.2809 3.5585 3.5585 3.5590 3.5590 3.6549 3.6549 3.6562 3.6562 4.1300 4.1300 4.1317 4.1317 5.4339 5.4339 5.4375 5.4375 5.6122 5.6122 5.6154 5.6154 5.9076 5.9076 5.9156 5.9156 5.9806 5.9806 5.9937 5.9937 6.2409 6.2409 6.2476 6.2476 6.4286 6.4286 6.4344 6.4344 6.4635 6.4635 6.4646 6.4646 6.7635 6.7635 6.7854 6.7854 6.9497 6.9497 6.9878 6.9878 7.1039 7.1039 7.1430 7.1430 7.1622 7.1622 7.1778 7.1778 7.3542 7.3542 7.3905 7.3905 7.6352 7.6352 7.6473 7.6473 7.7311 7.7311 7.7476 7.7476 8.8470 8.8470 8.8583 8.8583 9.1387 9.1387 9.1414 9.1414 9.4298 9.4298 9.4414 9.4414 9.8586 9.8586 9.8711 9.8711 k = 0.5000 0.4623 0.3660 ( 12400 PWs) bands (ev): -0.2497 -0.2497 -0.2497 -0.2497 -0.1184 -0.1184 -0.1177 -0.1177 0.0486 0.0486 0.0489 0.0489 0.3818 0.3818 0.3825 0.3825 3.3219 3.3219 3.3228 3.3228 3.5069 3.5069 3.5074 3.5074 3.6200 3.6200 3.6215 3.6215 4.1842 4.1842 4.1859 4.1859 5.4007 5.4007 5.4040 5.4040 5.5949 5.5949 5.5977 5.5977 5.8909 5.8909 5.8969 5.8969 5.9909 5.9909 6.0051 6.0051 6.2237 6.2237 6.2309 6.2309 6.4272 6.4272 6.4309 6.4309 6.4759 6.4759 6.4782 6.4782 6.7701 6.7701 6.7919 6.7919 6.9488 6.9488 6.9864 6.9864 7.1086 7.1086 7.1474 7.1474 7.1626 7.1626 7.1783 7.1783 7.3505 7.3505 7.3859 7.3859 7.6292 7.6292 7.6439 7.6439 7.7321 7.7321 7.7461 7.7461 8.8702 8.8702 8.8810 8.8810 9.1523 9.1523 9.1548 9.1548 9.4614 9.4614 9.4728 9.4728 9.8693 9.8693 9.8817 9.8817 k = 0.5000 0.4422 0.3660 ( 12410 PWs) bands (ev): -0.3049 -0.3049 -0.3048 -0.3048 -0.1598 -0.1598 -0.1592 -0.1592 0.1050 0.1050 0.1051 0.1051 0.4494 0.4494 0.4502 0.4502 3.3403 3.3403 3.3410 3.3410 3.4621 3.4621 3.4628 3.4628 3.6066 3.6066 3.6082 3.6082 4.2406 4.2406 4.2422 4.2422 5.3491 5.3491 5.3520 5.3520 5.5608 5.5608 5.5631 5.5631 5.8697 5.8697 5.8744 5.8744 6.0004 6.0004 6.0145 6.0145 6.2022 6.2022 6.2094 6.2094 6.4242 6.4242 6.4273 6.4273 6.4960 6.4960 6.4981 6.4981 6.7791 6.7791 6.8009 6.8009 6.9471 6.9471 6.9837 6.9837 7.1131 7.1131 7.1499 7.1499 7.1665 7.1665 7.1840 7.1840 7.3459 7.3459 7.3799 7.3799 7.6185 7.6185 7.6359 7.6359 7.7383 7.7383 7.7495 7.7495 8.8992 8.8992 8.9096 8.9096 9.1733 9.1733 9.1756 9.1756 9.5056 9.5056 9.5167 9.5167 9.8889 9.8889 9.9012 9.9012 k = 0.5000 0.4221 0.3660 ( 12408 PWs) bands (ev): -0.3624 -0.3624 -0.3623 -0.3623 -0.2097 -0.2097 -0.2092 -0.2092 0.1768 0.1768 0.1768 0.1768 0.5235 0.5235 0.5242 0.5242 3.3255 3.3255 3.3259 3.3259 3.4238 3.4238 3.4246 3.4246 3.6257 3.6257 3.6271 3.6271 4.2979 4.2979 4.2995 4.2995 5.2827 5.2827 5.2851 5.2851 5.5082 5.5082 5.5101 5.5101 5.8478 5.8478 5.8516 5.8516 6.0037 6.0037 6.0163 6.0163 6.1837 6.1837 6.1897 6.1897 6.4236 6.4236 6.4266 6.4266 6.5176 6.5176 6.5190 6.5190 6.7894 6.7894 6.8110 6.8110 6.9446 6.9446 6.9800 6.9800 7.1171 7.1171 7.1512 7.1512 7.1738 7.1738 7.1936 7.1936 7.3410 7.3410 7.3730 7.3730 7.6044 7.6044 7.6235 7.6235 7.7493 7.7493 7.7584 7.7584 8.9299 8.9299 8.9397 8.9397 9.2009 9.2009 9.2030 9.2030 9.5589 9.5589 9.5696 9.5696 9.9183 9.9183 9.9302 9.9302 k = 0.5000 0.4020 0.3660 ( 12402 PWs) bands (ev): -0.4192 -0.4192 -0.4191 -0.4191 -0.2615 -0.2615 -0.2612 -0.2612 0.2559 0.2559 0.2560 0.2560 0.6023 0.6023 0.6030 0.6030 3.2890 3.2890 3.2891 3.2891 3.3861 3.3861 3.3867 3.3867 3.6719 3.6719 3.6729 3.6729 4.3548 4.3548 4.3564 4.3564 5.2046 5.2046 5.2066 5.2066 5.4381 5.4381 5.4397 5.4397 5.8265 5.8265 5.8297 5.8297 5.9958 5.9958 6.0052 6.0052 6.1756 6.1756 6.1790 6.1790 6.4255 6.4255 6.4286 6.4286 6.5382 6.5382 6.5391 6.5391 6.8000 6.8000 6.8211 6.8211 6.9413 6.9413 6.9751 6.9751 7.1202 7.1202 7.1522 7.1522 7.1836 7.1836 7.2052 7.2052 7.3363 7.3363 7.3655 7.3655 7.5890 7.5890 7.6089 7.6089 7.7639 7.7639 7.7715 7.7715 8.9578 8.9578 8.9669 8.9669 9.2339 9.2339 9.2358 9.2358 9.6152 9.6152 9.6253 9.6253 9.9582 9.9582 9.9695 9.9695 k = 0.5000 0.3819 0.3660 ( 12408 PWs) bands (ev): -0.4742 -0.4742 -0.4740 -0.4740 -0.3129 -0.3129 -0.3126 -0.3126 0.3398 0.3398 0.3399 0.3399 0.6850 0.6850 0.6856 0.6856 3.2449 3.2449 3.2450 3.2450 3.3469 3.3469 3.3473 3.3473 3.7330 3.7330 3.7338 3.7338 4.4093 4.4093 4.4109 4.4109 5.1182 5.1182 5.1197 5.1197 5.3533 5.3533 5.3548 5.3548 5.8058 5.8058 5.8087 5.8087 5.9756 5.9756 5.9815 5.9815 6.1797 6.1797 6.1798 6.1798 6.4290 6.4290 6.4323 6.4323 6.5565 6.5565 6.5571 6.5571 6.8103 6.8103 6.8307 6.8307 6.9370 6.9370 6.9692 6.9692 7.1224 7.1224 7.1533 7.1533 7.1949 7.1949 7.2173 7.2173 7.3325 7.3325 7.3580 7.3580 7.5745 7.5745 7.5942 7.5942 7.7806 7.7806 7.7873 7.7873 8.9788 8.9788 8.9871 8.9871 9.2701 9.2701 9.2718 9.2718 9.6661 9.6661 9.6754 9.6754 10.0092 10.0092 10.0194 10.0194 k = 0.5000 0.3618 0.3660 ( 12406 PWs) bands (ev): -0.5268 -0.5268 -0.5267 -0.5267 -0.3628 -0.3628 -0.3625 -0.3625 0.4274 0.4274 0.4276 0.4276 0.7710 0.7710 0.7716 0.7716 3.1993 3.1993 3.1994 3.1994 3.3072 3.3072 3.3076 3.3076 3.8021 3.8021 3.8027 3.8027 4.4577 4.4577 4.4594 4.4594 5.0278 5.0278 5.0290 5.0290 5.2572 5.2572 5.2588 5.2588 5.7851 5.7851 5.7879 5.7879 5.9477 5.9477 5.9508 5.9508 6.1890 6.1890 6.1914 6.1914 6.4336 6.4336 6.4370 6.4370 6.5721 6.5721 6.5728 6.5728 6.8199 6.8199 6.8391 6.8391 6.9319 6.9319 6.9624 6.9624 7.1235 7.1235 7.1541 7.1541 7.2060 7.2060 7.2288 7.2288 7.3304 7.3304 7.3512 7.3512 7.5626 7.5626 7.5810 7.5810 7.7984 7.7984 7.8045 7.8045 8.9897 8.9897 8.9969 8.9969 9.3063 9.3063 9.3076 9.3076 9.7038 9.7038 9.7120 9.7120 10.0705 10.0705 10.0788 10.0788 k = 0.5000 0.3417 0.3660 ( 12396 PWs) bands (ev): -0.5770 -0.5770 -0.5769 -0.5769 -0.4108 -0.4108 -0.4105 -0.4105 0.5183 0.5183 0.5185 0.5185 0.8602 0.8602 0.8608 0.8608 3.1543 3.1543 3.1544 3.1544 3.2682 3.2682 3.2685 3.2685 3.8760 3.8760 3.8764 3.8764 4.4925 4.4925 4.4941 4.4941 4.9409 4.9409 4.9416 4.9416 5.1541 5.1541 5.1559 5.1559 5.7639 5.7639 5.7667 5.7667 5.9173 5.9173 5.9185 5.9185 6.2021 6.2021 6.2060 6.2060 6.4388 6.4388 6.4422 6.4422 6.5851 6.5851 6.5862 6.5862 6.8283 6.8283 6.8463 6.8463 6.9261 6.9261 6.9548 6.9548 7.1232 7.1232 7.1542 7.1542 7.2154 7.2154 7.2381 7.2381 7.3311 7.3311 7.3463 7.3463 7.5542 7.5542 7.5705 7.5705 7.8166 7.8166 7.8223 7.8223 8.9874 8.9874 8.9933 8.9933 9.3394 9.3394 9.3399 9.3399 9.7270 9.7270 9.7337 9.7337 10.1347 10.1347 10.1402 10.1402 k = 0.5000 0.3216 0.3660 ( 12392 PWs) bands (ev): -0.6246 -0.6246 -0.6244 -0.6244 -0.4564 -0.4564 -0.4562 -0.4562 0.6122 0.6122 0.6124 0.6124 0.9522 0.9522 0.9528 0.9528 3.1108 3.1108 3.1110 3.1110 3.2305 3.2305 3.2307 3.2307 3.9529 3.9529 3.9532 3.9532 4.4990 4.4990 4.5004 4.5004 4.8681 4.8681 4.8684 4.8684 5.0513 5.0513 5.0535 5.0535 5.7419 5.7419 5.7447 5.7447 5.8877 5.8877 5.8878 5.8878 6.2155 6.2155 6.2205 6.2205 6.4441 6.4441 6.4476 6.4476 6.5959 6.5959 6.5975 6.5975 6.8354 6.8354 6.8519 6.8519 6.9196 6.9196 6.9466 6.9466 7.1214 7.1214 7.1531 7.1531 7.2218 7.2218 7.2436 7.2436 7.3356 7.3356 7.3449 7.3449 7.5501 7.5501 7.5635 7.5635 7.8347 7.8347 7.8400 7.8400 8.9694 8.9694 8.9738 8.9738 9.3674 9.3674 9.3681 9.3681 9.7420 9.7420 9.7473 9.7473 10.1674 10.1674 10.1690 10.1690 k = 0.5000 0.3015 0.3660 ( 12390 PWs) bands (ev): -0.6694 -0.6694 -0.6693 -0.6693 -0.4996 -0.4996 -0.4994 -0.4994 0.7089 0.7089 0.7092 0.7092 1.0470 1.0470 1.0476 1.0476 3.0694 3.0694 3.0695 3.0695 3.1944 3.1944 3.1945 3.1945 4.0318 4.0318 4.0320 4.0320 4.4606 4.4606 4.4614 4.4614 4.8069 4.8069 4.8083 4.8083 4.9703 4.9703 4.9729 4.9729 5.7189 5.7189 5.7217 5.7217 5.8603 5.8603 5.8610 5.8610 6.2272 6.2272 6.2330 6.2330 6.4495 6.4495 6.4529 6.4529 6.6048 6.6048 6.6073 6.6073 6.8409 6.8409 6.8557 6.8557 6.9127 6.9127 6.9379 6.9379 7.1177 7.1177 7.1504 7.1504 7.2243 7.2243 7.2442 7.2442 7.3443 7.3443 7.3481 7.3481 7.5505 7.5505 7.5603 7.5603 7.8521 7.8521 7.8572 7.8572 8.9341 8.9341 8.9370 8.9370 9.3909 9.3909 9.3931 9.3931 9.7575 9.7575 9.7612 9.7612 10.1259 10.1259 10.1262 10.1262 k = 0.5000 0.2814 0.3660 ( 12382 PWs) bands (ev): -0.7115 -0.7115 -0.7114 -0.7114 -0.5402 -0.5402 -0.5400 -0.5400 0.8084 0.8084 0.8086 0.8086 1.1445 1.1445 1.1451 1.1451 3.0300 3.0300 3.0302 3.0302 3.1601 3.1601 3.1603 3.1603 4.1112 4.1112 4.1113 4.1113 4.3804 4.3804 4.3809 4.3809 4.7213 4.7213 4.7225 4.7225 4.9489 4.9489 4.9508 4.9508 5.6951 5.6951 5.6978 5.6978 5.8366 5.8366 5.8378 5.8378 6.2358 6.2358 6.2420 6.2420 6.4548 6.4548 6.4581 6.4581 6.6126 6.6126 6.6160 6.6160 6.8446 6.8446 6.8577 6.8577 6.9054 6.9054 6.9289 6.9289 7.1124 7.1124 7.1459 7.1459 7.2233 7.2233 7.2402 7.2402 7.3556 7.3556 7.3563 7.3563 7.5553 7.5553 7.5612 7.5612 7.8686 7.8686 7.8737 7.8737 8.8824 8.8824 8.8840 8.8840 9.4132 9.4132 9.4166 9.4166 9.7769 9.7769 9.7793 9.7793 10.0505 10.0505 10.0508 10.0508 k = 0.5000 0.2613 0.3660 ( 12368 PWs) bands (ev): -0.7507 -0.7507 -0.7506 -0.7506 -0.5782 -0.5782 -0.5780 -0.5780 0.9104 0.9104 0.9107 0.9107 1.2445 1.2445 1.2450 1.2450 2.9929 2.9929 2.9931 2.9931 3.1278 3.1278 3.1280 3.1280 4.1812 4.1812 4.1818 4.1818 4.2842 4.2842 4.2850 4.2850 4.6071 4.6071 4.6077 4.6077 4.9752 4.9752 4.9761 4.9761 5.6709 5.6709 5.6734 5.6734 5.8170 5.8170 5.8183 5.8183 6.2402 6.2402 6.2466 6.2466 6.4601 6.4601 6.4634 6.4634 6.6195 6.6195 6.6239 6.6239 6.8462 6.8462 6.8577 6.8577 6.8979 6.8979 6.9196 6.9196 7.1055 7.1055 7.1396 7.1396 7.2198 7.2198 7.2333 7.2333 7.3659 7.3659 7.3703 7.3703 7.5643 7.5643 7.5663 7.5663 7.8840 7.8840 7.8891 7.8891 8.8175 8.8175 8.8181 8.8181 9.4357 9.4357 9.4401 9.4401 9.7967 9.7967 9.7983 9.7983 9.9753 9.9753 9.9759 9.9759 k = 0.5000 0.2412 0.3660 ( 12358 PWs) bands (ev): -0.7871 -0.7871 -0.7870 -0.7870 -0.6135 -0.6135 -0.6133 -0.6133 1.0149 1.0149 1.0152 1.0152 1.3469 1.3469 1.3474 1.3474 2.9582 2.9582 2.9583 2.9583 3.0976 3.0976 3.0978 3.0978 4.1334 4.1334 4.1343 4.1343 4.2926 4.2926 4.2935 4.2935 4.4822 4.4822 4.4823 4.4823 5.0204 5.0204 5.0208 5.0208 5.6467 5.6467 5.6490 5.6490 5.8010 5.8010 5.8023 5.8023 6.2398 6.2398 6.2462 6.2462 6.4655 6.4655 6.4687 6.4687 6.6259 6.6259 6.6313 6.6313 6.8455 6.8455 6.8555 6.8555 6.8905 6.8905 6.9103 6.9103 7.0976 7.0976 7.1318 7.1318 7.2146 7.2146 7.2250 7.2250 7.3775 7.3775 7.3852 7.3852 7.5754 7.5754 7.5771 7.5771 7.8981 7.8981 7.9032 7.9032 8.7434 8.7434 8.7435 8.7435 9.4580 9.4580 9.4626 9.4626 9.7982 9.7982 9.8001 9.8001 9.9283 9.9283 9.9296 9.9296 k = 0.5000 0.2211 0.3660 ( 12364 PWs) bands (ev): -0.8207 -0.8207 -0.8206 -0.8206 -0.6461 -0.6461 -0.6459 -0.6459 1.1219 1.1219 1.1222 1.1222 1.4516 1.4516 1.4521 1.4521 2.9257 2.9257 2.9259 2.9259 3.0694 3.0694 3.0696 3.0696 4.0108 4.0108 4.0115 4.0115 4.3302 4.3302 4.3311 4.3311 4.3916 4.3916 4.3922 4.3922 5.0723 5.0723 5.0724 5.0724 5.6229 5.6229 5.6250 5.6250 5.7884 5.7884 5.7895 5.7895 6.2347 6.2347 6.2408 6.2408 6.4709 6.4709 6.4740 6.4740 6.6318 6.6318 6.6380 6.6380 6.8424 6.8424 6.8510 6.8510 6.8833 6.8833 6.9010 6.9010 7.0892 7.0892 7.1230 7.1230 7.2083 7.2083 7.2163 7.2163 7.3892 7.3892 7.3997 7.3997 7.5882 7.5882 7.5933 7.5933 7.9108 7.9108 7.9159 7.9159 8.6639 8.6639 8.6645 8.6645 9.4759 9.4759 9.4802 9.4802 9.7625 9.7625 9.7654 9.7654 9.9354 9.9354 9.9374 9.9374 k = 0.5000 0.2010 0.3660 ( 12370 PWs) bands (ev): -0.8514 -0.8514 -0.8513 -0.8513 -0.6758 -0.6758 -0.6757 -0.6757 1.2313 1.2313 1.2316 1.2316 1.5584 1.5584 1.5590 1.5590 2.8956 2.8956 2.8957 2.8957 3.0432 3.0432 3.0435 3.0435 3.8801 3.8801 3.8808 3.8808 4.2087 4.2087 4.2089 4.2089 4.4632 4.4632 4.4634 4.4634 5.1256 5.1256 5.1258 5.1258 5.5999 5.5999 5.6017 5.6017 5.7786 5.7786 5.7795 5.7795 6.2254 6.2254 6.2312 6.2312 6.4761 6.4761 6.4792 6.4792 6.6372 6.6372 6.6442 6.6442 6.8368 6.8368 6.8441 6.8441 6.8764 6.8764 6.8920 6.8920 7.0808 7.0808 7.1136 7.1136 7.2014 7.2014 7.2076 7.2076 7.4003 7.4003 7.4133 7.4133 7.6044 7.6044 7.6123 7.6123 7.9221 7.9221 7.9272 7.9272 8.5828 8.5828 8.5838 8.5838 9.4807 9.4807 9.4837 9.4837 9.7235 9.7235 9.7279 9.7279 9.9726 9.9726 9.9752 9.9752 k = 0.5000 0.1809 0.3660 ( 12358 PWs) bands (ev): -0.8792 -0.8792 -0.8791 -0.8791 -0.7029 -0.7029 -0.7027 -0.7027 1.3429 1.3429 1.3432 1.3432 1.6673 1.6673 1.6678 1.6678 2.8675 2.8675 2.8676 2.8676 3.0190 3.0190 3.0194 3.0194 3.7469 3.7469 3.7476 3.7476 4.0746 4.0746 4.0747 4.0747 4.5470 4.5470 4.5473 4.5473 5.1774 5.1774 5.1777 5.1777 5.5778 5.5778 5.5795 5.5795 5.7711 5.7711 5.7716 5.7716 6.2132 6.2132 6.2184 6.2184 6.4806 6.4806 6.4838 6.4838 6.6416 6.6416 6.6493 6.6493 6.8291 6.8291 6.8352 6.8352 6.8700 6.8700 6.8835 6.8835 7.0729 7.0729 7.1044 7.1044 7.1941 7.1941 7.1994 7.1994 7.4104 7.4104 7.4256 7.4256 7.6234 7.6234 7.6336 7.6336 7.9318 7.9318 7.9369 7.9369 8.5026 8.5026 8.5040 8.5040 9.4619 9.4619 9.4634 9.4634 9.7101 9.7101 9.7161 9.7161 10.0216 10.0216 10.0246 10.0246 k = 0.5000 0.1608 0.3660 ( 12358 PWs) bands (ev): -0.9041 -0.9041 -0.9040 -0.9040 -0.7271 -0.7271 -0.7269 -0.7269 1.4566 1.4566 1.4570 1.4570 1.7780 1.7780 1.7785 1.7785 2.8414 2.8414 2.8415 2.8415 2.9965 2.9965 2.9970 2.9970 3.6133 3.6133 3.6141 3.6141 3.9396 3.9396 3.9398 3.9398 4.6314 4.6314 4.6318 4.6318 5.2258 5.2258 5.2262 5.2262 5.5569 5.5569 5.5584 5.5584 5.7647 5.7647 5.7649 5.7649 6.2000 6.2000 6.2046 6.2046 6.4837 6.4837 6.4873 6.4873 6.6449 6.6449 6.6530 6.6530 6.8201 6.8201 6.8249 6.8249 6.8638 6.8638 6.8753 6.8753 7.0660 7.0660 7.0958 7.0958 7.1866 7.1866 7.1916 7.1916 7.4193 7.4193 7.4365 7.4365 7.6446 7.6446 7.6567 7.6567 7.9399 7.9399 7.9451 7.9451 8.4253 8.4253 8.4269 8.4269 9.4222 9.4222 9.4229 9.4229 9.7241 9.7241 9.7310 9.7310 10.0773 10.0773 10.0806 10.0806 k = 0.5000 0.1407 0.3660 ( 12378 PWs) bands (ev): -0.9261 -0.9261 -0.9260 -0.9260 -0.7484 -0.7484 -0.7483 -0.7483 1.5724 1.5724 1.5727 1.5727 1.8903 1.8903 1.8907 1.8907 2.8167 2.8167 2.8169 2.8169 2.9753 2.9753 2.9760 2.9760 3.4812 3.4812 3.4821 3.4821 3.8054 3.8054 3.8057 3.8057 4.7150 4.7150 4.7157 4.7157 5.2693 5.2693 5.2699 5.2699 5.5371 5.5371 5.5384 5.5384 5.7576 5.7576 5.7584 5.7584 6.1884 6.1884 6.1921 6.1921 6.4846 6.4846 6.4888 6.4888 6.6464 6.6464 6.6546 6.6546 6.8108 6.8108 6.8144 6.8144 6.8578 6.8578 6.8673 6.8673 7.0602 7.0602 7.0881 7.0881 7.1792 7.1792 7.1844 7.1844 7.4268 7.4268 7.4458 7.4458 7.6675 7.6675 7.6809 7.6809 7.9466 7.9466 7.9518 7.9518 8.3523 8.3523 8.3540 8.3540 9.3741 9.3741 9.3746 9.3746 9.7541 9.7541 9.7613 9.7613 10.1380 10.1380 10.1415 10.1415 k = 0.5000 0.1206 0.3660 ( 12364 PWs) bands (ev): -0.9452 -0.9452 -0.9451 -0.9451 -0.7670 -0.7670 -0.7668 -0.7668 1.6899 1.6899 1.6904 1.6904 2.0036 2.0036 2.0040 2.0040 2.7927 2.7927 2.7930 2.7930 2.9545 2.9545 2.9555 2.9555 3.3527 3.3527 3.3538 3.3538 3.6732 3.6732 3.6735 3.6735 4.7968 4.7968 4.7977 4.7977 5.3071 5.3071 5.3078 5.3078 5.5182 5.5182 5.5195 5.5195 5.7481 5.7481 5.7498 5.7498 6.1811 6.1811 6.1839 6.1839 6.4826 6.4826 6.4877 6.4877 6.6459 6.6459 6.6538 6.6538 6.8023 6.8023 6.8050 6.8050 6.8520 6.8520 6.8597 6.8597 7.0556 7.0556 7.0816 7.0816 7.1722 7.1722 7.1780 7.1780 7.4330 7.4330 7.4537 7.4537 7.6913 7.6913 7.7060 7.7060 7.9517 7.9517 7.9568 7.9568 8.2849 8.2849 8.2866 8.2866 9.3262 9.3262 9.3267 9.3267 9.7913 9.7913 9.7984 9.7984 10.2026 10.2026 10.2062 10.2062 k = 0.5000 0.1005 0.3660 ( 12350 PWs) bands (ev): -0.9614 -0.9614 -0.9613 -0.9613 -0.7827 -0.7827 -0.7825 -0.7825 1.8091 1.8091 1.8096 1.8096 2.1174 2.1174 2.1176 2.1176 2.7678 2.7678 2.7682 2.7682 2.9321 2.9321 2.9335 2.9335 3.2317 3.2317 3.2331 3.2331 3.5443 3.5443 3.5446 3.5446 4.8755 4.8755 4.8768 4.8768 5.3386 5.3386 5.3394 5.3394 5.5002 5.5002 5.5016 5.5016 5.7347 5.7347 5.7374 5.7374 6.1807 6.1807 6.1824 6.1824 6.4767 6.4767 6.4829 6.4829 6.6436 6.6436 6.6504 6.6504 6.7957 6.7957 6.7981 6.7981 6.8463 6.8463 6.8523 6.8523 7.0522 7.0522 7.0762 7.0762 7.1656 7.1656 7.1723 7.1723 7.4378 7.4378 7.4601 7.4601 7.7156 7.7156 7.7312 7.7312 7.9553 7.9553 7.9601 7.9601 8.2241 8.2241 8.2256 8.2256 9.2827 9.2827 9.2833 9.2833 9.8306 9.8306 9.8374 9.8374 10.2695 10.2695 10.2731 10.2731 k = 0.5000 0.0804 0.3660 ( 12352 PWs) bands (ev): -0.9746 -0.9746 -0.9745 -0.9745 -0.7956 -0.7956 -0.7954 -0.7954 1.9295 1.9295 1.9300 1.9300 2.2303 2.2303 2.2305 2.2305 2.7388 2.7388 2.7395 2.7395 2.9031 2.9031 2.9050 2.9050 3.1264 3.1264 3.1283 3.1283 3.4207 3.4207 3.4211 3.4211 4.9494 4.9494 4.9513 4.9513 5.3636 5.3636 5.3644 5.3644 5.4830 5.4830 5.4846 5.4846 5.7169 5.7169 5.7205 5.7205 6.1882 6.1882 6.1890 6.1890 6.4664 6.4664 6.4739 6.4739 6.6399 6.6399 6.6452 6.6452 6.7914 6.7914 6.7942 6.7942 6.8409 6.8409 6.8452 6.8452 7.0497 7.0497 7.0720 7.0720 7.1598 7.1598 7.1675 7.1675 7.4415 7.4415 7.4652 7.4652 7.7396 7.7396 7.7562 7.7562 7.9573 7.9573 7.9616 7.9616 8.1712 8.1712 8.1721 8.1721 9.2457 9.2457 9.2464 9.2464 9.8683 9.8683 9.8748 9.8748 10.3366 10.3366 10.3400 10.3400 k = 0.5000 0.0603 0.3660 ( 12354 PWs) bands (ev): -0.9849 -0.9849 -0.9848 -0.9848 -0.8056 -0.8056 -0.8054 -0.8054 2.0506 2.0506 2.0512 2.0512 2.3399 2.3399 2.3401 2.3401 2.6995 2.6995 2.7006 2.7006 2.8599 2.8599 2.8620 2.8620 3.0510 3.0510 3.0530 3.0530 3.3060 3.3060 3.3065 3.3065 5.0161 5.0161 5.0186 5.0186 5.3820 5.3820 5.3827 5.3827 5.4667 5.4667 5.4689 5.4689 5.6961 5.6961 5.7006 5.7006 6.2024 6.2024 6.2025 6.2025 6.4520 6.4520 6.4607 6.4607 6.6361 6.6361 6.6397 6.6397 6.7892 6.7892 6.7930 6.7930 6.8361 6.8361 6.8386 6.8386 7.0482 7.0482 7.0689 7.0689 7.1549 7.1549 7.1637 7.1637 7.4441 7.4441 7.4690 7.4690 7.7624 7.7624 7.7799 7.7799 7.9575 7.9575 7.9609 7.9609 8.1274 8.1274 8.1276 8.1276 9.2162 9.2162 9.2170 9.2170 9.9016 9.9016 9.9077 9.9077 10.4002 10.4002 10.4030 10.4030 k = 0.5000 0.0402 0.3660 ( 12340 PWs) bands (ev): -0.9922 -0.9922 -0.9921 -0.9921 -0.8127 -0.8127 -0.8126 -0.8126 2.1714 2.1714 2.1720 2.1720 2.4377 2.4377 2.4387 2.4387 2.6449 2.6449 2.6465 2.6465 2.8041 2.8041 2.8053 2.8053 3.0124 3.0124 3.0138 3.0138 3.2067 3.2067 3.2072 3.2072 5.0717 5.0717 5.0749 5.0749 5.3934 5.3934 5.3937 5.3937 5.4529 5.4529 5.4560 5.4560 5.6760 5.6760 5.6811 5.6811 6.2197 6.2197 6.2200 6.2200 6.4356 6.4356 6.4453 6.4453 6.6329 6.6329 6.6352 6.6352 6.7887 6.7887 6.7938 6.7938 6.8321 6.8321 6.8330 6.8330 7.0472 7.0472 7.0667 7.0667 7.1512 7.1512 7.1610 7.1610 7.4458 7.4458 7.4716 7.4716 7.7824 7.7824 7.8009 7.8009 7.9559 7.9559 7.9581 7.9581 8.0931 8.0931 8.0949 8.0949 9.1948 9.1948 9.1956 9.1956 9.9276 9.9276 9.9335 9.9335 10.4571 10.4571 10.4592 10.4592 k = 0.5000 0.0201 0.3660 ( 12336 PWs) bands (ev): -0.9966 -0.9966 -0.9965 -0.9965 -0.8170 -0.8170 -0.8168 -0.8168 2.2897 2.2897 2.2905 2.2905 2.4766 2.4766 2.4785 2.4785 2.6149 2.6149 2.6170 2.6170 2.7445 2.7445 2.7447 2.7447 2.9993 2.9993 2.9998 2.9998 3.1342 3.1342 3.1350 3.1350 5.1101 5.1101 5.1141 5.1141 5.3972 5.3972 5.3974 5.3974 5.4443 5.4443 5.4485 5.4485 5.6612 5.6612 5.6667 5.6667 6.2349 6.2349 6.2353 6.2353 6.4213 6.4213 6.4319 6.4319 6.6308 6.6308 6.6323 6.6323 6.7889 6.7889 6.7951 6.7951 6.8289 6.8289 6.8294 6.8294 7.0467 7.0467 7.0655 7.0655 7.1490 7.1490 7.1593 7.1593 7.4468 7.4468 7.4732 7.4732 7.7970 7.7970 7.8163 7.8163 7.9531 7.9531 7.9544 7.9544 8.0715 8.0715 8.0749 8.0749 9.1819 9.1819 9.1827 9.1827 9.9442 9.9442 9.9498 9.9498 10.5075 10.5075 10.5096 10.5096 k = 0.5000-0.0000 0.3660 ( 12324 PWs) bands (ev): -0.9981 -0.9981 -0.9980 -0.9980 -0.8185 -0.8185 -0.8183 -0.8183 2.3929 2.3929 2.3948 2.3948 2.4079 2.4079 2.4084 2.4084 2.6576 2.6576 2.6581 2.6581 2.6914 2.6914 2.6930 2.6930 2.9976 2.9976 2.9977 2.9977 3.1061 3.1061 3.1071 3.1071 5.1241 5.1241 5.1285 5.1285 5.3972 5.3972 5.3974 5.3974 5.4418 5.4418 5.4464 5.4464 5.6557 5.6557 5.6613 5.6613 6.2413 6.2413 6.2415 6.2415 6.4155 6.4155 6.4263 6.4263 6.6301 6.6301 6.6313 6.6313 6.7891 6.7891 6.7958 6.7958 6.8274 6.8274 6.8285 6.8285 7.0466 7.0466 7.0651 7.0651 7.1482 7.1482 7.1587 7.1587 7.4471 7.4471 7.4737 7.4737 7.8024 7.8024 7.8222 7.8222 7.9516 7.9516 7.9525 7.9525 8.0642 8.0642 8.0682 8.0682 9.1775 9.1775 9.1784 9.1784 9.9499 9.9499 9.9555 9.9555 10.5396 10.5396 10.5441 10.5441 k = 0.5000-0.0000 0.3660 ( 12324 PWs) bands (ev): -0.9981 -0.9981 -0.9980 -0.9980 -0.8185 -0.8185 -0.8183 -0.8183 2.3929 2.3929 2.3948 2.3948 2.4079 2.4079 2.4084 2.4084 2.6576 2.6576 2.6581 2.6581 2.6914 2.6914 2.6930 2.6930 2.9976 2.9976 2.9977 2.9977 3.1061 3.1061 3.1071 3.1071 5.1241 5.1241 5.1285 5.1285 5.3972 5.3972 5.3974 5.3974 5.4418 5.4418 5.4464 5.4464 5.6557 5.6557 5.6613 5.6613 6.2413 6.2413 6.2415 6.2415 6.4155 6.4155 6.4263 6.4263 6.6301 6.6301 6.6313 6.6313 6.7891 6.7891 6.7958 6.7958 6.8274 6.8274 6.8285 6.8285 7.0466 7.0466 7.0651 7.0651 7.1482 7.1482 7.1587 7.1587 7.4471 7.4471 7.4737 7.4737 7.8024 7.8024 7.8222 7.8222 7.9516 7.9516 7.9525 7.9525 8.0642 8.0642 8.0682 8.0682 9.1775 9.1775 9.1784 9.1784 9.9499 9.9499 9.9555 9.9555 10.5396 10.5396 10.5441 10.5441 k = 0.5000-0.0000 0.3467 ( 12320 PWs) bands (ev): -1.0100 -1.0100 -1.0099 -1.0099 -0.8039 -0.8039 -0.8038 -0.8038 2.3718 2.3718 2.3728 2.3728 2.4195 2.4195 2.4210 2.4210 2.6228 2.6228 2.6237 2.6237 2.7006 2.7006 2.7018 2.7018 2.9960 2.9960 2.9962 2.9962 3.1487 3.1487 3.1496 3.1496 5.1069 5.1069 5.1109 5.1109 5.4053 5.4053 5.4054 5.4054 5.4372 5.4372 5.4411 5.4411 5.6641 5.6641 5.6696 5.6696 6.2333 6.2333 6.2335 6.2335 6.4204 6.4204 6.4315 6.4315 6.6301 6.6301 6.6313 6.6313 6.7872 6.7872 6.7933 6.7933 6.8280 6.8280 6.8288 6.8288 7.0330 7.0330 7.0492 7.0492 7.1655 7.1655 7.1780 7.1780 7.4477 7.4477 7.4742 7.4742 7.8027 7.8027 7.8223 7.8223 7.9515 7.9515 7.9523 7.9523 8.0687 8.0687 8.0728 8.0728 9.1795 9.1795 9.1804 9.1804 9.9451 9.9451 9.9506 9.9506 10.5138 10.5138 10.5171 10.5171 k = 0.5000-0.0000 0.3275 ( 12338 PWs) bands (ev): -1.0383 -1.0383 -1.0382 -1.0382 -0.7680 -0.7680 -0.7678 -0.7678 2.3390 2.3390 2.3395 2.3395 2.4131 2.4131 2.4155 2.4155 2.5695 2.5695 2.5712 2.5712 2.7020 2.7020 2.7030 2.7030 3.0104 3.0104 3.0108 3.0108 3.2422 3.2422 3.2430 3.2430 5.0623 5.0623 5.0654 5.0654 5.4032 5.4032 5.4063 5.4063 5.4446 5.4446 5.4448 5.4448 5.6860 5.6860 5.6912 5.6912 6.2119 6.2119 6.2133 6.2133 6.4329 6.4329 6.4446 6.4446 6.6299 6.6299 6.6313 6.6313 6.7815 6.7815 6.7862 6.7862 6.8294 6.8294 6.8297 6.8297 7.0071 7.0071 7.0200 7.0200 7.2023 7.2023 7.2171 7.2171 7.4495 7.4495 7.4754 7.4754 7.8036 7.8036 7.8226 7.8226 7.9513 7.9513 7.9517 7.9517 8.0822 8.0822 8.0865 8.0865 9.1852 9.1852 9.1861 9.1861 9.9312 9.9312 9.9363 9.9363 10.4530 10.4530 10.4556 10.4556 k = 0.5000-0.0000 0.3082 ( 12344 PWs) bands (ev): -1.0728 -1.0728 -1.0727 -1.0727 -0.7206 -0.7206 -0.7205 -0.7205 2.2938 2.2938 2.2939 2.2939 2.3695 2.3695 2.3723 2.3723 2.5376 2.5376 2.5395 2.5395 2.7031 2.7031 2.7036 2.7036 3.0440 3.0440 3.0445 3.0445 3.3571 3.3571 3.3577 3.3577 5.0012 5.0012 5.0036 5.0036 5.3775 5.3775 5.3809 5.3809 5.4703 5.4703 5.4716 5.4716 5.7149 5.7149 5.7193 5.7193 6.1841 6.1841 6.1873 6.1873 6.4489 6.4489 6.4614 6.4614 6.6297 6.6297 6.6313 6.6313 6.7725 6.7725 6.7753 6.7753 6.8309 6.8309 6.8310 6.8310 6.9816 6.9816 6.9915 6.9915 7.2444 7.2444 7.2604 7.2604 7.4527 7.4527 7.4776 7.4776 7.8051 7.8051 7.8232 7.8232 7.9513 7.9513 7.9515 7.9515 8.1042 8.1042 8.1086 8.1086 9.1941 9.1941 9.1951 9.1951 9.9094 9.9094 9.9140 9.9140 10.3651 10.3651 10.3672 10.3672 k = 0.5000-0.0000 0.2890 ( 12344 PWs) bands (ev): -1.1087 -1.1087 -1.1086 -1.1086 -0.6668 -0.6668 -0.6667 -0.6667 2.2185 2.2185 2.2186 2.2186 2.3209 2.3209 2.3232 2.3232 2.5192 2.5192 2.5210 2.5210 2.7154 2.7154 2.7156 2.7156 3.0894 3.0894 3.0901 3.0901 3.4823 3.4823 3.4828 3.4828 4.9308 4.9308 4.9326 4.9326 5.3441 5.3441 5.3471 5.3471 5.4966 5.4966 5.4980 5.4980 5.7450 5.7450 5.7479 5.7479 6.1563 6.1563 6.1620 6.1620 6.4658 6.4658 6.4792 6.4792 6.6291 6.6291 6.6311 6.6311 6.7603 6.7603 6.7611 6.7611 6.8322 6.8322 6.8323 6.8323 6.9601 6.9601 6.9673 6.9673 7.2860 7.2860 7.3022 7.3022 7.4577 7.4577 7.4809 7.4809 7.8072 7.8072 7.8242 7.8242 7.9517 7.9517 7.9519 7.9519 8.1340 8.1340 8.1387 8.1387 9.2051 9.2051 9.2061 9.2061 9.8817 9.8817 9.8856 9.8856 10.2551 10.2551 10.2564 10.2564 k = 0.5000-0.0000 0.2697 ( 12352 PWs) bands (ev): -1.1439 -1.1439 -1.1438 -1.1438 -0.6085 -0.6085 -0.6084 -0.6084 2.1164 2.1164 2.1166 2.1166 2.2862 2.2862 2.2880 2.2880 2.4981 2.4981 2.4998 2.4998 2.7413 2.7413 2.7415 2.7415 3.1419 3.1419 3.1428 3.1428 3.6132 3.6132 3.6136 3.6136 4.8549 4.8549 4.8562 4.8562 5.3059 5.3059 5.3085 5.3085 5.5173 5.5173 5.5185 5.5185 5.7717 5.7717 5.7725 5.7725 6.1344 6.1344 6.1430 6.1430 6.4824 6.4824 6.4968 6.4968 6.6281 6.6281 6.6306 6.6306 6.7440 6.7440 6.7456 6.7456 6.8333 6.8333 6.8334 6.8334 6.9432 6.9432 6.9478 6.9478 7.3242 7.3242 7.3393 7.3393 7.4652 7.4652 7.4857 7.4857 7.8098 7.8098 7.8258 7.8258 7.9526 7.9526 7.9530 7.9530 8.1709 8.1709 8.1760 8.1760 9.2162 9.2162 9.2172 9.2172 9.8503 9.8503 9.8531 9.8531 10.1341 10.1341 10.1344 10.1344 k = 0.5000-0.0000 0.2504 ( 12368 PWs) bands (ev): -1.1777 -1.1777 -1.1776 -1.1776 -0.5467 -0.5467 -0.5466 -0.5466 2.0039 2.0039 2.0041 2.0041 2.2582 2.2582 2.2598 2.2598 2.4728 2.4728 2.4744 2.4744 2.7776 2.7776 2.7780 2.7780 3.1991 3.1991 3.2002 3.2002 3.7471 3.7471 3.7475 3.7475 4.7758 4.7758 4.7768 4.7768 5.2635 5.2635 5.2657 5.2657 5.5296 5.5296 5.5304 5.5304 5.7912 5.7912 5.7927 5.7927 6.1227 6.1227 6.1341 6.1341 6.4985 6.4985 6.5140 6.5140 6.6261 6.6261 6.6293 6.6293 6.7250 6.7250 6.7288 6.7288 6.8343 6.8343 6.8345 6.8345 6.9302 6.9302 6.9327 6.9327 7.3570 7.3570 7.3694 7.3694 7.4760 7.4760 7.4925 7.4925 7.8130 7.8130 7.8280 7.8280 7.9540 7.9540 7.9547 7.9547 8.2135 8.2135 8.2190 8.2190 9.2248 9.2248 9.2255 9.2255 9.8169 9.8169 9.8179 9.8179 10.0143 10.0143 10.0157 10.0157 k = 0.5000-0.0000 0.2312 ( 12382 PWs) bands (ev): -1.2094 -1.2094 -1.2093 -1.2093 -0.4819 -0.4819 -0.4817 -0.4817 1.8881 1.8881 1.8883 1.8883 2.2339 2.2339 2.2353 2.2353 2.4453 2.4453 2.4468 2.4468 2.8209 2.8209 2.8215 2.8215 3.2597 3.2597 3.2609 3.2609 3.8827 3.8827 3.8830 3.8830 4.6952 4.6952 4.6958 4.6958 5.2165 5.2165 5.2183 5.2183 5.5319 5.5319 5.5323 5.5323 5.8051 5.8051 5.8085 5.8085 6.1224 6.1224 6.1361 6.1361 6.5141 6.5141 6.5307 6.5307 6.6225 6.6225 6.6264 6.6264 6.7050 6.7050 6.7112 6.7112 6.8350 6.8350 6.8355 6.8355 6.9206 6.9206 6.9213 6.9213 7.3834 7.3834 7.3915 7.3915 7.4905 7.4905 7.5016 7.5016 7.8169 7.8169 7.8310 7.8310 7.9558 7.9558 7.9566 7.9566 8.2595 8.2595 8.2657 8.2657 9.2269 9.2269 9.2272 9.2272 9.7771 9.7771 9.7790 9.7790 9.9117 9.9117 9.9160 9.9160 k = 0.5000-0.0000 0.2119 ( 12384 PWs) bands (ev): -1.2389 -1.2389 -1.2388 -1.2388 -0.4143 -0.4143 -0.4142 -0.4142 1.7715 1.7715 1.7717 1.7717 2.2122 2.2122 2.2134 2.2134 2.4176 2.4176 2.4190 2.4190 2.8691 2.8691 2.8697 2.8697 3.3229 3.3229 3.3242 3.3242 4.0184 4.0184 4.0188 4.0188 4.6142 4.6142 4.6146 4.6146 5.1644 5.1644 5.1658 5.1658 5.5245 5.5245 5.5246 5.5246 5.8172 5.8172 5.8216 5.8216 6.1312 6.1312 6.1461 6.1461 6.5289 6.5289 6.5469 6.5469 6.6163 6.6163 6.6202 6.6202 6.6863 6.6863 6.6944 6.6944 6.8355 6.8355 6.8364 6.8364 6.9127 6.9127 6.9135 6.9135 7.4030 7.4030 7.4066 7.4066 7.5077 7.5077 7.5134 7.5134 7.8214 7.8214 7.8348 7.8348 7.9578 7.9578 7.9585 7.9585 8.3056 8.3056 8.3127 8.3127 9.2180 9.2180 9.2195 9.2195 9.7208 9.7208 9.7247 9.7247 9.8494 9.8494 9.8562 9.8562 k = 0.5000-0.0000 0.1926 ( 12400 PWs) bands (ev): -1.2661 -1.2661 -1.2660 -1.2660 -0.3442 -0.3442 -0.3440 -0.3440 1.6554 1.6554 1.6556 1.6556 2.1928 2.1928 2.1940 2.1940 2.3906 2.3906 2.3919 2.3919 2.9208 2.9208 2.9215 2.9215 3.3878 3.3878 3.3892 3.3892 4.1526 4.1526 4.1530 4.1530 4.5347 4.5347 4.5348 4.5348 5.1068 5.1068 5.1079 5.1079 5.5096 5.5096 5.5097 5.5097 5.8296 5.8296 5.8342 5.8342 6.1453 6.1453 6.1603 6.1603 6.5413 6.5413 6.5617 6.5617 6.6068 6.6068 6.6080 6.6080 6.6720 6.6720 6.6807 6.6807 6.8360 6.8360 6.8372 6.8372 6.9064 6.9064 6.9083 6.9083 7.4166 7.4166 7.4168 7.4168 7.5261 7.5261 7.5274 7.5274 7.8265 7.8265 7.8393 7.8393 7.9596 7.9596 7.9604 7.9604 8.3472 8.3472 8.3555 8.3555 9.1977 9.1977 9.2014 9.2014 9.6533 9.6533 9.6561 9.6561 9.8324 9.8324 9.8391 9.8391 k = 0.5000-0.0000 0.1734 ( 12414 PWs) bands (ev): -1.2908 -1.2908 -1.2907 -1.2907 -0.2717 -0.2717 -0.2716 -0.2716 1.5407 1.5407 1.5409 1.5409 2.1757 2.1757 2.1767 2.1767 2.3652 2.3652 2.3663 2.3663 2.9753 2.9753 2.9761 2.9761 3.4538 3.4538 3.4554 3.4554 4.2797 4.2797 4.2801 4.2801 4.4620 4.4620 4.4623 4.4623 5.0439 5.0439 5.0448 5.0448 5.4906 5.4906 5.4907 5.4907 5.8426 5.8426 5.8468 5.8468 6.1611 6.1611 6.1752 6.1752 6.5460 6.5460 6.5688 6.5688 6.5943 6.5943 6.5978 6.5978 6.6641 6.6641 6.6716 6.6716 6.8366 6.8366 6.8381 6.8381 6.9018 6.9018 6.9046 6.9046 7.4236 7.4236 7.4260 7.4260 7.5430 7.5430 7.5444 7.5444 7.8322 7.8322 7.8445 7.8445 7.9613 7.9613 7.9619 7.9619 8.3782 8.3782 8.3880 8.3880 9.1719 9.1719 9.1783 9.1783 9.5906 9.5906 9.5918 9.5918 9.8430 9.8430 9.8493 9.8493 k = 0.5000-0.0000 0.1541 ( 12406 PWs) bands (ev): -1.3131 -1.3131 -1.3129 -1.3129 -0.1972 -0.1972 -0.1971 -0.1971 1.4279 1.4279 1.4281 1.4281 2.1606 2.1606 2.1615 2.1615 2.3416 2.3416 2.3426 2.3426 3.0321 3.0321 3.0330 3.0330 3.5199 3.5199 3.5217 3.5217 4.3397 4.3397 4.3399 4.3399 4.4567 4.4567 4.4568 4.4568 4.9762 4.9762 4.9768 4.9768 5.4704 5.4704 5.4706 5.4706 5.8551 5.8551 5.8586 5.8586 6.1762 6.1762 6.1888 6.1888 6.5336 6.5336 6.5486 6.5486 6.5992 6.5992 6.6001 6.6001 6.6611 6.6611 6.6668 6.6668 6.8372 6.8372 6.8391 6.8391 6.8986 6.8986 6.9021 6.9021 7.4286 7.4286 7.4321 7.4321 7.5593 7.5593 7.5622 7.5622 7.8384 7.8384 7.8502 7.8502 7.9625 7.9625 7.9631 7.9631 8.3925 8.3925 8.4038 8.4038 9.1516 9.1516 9.1607 9.1607 9.5373 9.5373 9.5375 9.5375 9.8707 9.8707 9.8771 9.8771 k = 0.5000-0.0000 0.1348 ( 12400 PWs) bands (ev): -1.3327 -1.3327 -1.3326 -1.3326 -0.1208 -0.1208 -0.1207 -0.1207 1.3174 1.3174 1.3176 1.3176 2.1476 2.1476 2.1484 2.1484 2.3201 2.3201 2.3211 2.3211 3.0906 3.0906 3.0915 3.0915 3.5847 3.5847 3.5868 3.5868 4.2838 4.2838 4.2845 4.2845 4.5668 4.5668 4.5670 4.5670 4.9049 4.9049 4.9053 4.9053 5.4513 5.4513 5.4515 5.4515 5.8656 5.8656 5.8683 5.8683 6.1896 6.1896 6.1999 6.1999 6.5074 6.5074 6.5163 6.5163 6.6089 6.6089 6.6122 6.6122 6.6610 6.6610 6.6648 6.6648 6.8381 6.8381 6.8401 6.8401 6.8964 6.8964 6.9004 6.9004 7.4324 7.4324 7.4360 7.4360 7.5760 7.5760 7.5794 7.5794 7.8449 7.8449 7.8563 7.8563 7.9633 7.9633 7.9637 7.9637 8.3863 8.3863 8.3987 8.3987 9.1472 9.1472 9.1582 9.1582 9.4920 9.4920 9.4929 9.4929 9.9086 9.9086 9.9153 9.9153 k = 0.5000-0.0000 0.1156 ( 12398 PWs) bands (ev): -1.3498 -1.3498 -1.3497 -1.3497 -0.0431 -0.0431 -0.0429 -0.0429 1.2099 1.2099 1.2101 1.2101 2.1365 2.1365 2.1373 2.1373 2.3011 2.3011 2.3020 2.3020 3.1503 3.1503 3.1513 3.1513 3.6457 3.6457 3.6482 3.6482 4.2185 4.2185 4.2196 4.2196 4.6859 4.6859 4.6861 4.6861 4.8325 4.8325 4.8327 4.8327 5.4345 5.4345 5.4347 5.4347 5.8725 5.8725 5.8742 5.8742 6.2008 6.2008 6.2083 6.2083 6.4756 6.4756 6.4807 6.4807 6.6201 6.6201 6.6233 6.6233 6.6628 6.6628 6.6648 6.6648 6.8391 6.8391 6.8414 6.8414 6.8949 6.8949 6.8992 6.8992 7.4352 7.4352 7.4386 7.4386 7.5927 7.5927 7.5962 7.5962 7.8517 7.8517 7.8625 7.8625 7.9635 7.9635 7.9639 7.9639 8.3608 8.3608 8.3734 8.3734 9.1625 9.1625 9.1743 9.1743 9.4543 9.4543 9.4556 9.4556 9.9504 9.9504 9.9576 9.9576 k = 0.5000-0.0000 0.0963 ( 12408 PWs) bands (ev): -1.3643 -1.3643 -1.3642 -1.3642 0.0355 0.0355 0.0356 0.0356 1.1061 1.1061 1.1062 1.1062 2.1273 2.1273 2.1280 2.1280 2.2847 2.2847 2.2855 2.2855 3.2106 3.2106 3.2117 3.2117 3.6988 3.6988 3.7016 3.7016 4.1615 4.1615 4.1631 4.1631 4.7437 4.7437 4.7439 4.7439 4.8152 4.8152 4.8155 4.8155 5.4208 5.4208 5.4210 5.4210 5.8742 5.8742 5.8749 5.8749 6.2098 6.2098 6.2142 6.2142 6.4423 6.4423 6.4444 6.4444 6.6302 6.6302 6.6322 6.6322 6.6658 6.6658 6.6662 6.6662 6.8405 6.8405 6.8427 6.8427 6.8941 6.8941 6.8984 6.8984 7.4373 7.4373 7.4402 7.4402 7.6093 7.6093 7.6124 7.6124 7.8586 7.8586 7.8687 7.8687 7.9633 7.9633 7.9636 7.9636 8.3222 8.3222 8.3342 8.3342 9.1936 9.1936 9.2052 9.2052 9.4238 9.4238 9.4252 9.4252 9.9899 9.9899 9.9975 9.9975 k = 0.5000-0.0000 0.0771 ( 12396 PWs) bands (ev): -1.3762 -1.3762 -1.3761 -1.3761 0.1136 0.1136 0.1137 0.1137 1.0071 1.0071 1.0073 1.0073 2.1200 2.1200 2.1206 2.1206 2.2711 2.2711 2.2717 2.2717 3.2704 3.2704 3.2715 3.2715 3.7364 3.7364 3.7396 3.7396 4.1216 4.1216 4.1236 4.1236 4.6752 4.6752 4.6754 4.6754 4.9156 4.9156 4.9159 4.9159 5.4107 5.4107 5.4110 5.4110 5.8693 5.8693 5.8695 5.8695 6.2170 6.2170 6.2183 6.2183 6.4101 6.4101 6.4104 6.4104 6.6380 6.6380 6.6387 6.6387 6.6688 6.6688 6.6696 6.6696 6.8420 6.8420 6.8441 6.8441 6.8938 6.8938 6.8977 6.8977 7.4388 7.4388 7.4411 7.4411 7.6253 7.6253 7.6279 7.6279 7.8654 7.8654 7.8745 7.8745 7.9626 7.9626 7.9630 7.9630 8.2783 8.2783 8.2892 8.2892 9.2329 9.2329 9.2431 9.2431 9.4012 9.4012 9.4023 9.4023 10.0216 10.0216 10.0293 10.0293 k = 0.5000-0.0000 0.0578 ( 12398 PWs) bands (ev): -1.3854 -1.3854 -1.3853 -1.3853 0.1892 0.1892 0.1894 0.1894 0.9153 0.9153 0.9154 0.9154 2.1144 2.1144 2.1149 2.1149 2.2603 2.2603 2.2608 2.2608 3.3279 3.3279 3.3290 3.3290 3.7503 3.7503 3.7534 3.7534 4.1077 4.1077 4.1098 4.1098 4.6045 4.6045 4.6047 4.6047 5.0077 5.0077 5.0080 5.0080 5.4047 5.4047 5.4049 5.4049 5.8578 5.8578 5.8584 5.8584 6.2214 6.2214 6.2226 6.2226 6.3802 6.3802 6.3823 6.3823 6.6430 6.6430 6.6433 6.6433 6.6720 6.6720 6.6734 6.6734 6.8435 6.8435 6.8454 6.8454 6.8938 6.8938 6.8972 6.8972 7.4399 7.4399 7.4416 7.4416 7.6398 7.6398 7.6418 7.6418 7.8719 7.8719 7.8796 7.8796 7.9616 7.9616 7.9620 7.9620 8.2365 8.2365 8.2457 8.2457 9.2703 9.2703 9.2783 9.2783 9.3887 9.3887 9.3890 9.3890 10.0422 10.0422 10.0494 10.0494 k = 0.5000-0.0000 0.0385 ( 12398 PWs) bands (ev): -1.3920 -1.3920 -1.3919 -1.3919 0.2579 0.2579 0.2580 0.2580 0.8350 0.8350 0.8352 0.8352 2.1105 2.1105 2.1108 2.1108 2.2526 2.2526 2.2529 2.2529 3.3796 3.3796 3.3806 3.3806 3.7407 3.7407 3.7432 3.7432 4.1193 4.1193 4.1209 4.1209 4.5412 4.5412 4.5414 4.5414 5.0805 5.0805 5.0808 5.0808 5.4028 5.4028 5.4030 5.4030 5.8426 5.8426 5.8433 5.8433 6.2242 6.2242 6.2266 6.2266 6.3573 6.3573 6.3602 6.3602 6.6459 6.6459 6.6464 6.6464 6.6751 6.6751 6.6764 6.6764 6.8449 6.8449 6.8463 6.8463 6.8941 6.8941 6.8966 6.8966 7.4407 7.4407 7.4418 7.4418 7.6518 7.6518 7.6532 7.6532 7.8778 7.8778 7.8834 7.8834 7.9605 7.9605 7.9609 7.9609 8.2025 8.2025 8.2093 8.2093 9.2958 9.2958 9.3004 9.3004 9.3884 9.3884 9.3894 9.3894 10.0525 10.0525 10.0581 10.0581 k = 0.5000-0.0000 0.0193 ( 12406 PWs) bands (ev): -1.3960 -1.3960 -1.3959 -1.3959 0.3103 0.3103 0.3104 0.3104 0.7756 0.7756 0.7758 0.7758 2.1083 2.1083 2.1084 2.1084 2.2479 2.2479 2.2481 2.2481 3.4187 3.4187 3.4193 3.4193 3.7218 3.7218 3.7232 3.7232 4.1411 4.1411 4.1419 4.1419 4.4939 4.4939 4.4941 4.4941 5.1274 5.1274 5.1276 5.1276 5.4038 5.4038 5.4039 5.4039 5.8291 5.8291 5.8296 5.8296 6.2268 6.2268 6.2287 6.2287 6.3433 6.3433 6.3454 6.3454 6.6476 6.6476 6.6479 6.6479 6.6774 6.6774 6.6781 6.6781 6.8460 6.8460 6.8468 6.8468 6.8946 6.8946 6.8960 6.8960 7.4412 7.4412 7.4417 7.4417 7.6599 7.6599 7.6606 7.6606 7.8824 7.8824 7.8855 7.8855 7.9597 7.9597 7.9599 7.9599 8.1810 8.1810 8.1847 8.1847 9.3062 9.3062 9.3079 9.3079 9.3969 9.3969 9.3982 9.3982 10.0563 10.0563 10.0593 10.0593 k = 0.5000-0.0000-0.0000 ( 12406 PWs) bands (ev): -1.3973 -1.3973 -1.3972 -1.3972 0.3311 0.3311 0.3312 0.3312 0.7526 0.7526 0.7527 0.7527 2.1075 2.1075 2.1076 2.1076 2.2464 2.2464 2.2465 2.2465 3.4342 3.4342 3.4343 3.4343 3.7128 3.7128 3.7129 3.7129 4.1522 4.1522 4.1523 4.1523 4.4755 4.4755 4.4756 4.4756 5.1436 5.1436 5.1437 5.1437 5.4048 5.4048 5.4049 5.4049 5.8238 5.8238 5.8238 5.8238 6.2286 6.2286 6.2287 6.2287 6.3393 6.3393 6.3395 6.3395 6.6482 6.6482 6.6484 6.6484 6.6784 6.6784 6.6785 6.6785 6.8466 6.8466 6.8467 6.8467 6.8952 6.8952 6.8954 6.8954 7.4415 7.4415 7.4416 7.4416 7.6630 7.6630 7.6631 7.6631 7.8852 7.8852 7.8852 7.8852 7.9594 7.9594 7.9595 7.9595 8.1747 8.1747 8.1749 8.1749 9.3086 9.3086 9.3087 9.3087 9.4024 9.4024 9.4025 9.4025 10.0579 10.0579 10.0580 10.0580 k = 0.0000 0.0000 0.3660 ( 12352 PWs) bands (ev): -1.8204 -1.8204 -1.8203 -1.8203 1.4459 1.4459 1.4459 1.4459 1.6431 1.6431 1.6431 1.6431 1.8715 1.8715 1.8715 1.8715 2.0081 2.0081 2.0081 2.0081 2.1094 2.1094 2.1095 2.1095 4.3453 4.3453 4.3453 4.3453 4.6631 4.6631 4.6631 4.6631 4.7709 4.7709 4.7710 4.7710 5.0004 5.0004 5.0004 5.0004 5.1417 5.1417 5.1417 5.1417 5.3109 5.3109 5.3110 5.3110 5.6811 5.6811 5.6812 5.6812 5.9087 5.9087 5.9087 5.9087 6.5046 6.5046 6.5047 6.5047 6.7389 6.7389 6.7390 6.7390 6.7996 6.7996 6.7997 6.7997 6.9812 6.9812 6.9813 6.9813 7.2629 7.2629 7.2631 7.2631 7.4563 7.4563 7.4563 7.4563 7.5703 7.5703 7.5703 7.5703 7.7095 7.7095 7.7095 7.7095 7.9363 7.9363 7.9364 7.9364 8.7124 8.7124 8.7125 8.7125 9.6375 9.6375 9.6376 9.6376 9.8962 9.8962 9.8962 9.8962 k = 0.0200-0.0000 0.3660 ( 12360 PWs) bands (ev): -1.8189 -1.8189 -1.8189 -1.8189 1.4190 1.4190 1.4193 1.4193 1.6417 1.6417 1.6418 1.6418 1.8710 1.8710 1.8720 1.8720 2.0319 2.0319 2.0321 2.0321 2.1192 2.1192 2.1198 2.1198 4.3323 4.3323 4.3325 4.3325 4.6508 4.6508 4.6517 4.6517 4.7583 4.7583 4.7598 4.7598 5.0119 5.0119 5.0121 5.0121 5.1455 5.1455 5.1466 5.1466 5.3132 5.3132 5.3135 5.3135 5.6863 5.6863 5.6875 5.6875 5.9184 5.9184 5.9193 5.9193 6.5037 6.5037 6.5043 6.5043 6.7368 6.7368 6.7405 6.7405 6.7985 6.7985 6.8022 6.8022 6.9818 6.9818 6.9832 6.9832 7.2623 7.2623 7.2646 7.2646 7.4552 7.4552 7.4565 7.4565 7.5713 7.5713 7.5731 7.5731 7.7087 7.7087 7.7110 7.7110 7.9359 7.9359 7.9375 7.9375 8.7137 8.7137 8.7138 8.7138 9.6184 9.6184 9.6208 9.6208 9.9101 9.9101 9.9147 9.9147 k = 0.0400-0.0000 0.3660 ( 12360 PWs) bands (ev): -1.8145 -1.8145 -1.8145 -1.8145 1.3488 1.3488 1.3492 1.3492 1.6416 1.6416 1.6418 1.6418 1.8731 1.8731 1.8743 1.8743 2.0690 2.0690 2.0694 2.0694 2.1674 2.1674 2.1687 2.1687 4.2959 4.2959 4.2962 4.2962 4.6103 4.6103 4.6113 4.6113 4.7378 4.7378 4.7398 4.7398 5.0338 5.0338 5.0350 5.0350 5.1492 5.1492 5.1497 5.1497 5.3323 5.3323 5.3339 5.3339 5.7007 5.7007 5.7029 5.7029 5.9465 5.9465 5.9482 5.9482 6.5018 6.5018 6.5030 6.5030 6.7344 6.7344 6.7412 6.7412 6.7992 6.7992 6.8059 6.8059 6.9848 6.9848 6.9876 6.9876 7.2626 7.2626 7.2672 7.2672 7.4532 7.4532 7.4556 7.4556 7.5762 7.5762 7.5795 7.5795 7.7085 7.7085 7.7130 7.7130 7.9362 7.9362 7.9393 7.9393 8.7177 8.7177 8.7178 8.7178 9.5754 9.5754 9.5791 9.5791 9.9419 9.9419 9.9505 9.9505 k = 0.0600-0.0000 0.3660 ( 12348 PWs) bands (ev): -1.8073 -1.8073 -1.8072 -1.8072 1.2539 1.2539 1.2544 1.2544 1.6456 1.6456 1.6458 1.6458 1.8786 1.8786 1.8797 1.8797 2.0881 2.0881 2.0884 2.0884 2.2632 2.2632 2.2644 2.2644 4.2417 4.2417 4.2420 4.2420 4.5437 4.5437 4.5442 4.5442 4.7218 4.7218 4.7237 4.7237 5.0363 5.0363 5.0399 5.0399 5.1564 5.1564 5.1599 5.1599 5.3796 5.3796 5.3830 5.3830 5.7204 5.7204 5.7235 5.7235 5.9881 5.9881 5.9903 5.9903 6.4995 6.4995 6.5014 6.5014 6.7321 6.7321 6.7412 6.7412 6.8014 6.8014 6.8103 6.8103 6.9903 6.9903 6.9944 6.9944 7.2639 7.2639 7.2709 7.2709 7.4504 7.4504 7.4534 7.4534 7.5853 7.5853 7.5897 7.5897 7.7091 7.7091 7.7158 7.7158 7.9372 7.9372 7.9419 7.9419 8.7244 8.7244 8.7246 8.7246 9.5239 9.5239 9.5281 9.5281 9.9650 9.9650 9.9767 9.9767 k = 0.0800-0.0000 0.3660 ( 12356 PWs) bands (ev): -1.7970 -1.7970 -1.7970 -1.7970 1.1474 1.1474 1.1478 1.1478 1.6534 1.6534 1.6536 1.6536 1.8871 1.8871 1.8881 1.8881 2.1017 2.1017 2.1019 2.1019 2.3809 2.3809 2.3819 2.3819 4.1752 4.1752 4.1755 4.1755 4.4622 4.4622 4.4623 4.4623 4.7045 4.7045 4.7062 4.7062 5.0062 5.0062 5.0099 5.0099 5.1901 5.1901 5.1941 5.1941 5.4459 5.4459 5.4507 5.4507 5.7437 5.7437 5.7476 5.7476 6.0364 6.0364 6.0389 6.0389 6.4977 6.4977 6.5003 6.5003 6.7299 6.7299 6.7406 6.7406 6.8047 6.8047 6.8148 6.8148 6.9981 6.9981 7.0033 7.0033 7.2666 7.2666 7.2760 7.2760 7.4468 7.4468 7.4498 7.4498 7.5990 7.5990 7.6038 7.6038 7.7104 7.7104 7.7193 7.7193 7.9391 7.9391 7.9452 7.9452 8.7339 8.7339 8.7342 8.7342 9.4717 9.4717 9.4764 9.4764 9.9620 9.9620 9.9744 9.9744 k = 0.1000-0.0000 0.3660 ( 12364 PWs) bands (ev): -1.7839 -1.7839 -1.7839 -1.7839 1.0356 1.0356 1.0360 1.0360 1.6645 1.6645 1.6647 1.6647 1.8984 1.8984 1.8994 1.8994 2.1158 2.1158 2.1159 2.1159 2.5085 2.5085 2.5094 2.5094 4.1007 4.1007 4.1010 4.1010 4.3734 4.3734 4.3736 4.3736 4.6776 4.6776 4.6791 4.6791 4.9663 4.9663 4.9694 4.9694 5.2372 5.2372 5.2406 5.2406 5.5203 5.5203 5.5260 5.5260 5.7704 5.7704 5.7750 5.7750 6.0854 6.0854 6.0881 6.0881 6.4979 6.4979 6.5011 6.5011 6.7281 6.7281 6.7395 6.7395 6.8086 6.8086 6.8192 6.8192 7.0076 7.0076 7.0138 7.0138 7.2710 7.2710 7.2828 7.2828 7.4422 7.4422 7.4446 7.4446 7.6172 7.6172 7.6221 7.6221 7.7127 7.7127 7.7237 7.7237 7.9419 7.9419 7.9494 7.9494 8.7465 8.7465 8.7469 8.7469 9.4227 9.4227 9.4279 9.4279 9.9360 9.9360 9.9472 9.9472 k = 0.1200-0.0000 0.3660 ( 12358 PWs) bands (ev): -1.7679 -1.7679 -1.7678 -1.7678 0.9219 0.9219 0.9222 0.9222 1.6786 1.6786 1.6787 1.6787 1.9124 1.9124 1.9133 1.9133 2.1318 2.1318 2.1319 2.1319 2.6414 2.6414 2.6421 2.6421 4.0213 4.0213 4.0215 4.0215 4.2812 4.2812 4.2815 4.2815 4.6349 4.6349 4.6362 4.6362 4.9347 4.9347 4.9372 4.9372 5.2868 5.2868 5.2896 5.2896 5.5965 5.5965 5.6031 5.6031 5.8004 5.8004 5.8056 5.8056 6.1305 6.1305 6.1331 6.1331 6.5013 6.5013 6.5052 6.5052 6.7265 6.7265 6.7383 6.7383 6.8129 6.8129 6.8232 6.8232 7.0183 7.0183 7.0254 7.0254 7.2777 7.2777 7.2920 7.2920 7.4365 7.4365 7.4380 7.4380 7.6401 7.6401 7.6445 7.6445 7.7161 7.7161 7.7292 7.7292 7.9460 7.9460 7.9547 7.9547 8.7622 8.7622 8.7627 8.7627 9.3791 9.3791 9.3847 9.3847 9.8983 9.8983 9.9084 9.9084 k = 0.1400-0.0000 0.3660 ( 12352 PWs) bands (ev): -1.7490 -1.7490 -1.7489 -1.7489 0.8079 0.8079 0.8082 0.8082 1.6955 1.6955 1.6957 1.6957 1.9290 1.9290 1.9299 1.9299 2.1501 2.1501 2.1502 2.1502 2.7771 2.7771 2.7778 2.7778 3.9391 3.9391 3.9393 3.9393 4.1876 4.1876 4.1880 4.1880 4.5756 4.5756 4.5766 4.5766 4.9174 4.9174 4.9193 4.9193 5.3345 5.3345 5.3368 5.3368 5.6711 5.6711 5.6784 5.6784 5.8328 5.8328 5.8385 5.8385 6.1695 6.1695 6.1716 6.1716 6.5091 6.5091 6.5134 6.5134 6.7252 6.7252 6.7370 6.7370 6.8170 6.8170 6.8268 6.8268 7.0292 7.0292 7.0368 7.0368 7.2873 7.2873 7.3038 7.3038 7.4297 7.4297 7.4299 7.4299 7.6668 7.6668 7.6705 7.6705 7.7212 7.7212 7.7364 7.7364 7.9516 7.9516 7.9613 7.9613 8.7813 8.7813 8.7819 8.7819 9.3422 9.3422 9.3483 9.3483 9.8566 9.8566 9.8659 9.8659 k = 0.1600-0.0000 0.3660 ( 12368 PWs) bands (ev): -1.7271 -1.7271 -1.7271 -1.7271 0.6946 0.6946 0.6949 0.6949 1.7152 1.7152 1.7153 1.7153 1.9482 1.9482 1.9491 1.9491 2.1709 2.1709 2.1710 2.1710 2.9137 2.9137 2.9144 2.9144 3.8560 3.8560 3.8562 3.8562 4.0937 4.0937 4.0940 4.0940 4.5041 4.5041 4.5048 4.5048 4.9128 4.9128 4.9142 4.9142 5.3787 5.3787 5.3805 5.3805 5.7419 5.7419 5.7499 5.7499 5.8656 5.8656 5.8717 5.8717 6.2024 6.2024 6.2037 6.2037 6.5211 6.5211 6.5256 6.5256 6.7240 6.7240 6.7356 6.7356 6.8210 6.8210 6.8299 6.8299 7.0392 7.0392 7.0468 7.0468 7.3002 7.3002 7.3185 7.3185 7.4206 7.4206 7.4218 7.4218 7.6949 7.6949 7.6980 7.6980 7.7302 7.7302 7.7468 7.7468 7.9591 7.9591 7.9695 7.9695 8.8039 8.8039 8.8047 8.8047 9.3132 9.3132 9.3197 9.3197 9.8150 9.8150 9.8236 9.8236 k = 0.1800-0.0000 0.3660 ( 12372 PWs) bands (ev): -1.7024 -1.7024 -1.7023 -1.7023 0.5826 0.5826 0.5828 0.5828 1.7375 1.7375 1.7376 1.7376 1.9699 1.9699 1.9708 1.9708 2.1942 2.1942 2.1944 2.1944 3.0491 3.0491 3.0497 3.0497 3.7738 3.7738 3.7739 3.7739 4.0002 4.0002 4.0005 4.0005 4.4260 4.4260 4.4265 4.4265 4.9171 4.9171 4.9182 4.9182 5.4187 5.4187 5.4200 5.4200 5.8069 5.8069 5.8163 5.8163 5.8957 5.8957 5.9026 5.9026 6.2318 6.2318 6.2321 6.2321 6.5359 6.5359 6.5406 6.5406 6.7231 6.7231 6.7343 6.7343 6.8248 6.8248 6.8327 6.8327 7.0472 7.0472 7.0545 7.0545 7.3161 7.3161 7.3359 7.3359 7.4102 7.4102 7.4132 7.4132 7.7162 7.7162 7.7221 7.7221 7.7501 7.7501 7.7641 7.7641 7.9693 7.9693 7.9800 7.9800 8.8302 8.8302 8.8311 8.8311 9.2929 9.2929 9.2998 9.2998 9.7755 9.7755 9.7836 9.7836 k = 0.2000-0.0000 0.3660 ( 12378 PWs) bands (ev): -1.6748 -1.6748 -1.6747 -1.6747 0.4723 0.4723 0.4725 0.4725 1.7625 1.7625 1.7626 1.7626 1.9942 1.9942 1.9950 1.9950 2.2201 2.2201 2.2203 2.2203 3.1793 3.1793 3.1797 3.1797 3.6952 3.6952 3.6953 3.6953 3.9077 3.9077 3.9080 3.9080 4.3462 4.3462 4.3466 4.3466 4.9276 4.9276 4.9285 4.9285 5.4544 5.4544 5.4554 5.4554 5.8629 5.8629 5.8757 5.8757 5.9204 5.9204 5.9302 5.9302 6.2608 6.2608 6.2617 6.2617 6.5515 6.5515 6.5562 6.5562 6.7221 6.7221 6.7331 6.7331 6.8284 6.8284 6.8353 6.8353 7.0526 7.0526 7.0592 7.0592 7.3338 7.3338 7.3550 7.3550 7.3997 7.3997 7.4049 7.4049 7.7282 7.7282 7.7387 7.7387 7.7814 7.7814 7.7904 7.7904 7.9829 7.9829 7.9935 7.9935 8.8604 8.8604 8.8614 8.8614 9.2821 9.2821 9.2892 9.2892 9.7396 9.7396 9.7470 9.7470 k = 0.2200-0.0000 0.3660 ( 12376 PWs) bands (ev): -1.6443 -1.6443 -1.6443 -1.6443 0.3639 0.3639 0.3640 0.3640 1.7901 1.7901 1.7902 1.7902 2.0209 2.0209 2.0218 2.0218 2.2484 2.2484 2.2487 2.2487 3.2944 3.2944 3.2947 3.2947 3.6279 3.6279 3.6280 3.6280 3.8169 3.8169 3.8170 3.8170 4.2692 4.2692 4.2695 4.2695 4.9425 4.9425 4.9432 4.9432 5.4863 5.4863 5.4870 5.4870 5.9001 5.9001 5.9162 5.9162 5.9486 5.9486 5.9617 5.9617 6.2931 6.2931 6.2947 6.2947 6.5658 6.5658 6.5705 6.5705 6.7213 6.7213 6.7320 6.7320 6.8318 6.8318 6.8378 6.8378 7.0552 7.0552 7.0608 7.0608 7.3491 7.3491 7.3700 7.3700 7.3940 7.3940 7.3999 7.3999 7.7378 7.7378 7.7510 7.7510 7.8144 7.8144 7.8197 7.8197 8.0011 8.0011 8.0109 8.0109 8.8945 8.8945 8.8955 8.8955 9.2815 9.2815 9.2885 9.2885 9.7083 9.7083 9.7148 9.7148 k = 0.2400-0.0000 0.3660 ( 12374 PWs) bands (ev): -1.6110 -1.6110 -1.6109 -1.6109 0.2576 0.2576 0.2577 0.2577 1.8202 1.8202 1.8203 1.8203 2.0501 2.0501 2.0510 2.0510 2.2791 2.2791 2.2795 2.2795 3.3641 3.3641 3.3642 3.3642 3.5962 3.5962 3.5964 3.5964 3.7290 3.7290 3.7295 3.7295 4.2010 4.2010 4.2012 4.2012 4.9609 4.9609 4.9614 4.9614 5.5145 5.5145 5.5150 5.5150 5.9112 5.9112 5.9234 5.9234 5.9940 5.9940 6.0037 6.0037 6.3298 6.3298 6.3313 6.3313 6.5769 6.5769 6.5820 6.5820 6.7206 6.7206 6.7312 6.7312 6.8350 6.8350 6.8402 6.8402 7.0552 7.0552 7.0597 7.0597 7.3539 7.3539 7.3657 7.3657 7.4053 7.4053 7.4073 7.4073 7.7477 7.7477 7.7621 7.7621 7.8436 7.8436 7.8458 7.8458 8.0238 8.0238 8.0323 8.0323 8.9324 8.9324 8.9333 8.9333 9.2909 9.2909 9.2975 9.2975 9.6830 9.6830 9.6883 9.6883 k = 0.2600-0.0000 0.3660 ( 12370 PWs) bands (ev): -1.5748 -1.5748 -1.5747 -1.5747 0.1535 0.1535 0.1536 0.1536 1.8529 1.8529 1.8530 1.8530 2.0817 2.0817 2.0827 2.0827 2.3122 2.3122 2.3126 2.3126 3.3507 3.3507 3.3510 3.3510 3.6075 3.6075 3.6097 3.6097 3.6628 3.6628 3.6652 3.6652 4.1530 4.1530 4.1530 4.1530 4.9821 4.9821 4.9825 4.9825 5.5393 5.5393 5.5397 5.5397 5.9057 5.9057 5.9157 5.9157 6.0397 6.0397 6.0481 6.0481 6.3694 6.3694 6.3701 6.3701 6.5838 6.5838 6.5894 6.5894 6.7203 6.7203 6.7310 6.7310 6.8381 6.8381 6.8425 6.8425 7.0529 7.0529 7.0565 7.0565 7.3471 7.3471 7.3530 7.3530 7.4208 7.4208 7.4276 7.4276 7.7583 7.7583 7.7734 7.7734 7.8664 7.8664 7.8668 7.8668 8.0494 8.0494 8.0565 8.0565 8.9738 8.9738 8.9746 8.9746 9.3100 9.3100 9.3157 9.3157 9.6655 9.6655 9.6691 9.6691 k = 0.2800-0.0000 0.3660 ( 12370 PWs) bands (ev): -1.5357 -1.5357 -1.5357 -1.5357 0.0518 0.0518 0.0519 0.0519 1.8881 1.8881 1.8881 1.8881 2.1157 2.1157 2.1167 2.1167 2.3474 2.3474 2.3479 2.3479 3.2911 3.2911 3.2914 3.2914 3.5429 3.5429 3.5441 3.5441 3.6856 3.6856 3.6868 3.6868 4.1450 4.1450 4.1453 4.1453 5.0057 5.0057 5.0059 5.0059 5.5607 5.5607 5.5610 5.5610 5.8909 5.8909 5.8999 5.8999 6.0813 6.0813 6.0898 6.0898 6.4089 6.4089 6.4096 6.4096 6.5857 6.5857 6.5922 6.5922 6.7209 6.7209 6.7317 6.7317 6.8410 6.8410 6.8447 6.8447 7.0491 7.0491 7.0519 7.0519 7.3351 7.3351 7.3384 7.3384 7.4386 7.4386 7.4470 7.4470 7.7696 7.7696 7.7850 7.7850 7.8813 7.8813 7.8835 7.8835 8.0742 8.0742 8.0803 8.0803 9.0176 9.0176 9.0184 9.0184 9.3375 9.3375 9.3417 9.3417 9.6587 9.6587 9.6599 9.6599 k = 0.3000-0.0000 0.3660 ( 12364 PWs) bands (ev): -1.4939 -1.4939 -1.4939 -1.4939 -0.0474 -0.0474 -0.0473 -0.0473 1.9257 1.9257 1.9258 1.9258 2.1519 2.1519 2.1530 2.1530 2.3845 2.3845 2.3852 2.3852 3.2193 3.2193 3.2197 3.2197 3.4612 3.4612 3.4619 3.4619 3.6853 3.6853 3.6857 3.6857 4.1935 4.1935 4.1942 4.1942 5.0313 5.0313 5.0314 5.0314 5.5784 5.5784 5.5786 5.5786 5.8705 5.8705 5.8788 5.8788 6.1183 6.1183 6.1273 6.1273 6.4455 6.4455 6.4482 6.4482 6.5823 6.5823 6.5900 6.5900 6.7228 6.7228 6.7336 6.7336 6.8436 6.8436 6.8467 6.8467 7.0445 7.0445 7.0468 7.0468 7.3209 7.3209 7.3230 7.3230 7.4545 7.4545 7.4639 7.4639 7.7813 7.7813 7.7969 7.7969 7.8918 7.8918 7.8951 7.8951 8.0946 8.0946 8.0999 8.0999 9.0618 9.0618 9.0626 9.0626 9.3716 9.3716 9.3741 9.3741 9.6653 9.6653 9.6668 9.6668 k = 0.3200-0.0000 0.3660 ( 12368 PWs) bands (ev): -1.4493 -1.4493 -1.4493 -1.4493 -0.1440 -0.1440 -0.1439 -0.1439 1.9657 1.9657 1.9658 1.9658 2.1903 2.1903 2.1915 2.1915 2.4232 2.4232 2.4240 2.4240 3.1451 3.1451 3.1455 3.1455 3.3802 3.3802 3.3807 3.3807 3.6464 3.6464 3.6465 3.6465 4.2870 4.2870 4.2881 4.2881 5.0588 5.0588 5.0590 5.0590 5.5917 5.5917 5.5919 5.5919 5.8471 5.8471 5.8548 5.8548 6.1503 6.1503 6.1599 6.1599 6.4777 6.4777 6.4831 6.4831 6.5743 6.5743 6.5838 6.5838 6.7262 6.7262 6.7369 6.7369 6.8457 6.8457 6.8482 6.8482 7.0397 7.0397 7.0418 7.0418 7.3054 7.3054 7.3066 7.3066 7.4667 7.4667 7.4771 7.4771 7.7926 7.7926 7.8083 7.8083 7.8993 7.8993 7.9030 7.9030 8.1077 8.1077 8.1126 8.1126 9.1025 9.1025 9.1035 9.1035 9.4117 9.4117 9.4128 9.4128 9.6899 9.6899 9.6941 9.6941 k = 0.3400-0.0000 0.3660 ( 12366 PWs) bands (ev): -1.4020 -1.4020 -1.4020 -1.4020 -0.2380 -0.2380 -0.2379 -0.2379 2.0080 2.0080 2.0081 2.0081 2.2307 2.2307 2.2320 2.2320 2.4629 2.4629 2.4639 2.4639 3.0715 3.0715 3.0720 3.0720 3.3015 3.3015 3.3019 3.3019 3.5869 3.5869 3.5870 3.5870 4.4032 4.4032 4.4046 4.4046 5.0879 5.0879 5.0883 5.0883 5.5997 5.5997 5.5999 5.5999 5.8226 5.8226 5.8298 5.8298 6.1774 6.1774 6.1873 6.1873 6.5020 6.5020 6.5110 6.5110 6.5645 6.5645 6.5765 6.5765 6.7312 6.7312 6.7415 6.7415 6.8470 6.8470 6.8491 6.8491 7.0355 7.0355 7.0377 7.0377 7.2887 7.2887 7.2894 7.2894 7.4744 7.4744 7.4862 7.4862 7.8026 7.8026 7.8184 7.8184 7.9052 7.9052 7.9088 7.9088 8.1127 8.1127 8.1175 8.1175 9.1353 9.1353 9.1366 9.1366 9.4597 9.4597 9.4601 9.4601 9.7364 9.7364 9.7423 9.7423 k = 0.3600-0.0000 0.3660 ( 12366 PWs) bands (ev): -1.3520 -1.3520 -1.3520 -1.3520 -0.3292 -0.3292 -0.3291 -0.3291 2.0525 2.0525 2.0526 2.0526 2.2729 2.2729 2.2743 2.2743 2.5026 2.5026 2.5038 2.5038 3.0004 3.0004 3.0010 3.0010 3.2261 3.2261 3.2264 3.2264 3.5187 3.5187 3.5189 3.5189 4.5282 4.5282 4.5298 4.5298 5.1186 5.1186 5.1193 5.1193 5.6011 5.6011 5.6014 5.6014 5.7987 5.7987 5.8052 5.8052 6.1997 6.1997 6.2096 6.2096 6.5113 6.5113 6.5199 6.5199 6.5648 6.5648 6.5757 6.5757 6.7376 6.7376 6.7473 6.7473 6.8476 6.8476 6.8492 6.8492 7.0323 7.0323 7.0350 7.0350 7.2707 7.2707 7.2711 7.2711 7.4773 7.4773 7.4912 7.4912 7.8099 7.8099 7.8259 7.8259 7.9108 7.9108 7.9139 7.9139 8.1107 8.1107 8.1153 8.1153 9.1575 9.1575 9.1589 9.1589 9.5188 9.5188 9.5192 9.5192 9.8036 9.8036 9.8102 9.8102 k = 0.3800-0.0000 0.3660 ( 12348 PWs) bands (ev): -1.2995 -1.2995 -1.2995 -1.2995 -0.4175 -0.4175 -0.4174 -0.4174 2.0992 2.0992 2.0993 2.0993 2.3163 2.3163 2.3179 2.3179 2.5404 2.5404 2.5420 2.5420 2.9336 2.9336 2.9344 2.9344 3.1549 3.1549 3.1550 3.1550 3.4474 3.4474 3.4477 3.4477 4.6543 4.6543 4.6563 4.6563 5.1508 5.1508 5.1520 5.1520 5.5950 5.5950 5.5957 5.5957 5.7760 5.7760 5.7819 5.7819 6.2171 6.2171 6.2264 6.2264 6.5026 6.5026 6.5057 6.5057 6.5803 6.5803 6.5855 6.5855 6.7452 6.7452 6.7542 6.7542 6.8471 6.8471 6.8482 6.8482 7.0307 7.0307 7.0344 7.0344 7.2514 7.2514 7.2517 7.2517 7.4761 7.4761 7.4923 7.4923 7.8137 7.8137 7.8301 7.8301 7.9173 7.9173 7.9195 7.9195 8.1039 8.1039 8.1083 8.1083 9.1700 9.1700 9.1714 9.1714 9.5892 9.5892 9.5901 9.5901 9.8882 9.8882 9.8944 9.8944 k = 0.4000-0.0000 0.3660 ( 12342 PWs) bands (ev): -1.2447 -1.2447 -1.2447 -1.2447 -0.5027 -0.5027 -0.5026 -0.5026 2.1478 2.1478 2.1479 2.1479 2.3600 2.3600 2.3618 2.3618 2.5733 2.5733 2.5754 2.5754 2.8736 2.8736 2.8748 2.8748 3.0896 3.0896 3.0897 3.0897 3.3759 3.3759 3.3763 3.3763 4.7765 4.7765 4.7788 4.7788 5.1849 5.1849 5.1866 5.1866 5.5813 5.5813 5.5824 5.5824 5.7545 5.7545 5.7596 5.7596 6.2297 6.2297 6.2380 6.2380 6.4843 6.4843 6.4850 6.4850 6.5968 6.5968 6.5985 6.5985 6.7537 6.7537 6.7621 6.7621 6.8454 6.8454 6.8461 6.8461 7.0309 7.0309 7.0361 7.0361 7.2308 7.2308 7.2315 7.2315 7.4715 7.4715 7.4904 7.4904 7.8139 7.8139 7.8309 7.8309 7.9248 7.9248 7.9261 7.9261 8.0947 8.0947 8.0990 8.0990 9.1758 9.1758 9.1771 9.1771 9.6676 9.6676 9.6692 9.6692 9.9865 9.9865 9.9919 9.9919 k = 0.4200-0.0000 0.3660 ( 12350 PWs) bands (ev): -1.1879 -1.1879 -1.1878 -1.1878 -0.5844 -0.5844 -0.5843 -0.5843 2.1980 2.1980 2.1981 2.1981 2.4020 2.4020 2.4041 2.4041 2.5961 2.5961 2.5988 2.5988 2.8243 2.8243 2.8257 2.8257 3.0339 3.0339 3.0340 3.0340 3.3061 3.3061 3.3066 3.3066 4.8897 4.8897 4.8926 4.8926 5.2215 5.2215 5.2238 5.2238 5.5612 5.5612 5.5624 5.5624 5.7325 5.7325 5.7370 5.7370 6.2377 6.2377 6.2442 6.2442 6.4622 6.4622 6.4658 6.4658 6.6102 6.6102 6.6102 6.6102 6.7627 6.7627 6.7705 6.7705 6.8425 6.8425 6.8427 6.8427 7.0329 7.0329 7.0403 7.0403 7.2094 7.2094 7.2111 7.2111 7.4650 7.4650 7.4865 7.4865 7.8117 7.8117 7.8294 7.8294 7.9329 7.9329 7.9334 7.9334 8.0851 8.0851 8.0893 8.0893 9.1779 9.1779 9.1791 9.1791 9.7484 9.7484 9.7510 9.7510 10.0958 10.0958 10.0999 10.0999 k = 0.4400-0.0000 0.3660 ( 12338 PWs) bands (ev): -1.1298 -1.1298 -1.1298 -1.1298 -0.6618 -0.6618 -0.6617 -0.6617 2.2495 2.2495 2.2497 2.2497 2.4371 2.4371 2.4395 2.4395 2.6052 2.6052 2.6084 2.6084 2.7874 2.7874 2.7888 2.7888 2.9944 2.9944 2.9945 2.9945 3.2396 3.2396 3.2402 3.2402 4.9877 4.9877 4.9913 4.9913 5.2623 5.2623 5.2652 5.2652 5.5361 5.5361 5.5370 5.5370 5.7088 5.7088 5.7131 5.7131 6.2416 6.2416 6.2459 6.2459 6.4426 6.4426 6.4489 6.4489 6.6192 6.6192 6.6200 6.6200 6.7718 6.7718 6.7791 6.7791 6.8384 6.8384 6.8386 6.8386 7.0366 7.0366 7.0467 7.0467 7.1881 7.1881 7.1916 7.1916 7.4582 7.4582 7.4819 7.4819 7.8084 7.8084 7.8269 7.8269 7.9404 7.9404 7.9406 7.9406 8.0765 8.0765 8.0806 8.0806 9.1783 9.1783 9.1793 9.1793 9.8252 9.8252 9.8288 9.8288 10.2137 10.2137 10.2160 10.2160 k = 0.4600-0.0000 0.3660 ( 12330 PWs) bands (ev): -1.0725 -1.0725 -1.0725 -1.0725 -0.7329 -0.7329 -0.7328 -0.7328 2.3014 2.3014 2.3017 2.3017 2.4532 2.4532 2.4553 2.4553 2.6115 2.6115 2.6142 2.6142 2.7557 2.7557 2.7565 2.7565 2.9795 2.9795 2.9796 2.9796 3.1787 3.1787 3.1795 3.1795 5.0628 5.0628 5.0670 5.0670 5.3092 5.3092 5.3125 5.3125 5.5067 5.5067 5.5067 5.5067 5.6843 5.6843 5.6889 5.6889 6.2425 6.2425 6.2445 6.2445 6.4276 6.4276 6.4363 6.4363 6.6254 6.6254 6.6265 6.6265 6.7801 6.7801 6.7871 6.7871 6.8335 6.8335 6.8342 6.8342 7.0411 7.0411 7.0546 7.0546 7.1687 7.1687 7.1748 7.1748 7.4524 7.4524 7.4777 7.4777 7.8053 7.8053 7.8244 7.8244 7.9463 7.9463 7.9469 7.9469 8.0699 8.0699 8.0739 8.0739 9.1780 9.1780 9.1790 9.1790 9.8901 9.8901 9.8946 9.8946 10.3374 10.3374 10.3375 10.3375 k = 0.4800-0.0000 0.3660 ( 12330 PWs) bands (ev): -1.0220 -1.0220 -1.0220 -1.0220 -0.7917 -0.7917 -0.7916 -0.7916 2.3524 2.3524 2.3529 2.3529 2.4389 2.4389 2.4400 2.4400 2.6333 2.6333 2.6345 2.6345 2.7200 2.7200 2.7202 2.7202 2.9877 2.9877 2.9878 2.9878 3.1288 3.1288 3.1297 3.1297 5.1089 5.1089 5.1132 5.1132 5.3610 5.3610 5.3634 5.3634 5.4710 5.4710 5.4729 5.4729 5.6639 5.6639 5.6691 5.6691 6.2419 6.2419 6.2423 6.2423 6.4185 6.4185 6.4288 6.4288 6.6289 6.6289 6.6301 6.6301 6.7865 6.7865 6.7933 6.7933 6.8292 6.8292 6.8302 6.8302 7.0450 7.0450 7.0619 7.0619 7.1539 7.1539 7.1630 7.1630 7.4485 7.4485 7.4748 7.4748 7.8032 7.8032 7.8227 7.8227 7.9503 7.9503 7.9510 7.9510 8.0656 8.0656 8.0697 8.0697 9.1777 9.1777 9.1786 9.1786 9.9342 9.9342 9.9394 9.9394 10.4582 10.4582 10.4610 10.4610 k = 0.5000-0.0000 0.3660 ( 12324 PWs) bands (ev): -0.9981 -0.9981 -0.9980 -0.9980 -0.8185 -0.8185 -0.8183 -0.8183 2.3929 2.3929 2.3948 2.3948 2.4079 2.4079 2.4084 2.4084 2.6576 2.6576 2.6581 2.6581 2.6914 2.6914 2.6930 2.6930 2.9976 2.9976 2.9977 2.9977 3.1061 3.1061 3.1071 3.1071 5.1241 5.1241 5.1285 5.1285 5.3972 5.3972 5.3974 5.3974 5.4418 5.4418 5.4464 5.4464 5.6557 5.6557 5.6613 5.6613 6.2413 6.2413 6.2415 6.2415 6.4155 6.4155 6.4263 6.4263 6.6301 6.6301 6.6313 6.6313 6.7891 6.7891 6.7958 6.7958 6.8274 6.8274 6.8285 6.8285 7.0466 7.0466 7.0651 7.0651 7.1482 7.1482 7.1587 7.1587 7.4471 7.4471 7.4737 7.4737 7.8024 7.8024 7.8222 7.8222 7.9516 7.9516 7.9525 7.9525 8.0642 8.0642 8.0682 8.0682 9.1775 9.1775 9.1784 9.1784 9.9499 9.9499 9.9555 9.9555 10.5396 10.5396 10.5441 10.5441 Writing output data file Al9Fe2.save init_run : 1.96s CPU 1.25s WALL ( 1 calls) electrons : 944.18s CPU 802.09s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.05s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 944.17s CPU 802.08s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.95s CPU 0.55s WALL ( 1 calls) Called by c_bands: init_us_2 : 1.10s CPU 0.84s WALL ( 210 calls) cegterg : 772.13s CPU 683.11s WALL ( 317 calls) Called by sum_band: Called by *egterg: h_psi : 569.42s CPU 424.44s WALL ( 5265 calls) s_psi : 87.04s CPU 87.26s WALL ( 5265 calls) g_psi : 1.26s CPU 1.21s WALL ( 4738 calls) cdiaghg : 151.61s CPU 153.60s WALL ( 4948 calls) cegterg:over : 40.38s CPU 40.25s WALL ( 4738 calls) cegterg:upda : 34.59s CPU 34.93s WALL ( 4738 calls) cegterg:last : 21.70s CPU 21.64s WALL ( 981 calls) cdiaghg:chol : 9.14s CPU 9.45s WALL ( 4948 calls) cdiaghg:inve : 6.99s CPU 7.05s WALL ( 4948 calls) cdiaghg:para : 12.41s CPU 12.95s WALL ( 9896 calls) Called by h_psi: h_psi:vloc : 376.23s CPU 246.42s WALL ( 5265 calls) h_psi:vnl : 191.58s CPU 176.53s WALL ( 5265 calls) add_vuspsi : 100.12s CPU 94.77s WALL ( 5265 calls) General routines calbec : 91.42s CPU 81.74s WALL ( 5265 calls) fft : 0.06s CPU 0.04s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 358.57s CPU 230.67s WALL ( 1372652 calls) interpolate : 0.02s CPU 0.02s WALL ( 4 calls) davcio : 0.56s CPU 2.65s WALL ( 420 calls) Parallel routines fft_scatter : 100.75s CPU 88.76s WALL ( 1372675 calls) PWSCF : 16m27.42s CPU 14m35.02s WALL This run was terminated on: 19: 4:35 3Aug2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=